*HEADER    UNKNOWN FUNCTION                        13-JUN-16   5KGQ              
*TITLE     NMR STRUCTURE AND DYNAMICS OF Q4DY78, A CONSERVED KINETOPLASID-       
*TITLE    2 SPECIFIC PROTEIN FROM TRYPANOSOMA CRUZI                              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UNCHARACTERIZED PROTEIN;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: TRYPANOSOMA CRUZI;                              
*SOURCE   3 ORGANISM_TAXID: 5693;                                                
*SOURCE   4 STRAIN: CL BRENER;                                                   
*SOURCE   5 GENE: TC00.1047053511907.89;                                         
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) STAR;                            
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PGEX-4T2                                  
*KEYWDS    HYPOTHETICAL PROTEIN, CONSERVED, UNKNOWN FUNCTION                     
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    E.D.D'ANDREA,J.S.RETEL,A.DIEHL,P.SCHMIEDER,H.OSCHKINAT,J.R.PIRES      
*REVDAT   1   05-JUL-17 5KGQ    0                                                
# Restraints file 1: hyp13_hbonds_talos.tbl
!helice 1
assign ( residue   16 and name HN  ) ( residue   12  and name O )  1.80  0.00  0.50
assign ( residue   16 and name N  )  ( residue   12  and name O )  2.80  0.00  0.50
assign ( residue   17 and name HN  ) ( residue   13  and name O )  1.80  0.00  0.50
assign ( residue   17 and name N  )  ( residue   13  and name O )  2.80  0.00  0.50
assign ( residue   18 and name HN  ) ( residue   14  and name O )  1.80  0.00  0.50
assign ( residue   18 and name N  )  ( residue   14  and name O )  2.80  0.00  0.50
assign ( residue   19 and name HN  ) ( residue   15  and name O )  1.80  0.00  0.50
assign ( residue   19 and name N  )  ( residue   15  and name O )  2.80  0.00  0.50
assign ( residue   20 and name HN  ) ( residue   16  and name O )  1.80  0.00  0.50
assign ( residue   20 and name N  )  ( residue   16  and name O )  2.80  0.00  0.50
assign ( residue   21 and name HN  ) ( residue   17  and name O )  1.80  0.00  0.50
assign ( residue   21 and name N  )  ( residue   17  and name O )  2.80  0.00  0.50
assign ( residue   22 and name HN  ) ( residue   18  and name O )  1.80  0.00  0.50
assign ( residue   22 and name N  )  ( residue   18  and name O )  2.80  0.00  0.50
assign ( residue   23 and name HN  ) ( residue   19  and name O )  1.80  0.00  0.50
assign ( residue   23 and name N  )  ( residue   19  and name O )  2.80  0.00  0.50
assign ( residue   24 and name HN  ) ( residue   20  and name O )  1.80  0.00  0.50
assign ( residue   24 and name N  )  ( residue   20  and name O )  2.80  0.00  0.50
assign ( residue   25 and name HN  ) ( residue   21  and name O )  1.80  0.00  0.50
assign ( residue   25 and name N  )  ( residue   21  and name O )  2.80  0.00  0.50
assign ( residue   26 and name HN  ) ( residue   22  and name O )  1.80  0.00  0.50
assign ( residue   26 and name N  )  ( residue   22  and name O )  2.80  0.00  0.50
assign ( residue   27 and name HN  ) ( residue   23  and name O )  1.80  0.00  0.50
assign ( residue   27 and name N  )  ( residue   23  and name O )  2.80  0.00  0.50
!helice 2
assign ( residue   38 and name HN  ) ( residue   34  and name O )  1.80  0.00  0.50
assign ( residue   38 and name N  )  ( residue   34  and name O )  2.80  0.00  0.50
assign ( residue   39 and name HN  ) ( residue   35  and name O )  1.80  0.00  0.50
assign ( residue   39 and name N  )  ( residue   35  and name O )  2.80  0.00  0.50
assign ( residue   40 and name HN  ) ( residue   36  and name O )  1.80  0.00  0.50
assign ( residue   40 and name N  )  ( residue   36  and name O )  2.80  0.00  0.50
assign ( residue   41 and name HN  ) ( residue   37  and name O )  1.80  0.00  0.50
assign ( residue   41 and name N  )  ( residue   37  and name O )  2.80  0.00  0.50
assign ( residue   42 and name HN  ) ( residue   38  and name O )  1.80  0.00  0.50
assign ( residue   42 and name N  )  ( residue   38  and name O )  2.80  0.00  0.50
assign ( residue   43 and name HN  ) ( residue   39  and name O )  1.80  0.00  0.50
assign ( residue   43 and name N  )  ( residue   39  and name O )  2.80  0.00  0.50
!helice 3
assign ( residue   54 and name HN  ) ( residue   50  and name O )  1.80  0.00  0.50
assign ( residue   54 and name N  )  ( residue   50  and name O )  2.80  0.00  0.50
assign ( residue   55 and name HN  ) ( residue   51  and name O )  1.80  0.00  0.50
assign ( residue   55 and name N  )  ( residue   51  and name O )  2.80  0.00  0.50
assign ( residue   56 and name HN  ) ( residue   52  and name O )  1.80  0.00  0.50
assign ( residue   56 and name N  )  ( residue   52  and name O )  2.80  0.00  0.50
assign ( residue   57 and name HN  ) ( residue   53  and name O )  1.80  0.00  0.50
assign ( residue   57 and name N  )  ( residue   53  and name O )  2.80  0.00  0.50
!helice 4
assign ( residue   72 and name HN  ) ( residue   68  and name O )  1.80  0.00  0.50
assign ( residue   72 and name N  )  ( residue   68  and name O )  2.80  0.00  0.50
assign ( residue   73 and name HN  ) ( residue   69  and name O )  1.80  0.00  0.50
assign ( residue   73 and name N  )  ( residue   69  and name O )  2.80  0.00  0.50
assign ( residue   74 and name HN  ) ( residue   70  and name O )  1.80  0.00  0.50
assign ( residue   74 and name N  )  ( residue   70  and name O )  2.80  0.00  0.50
assign ( residue   75 and name HN  ) ( residue   71  and name O )  1.80  0.00  0.50
assign ( residue   75 and name N  )  ( residue   71  and name O )  2.80  0.00  0.50
assign ( residue   76 and name HN  ) ( residue   72  and name O )  1.80  0.00  0.50
assign ( residue   76 and name N  )  ( residue   72  and name O )  2.80  0.00  0.50
!helice 5
assign ( residue   83 and name HN  ) ( residue   79  and name O )  1.80  0.00  0.50
assign ( residue   83 and name N  )  ( residue   79  and name O )  2.80  0.00  0.50
assign ( residue   84 and name HN  ) ( residue   80  and name O )  1.80  0.00  0.50
assign ( residue   84 and name N  )  ( residue   80  and name O )  2.80  0.00  0.50
assign ( residue   85 and name HN  ) ( residue   81  and name O )  1.80  0.00  0.50
assign ( residue   85 and name N  )  ( residue   81  and name O )  2.80  0.00  0.50
assign ( residue   86 and name HN  ) ( residue   82  and name O )  1.80  0.00  0.50
assign ( residue   86 and name N  )  ( residue   82  and name O )  2.80  0.00  0.50
assign ( residue   87 and name HN  ) ( residue   83  and name O )  1.80  0.00  0.50
assign ( residue   87 and name N  )  ( residue   83  and name O )  2.80  0.00  0.50
assign ( residue   88 and name HN  ) ( residue   84  and name O )  1.80  0.00  0.50
assign ( residue   88 and name N  )  ( residue   84  and name O )  2.80  0.00  0.50
# Restraints file 2: unambig.tbl
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   55 and name  HG1) 1.278 0.204 0.204 weight 1.000 ! spec=13C_NOESY, no=1, id=2411, vol=3.920000e+09
assign (segid "   A" and resid   51 and name  HG2) (segid "   A" and resid   51 and name  HG1) 1.374 0.236 0.236 weight 1.000 ! spec=13C_NOESY, no=5, id=2415, vol=2.360000e+09
assign (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid  102 and name  HB1) 1.394 0.243 0.243 weight 1.000 ! spec=13C_NOESY, no=6, id=2416, vol=2.130000e+09
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   26 and name  HB2) 1.689 0.357 0.357 weight 1.000 ! spec=13C_NOESY, no=19, id=2428, vol=8.230000e+08
    or (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   41 and name HG22) 1.885 0.444 0.444 weight 1.000 ! spec=13C_NOESY, no=26, id=2435, vol=6.710000e+08
    or (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name  HB1) 1.697 0.360 0.360 weight 1.000 ! spec=13C_NOESY, no=27, id=2436, vol=6.590000e+08
assign (segid "   A" and resid  101 and name HG11) (segid "   A" and resid  101 and name HG12) 1.576 0.310 0.310 weight 1.000 ! spec=13C_NOESY, no=29, id=2438, vol=6.130000e+08
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   32 and name HG12) 1.834 0.420 0.420 weight 1.000 ! spec=13C_NOESY, no=40, id=2447, vol=4.940000e+08
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   37 and name HG22) 2.210 0.611 0.611 weight 1.000 ! spec=13C_NOESY, no=42, id=2449, vol=4.930000e+08
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   37 and name HG23)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   37 and name HG23)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   19 and name  HE2) (segid "   A" and resid   19 and name  HD2) 1.884 0.444 0.444 weight 1.000 ! spec=13C_NOESY, no=47, id=2454, vol=4.180000e+08
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   85 and name HD12) 1.935 0.468 0.468 weight 1.000 ! spec=13C_NOESY, no=48, id=2455, vol=4.090000e+08
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name  HB2) 1.926 0.463 0.463 weight 1.000 ! spec=13C_NOESY, no=49, id=2456, vol=4.010000e+08
assign (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   37 and name HG12) 1.656 0.343 0.343 weight 1.000 ! spec=13C_NOESY, no=51, id=2457, vol=3.880000e+08
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name  HB1) 1.784 0.398 0.398 weight 1.000 ! spec=13C_NOESY, no=53, id=2459, vol=3.730000e+08
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name  HB1) 1.809 0.409 0.409 weight 1.000 ! spec=13C_NOESY, no=55, id=2461, vol=3.630000e+08
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name  HB2) 1.764 0.389 0.389 weight 1.000 ! spec=13C_NOESY, no=56, id=2462, vol=3.470000e+08
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HB2) 2.143 0.574 0.574 weight 1.000 ! spec=13C_NOESY, no=59, id=2465, vol=3.420000e+08
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name  HB3)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG22) 1.945 0.473 0.473 weight 1.000 ! spec=13C_NOESY, no=60, id=2466, vol=3.350000e+08
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name  HE2) 1.963 0.482 0.482 weight 1.000 ! spec=13C_NOESY, no=64, id=2470, vol=3.290000e+08
assign (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HD12) 1.940 0.470 0.470 weight 1.000 ! spec=13C_NOESY, no=67, id=2473, vol=3.210000e+08
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   10 and name HG22) 2.064 0.533 0.533 weight 1.000 ! spec=13C_NOESY, no=69, id=2475, vol=3.150000e+08
    or (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   10 and name HG23)
assign (segid "   A" and resid   28 and name  HA1) (segid "   A" and resid   28 and name  HA2) 1.868 0.436 0.436 weight 1.000 ! spec=13C_NOESY, no=70, id=2476, vol=3.110000e+08
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   68 and name  HB2) 1.843 0.424 0.424 weight 1.000 ! spec=13C_NOESY, no=71, id=2477, vol=3.090000e+08
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG22) 2.032 0.516 0.516 weight 1.000 ! spec=13C_NOESY, no=72, id=2478, vol=3.080000e+08
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid   59 and name  HA1) (segid "   A" and resid   59 and name  HA2) 2.000 0.500 0.500 weight 1.000 ! spec=13C_NOESY, no=73, id=2479, vol=3.030000e+08
assign (segid "   A" and resid   31 and name  HD2) (segid "   A" and resid   31 and name  HG1) 2.108 0.556 0.556 weight 1.000 ! spec=13C_NOESY, no=74, id=2480, vol=3.010000e+08
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   41 and name HD12) 1.948 0.474 0.474 weight 1.000 ! spec=13C_NOESY, no=80, id=2486, vol=2.900000e+08
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   41 and name HD12)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   41 and name HD12)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   40 and name HD22) 1.968 0.484 0.484 weight 1.000 ! spec=13C_NOESY, no=85, id=2490, vol=2.840000e+08
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   40 and name HD23)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   40 and name HD23)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name HD12) 2.035 0.518 0.518 weight 1.000 ! spec=13C_NOESY, no=86, id=2491, vol=2.770000e+08
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name HD13)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name HD12)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name HD13)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name HD12)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name  HB2) 2.168 0.587 0.587 weight 1.000 ! spec=13C_NOESY, no=88, id=2493, vol=2.720000e+08
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   82 and name HG12) 2.072 0.536 0.536 weight 1.000 ! spec=13C_NOESY, no=89, id=2494, vol=2.710000e+08
    or (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   82 and name HG13)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   82 and name HG13)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   93 and name  HD1) 2.138 0.571 0.571 weight 1.000 ! spec=13C_NOESY, no=92, id=2497, vol=2.650000e+08
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   86 and name  HB2) 2.106 0.554 0.554 weight 1.000 ! spec=13C_NOESY, no=94, id=2499, vol=2.580000e+08
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   71 and name  HD1) 2.520 0.794 0.794 weight 1.000 ! spec=13C_NOESY, no=98, id=2503, vol=2.540000e+08
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   71 and name  HD1)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   71 and name  HD1)
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   93 and name  HD2) 2.315 0.670 0.670 weight 1.000 ! spec=13C_NOESY, no=104, id=2509, vol=2.490000e+08
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   40 and name HD12) 2.094 0.548 0.548 weight 1.000 ! spec=13C_NOESY, no=114, id=2518, vol=2.330000e+08
    or (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid   83 and name  HB2) 2.292 0.657 0.657 weight 1.000 ! spec=13C_NOESY, no=115, id=2519, vol=2.310000e+08
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   41 and name HD12) 2.216 0.614 0.614 weight 1.000 ! spec=13C_NOESY, no=116, id=2520, vol=2.310000e+08
    or (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   41 and name HD12)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   41 and name HD12)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   65 and name  HA2) 2.032 0.516 0.516 weight 1.000 ! spec=13C_NOESY, no=117, id=2521, vol=2.300000e+08
assign (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD22) 2.108 0.555 0.555 weight 1.000 ! spec=13C_NOESY, no=121, id=2525, vol=2.260000e+08
    or (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD21)
    or (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD23)
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HB2) 2.405 0.723 0.723 weight 1.000 ! spec=13C_NOESY, no=123, id=2527, vol=2.230000e+08
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name  HB1) 2.064 0.533 0.533 weight 1.000 ! spec=13C_NOESY, no=125, id=2529, vol=2.190000e+08
assign (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG12) 2.196 0.603 0.603 weight 1.000 ! spec=13C_NOESY, no=127, id=2531, vol=2.170000e+08
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG11)
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG13)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   71 and name   HZ) 2.451 0.751 0.751 weight 1.000 ! spec=13C_NOESY, no=129, id=2533, vol=2.080000e+08
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   71 and name   HZ)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   71 and name   HZ)
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name HD22) 2.283 0.651 0.651 weight 1.000 ! spec=13C_NOESY, no=134, id=2538, vol=2.060000e+08
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name HD21)
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name HD23)
assign (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   68 and name  HG2) 2.154 0.580 0.580 weight 1.000 ! spec=13C_NOESY, no=137, id=2541, vol=2.030000e+08
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   85 and name HD12) 2.576 0.829 0.829 weight 1.000 ! spec=13C_NOESY, no=139, id=2543, vol=2.030000e+08
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   32 and name HG12) 2.120 0.562 0.562 weight 1.000 ! spec=13C_NOESY, no=146, id=2550, vol=1.950000e+08
    or (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HD12) 2.188 0.598 0.598 weight 1.000 ! spec=13C_NOESY, no=147, id=2551, vol=1.920000e+08
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   39 and name  HB2) 2.380 0.708 0.708 weight 1.000 ! spec=13C_NOESY, no=148, id=2552, vol=1.920000e+08
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   91 and name  HB1) 1.877 0.440 0.440 weight 1.000 ! spec=13C_NOESY, no=149, id=2553, vol=1.910000e+08
assign (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   82 and name HG12) 2.429 0.737 0.737 weight 1.000 ! spec=13C_NOESY, no=151, id=2555, vol=1.900000e+08
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   19 and name  HE2) (segid "   A" and resid   19 and name  HG2) 2.151 0.579 0.579 weight 1.000 ! spec=13C_NOESY, no=152, id=2556, vol=1.900000e+08
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name HG12) 2.305 0.664 0.664 weight 1.000 ! spec=13C_NOESY, no=157, id=2561, vol=1.790000e+08
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name HG12)
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name  HB2) 2.390 0.714 0.714 weight 1.000 ! spec=13C_NOESY, no=161, id=2564, vol=1.760000e+08
    or (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name  HB1)
    or (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name  HB3)
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name  HB2) 2.438 0.743 0.743 weight 1.000 ! spec=13C_NOESY, no=167, id=2569, vol=1.710000e+08
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD12) 2.318 0.672 0.672 weight 1.000 ! spec=13C_NOESY, no=170, id=2572, vol=1.700000e+08
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   75 and name HG12) 2.240 0.627 0.627 weight 1.000 ! spec=13C_NOESY, no=176, id=2578, vol=1.650000e+08
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG22) 2.333 0.680 0.680 weight 1.000 ! spec=13C_NOESY, no=178, id=2580, vol=1.640000e+08
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG23)
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD22) 2.676 0.895 0.895 weight 1.000 ! spec=13C_NOESY, no=180, id=2582, vol=1.610000e+08
    or (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   86 and name  HB2) 2.749 0.945 0.945 weight 1.000 ! spec=13C_NOESY, no=181, id=2583, vol=1.610000e+08
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid   71 and name  HE1) (segid "   A" and resid   40 and name HD12) 2.798 0.979 0.979 weight 1.000 ! spec=13C_NOESY, no=183, id=2585, vol=1.590000e+08
    or (segid "   A" and resid   71 and name  HE1) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   71 and name  HE1) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD12) 2.320 0.673 0.673 weight 1.000 ! spec=13C_NOESY, no=184, id=2586, vol=1.580000e+08
    or (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD11)
    or (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD13)
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   79 and name  HG2) 2.636 0.869 0.869 weight 1.000 ! spec=13C_NOESY, no=185, id=2587, vol=1.580000e+08
assign (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   10 and name HG12) 2.235 0.624 0.624 weight 1.000 ! spec=13C_NOESY, no=189, id=2591, vol=1.570000e+08
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   10 and name HG12)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   10 and name HG12)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   85 and name HG22) 2.291 0.656 0.656 weight 1.000 ! spec=13C_NOESY, no=190, id=2592, vol=1.560000e+08
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   33 and name HG21) 2.348 0.689 0.689 weight 1.000 ! spec=13C_NOESY, no=192, id=2594, vol=1.550000e+08
    or (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   33 and name HG23)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name  HB2) 2.399 0.719 0.719 weight 1.000 ! spec=13C_NOESY, no=197, id=2598, vol=1.510000e+08
assign (segid "   A" and resid   31 and name  HE2) (segid "   A" and resid   67 and name  HB1) 3.100 1.201 1.201 weight 1.000 ! spec=13C_NOESY, no=200, id=2601, vol=1.480000e+08
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name  HG2) 2.940 1.081 1.081 weight 1.000 ! spec=13C_NOESY, no=201, id=2602, vol=1.470000e+08
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name   HN) 2.312 0.668 0.668 weight 1.000 ! spec=13C_NOESY, no=203, id=2604, vol=1.470000e+08
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   53 and name   HG) 2.647 0.876 0.876 weight 1.000 ! spec=13C_NOESY, no=212, id=2613, vol=1.410000e+08
assign (segid "   A" and resid    8 and name HG22) (segid "   A" and resid    9 and name  HG2) 2.651 0.879 0.879 weight 1.000 ! spec=13C_NOESY, no=220, id=2621, vol=1.370000e+08
    or (segid "   A" and resid    8 and name HG21) (segid "   A" and resid    9 and name  HG2)
    or (segid "   A" and resid    8 and name HG23) (segid "   A" and resid    9 and name  HG2)
assign (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  101 and name HG22) 2.368 0.701 0.701 weight 1.000 ! spec=13C_NOESY, no=221, id=2622, vol=1.370000e+08
    or (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  101 and name HG21)
    or (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  101 and name HG23)
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name  HB2) 2.442 0.746 0.746 weight 1.000 ! spec=13C_NOESY, no=223, id=2624, vol=1.360000e+08
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name  HB1)
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name  HB3)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name HG22) 2.582 0.833 0.833 weight 1.000 ! spec=13C_NOESY, no=225, id=2626, vol=1.350000e+08
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name HG23)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   85 and name HD12) 2.488 0.774 0.774 weight 1.000 ! spec=13C_NOESY, no=226, id=2627, vol=1.350000e+08
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   41 and name HG22) 2.134 0.569 0.569 weight 1.000 ! spec=13C_NOESY, no=228, id=2629, vol=1.340000e+08
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   66 and name  HB2) 2.939 1.080 1.080 weight 1.000 ! spec=13C_NOESY, no=230, id=2631, vol=1.340000e+08
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB1) 2.479 0.768 0.768 weight 1.000 ! spec=13C_NOESY, no=235, id=2636, vol=1.320000e+08
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name HD22) 2.524 0.797 0.797 weight 1.000 ! spec=13C_NOESY, no=237, id=2638, vol=1.300000e+08
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name HD21)
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name HD23)
assign (segid "   A" and resid   71 and name  HB1) (segid "   A" and resid   71 and name  HB2) 2.108 0.555 0.555 weight 1.000 ! spec=13C_NOESY, no=239, id=2640, vol=1.290000e+08
assign (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   15 and name   HN) 2.630 0.864 0.864 weight 1.000 ! spec=13C_NOESY, no=242, id=2643, vol=1.290000e+08
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   15 and name   HN)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   15 and name   HN)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HB2) 2.663 0.887 0.887 weight 1.000 ! spec=13C_NOESY, no=243, id=2644, vol=1.280000e+08
assign (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   76 and name  HB2) 2.534 0.803 0.803 weight 1.000 ! spec=13C_NOESY, no=249, id=2650, vol=1.260000e+08
    or (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name   HN) 2.538 0.805 0.805 weight 1.000 ! spec=13C_NOESY, no=252, id=2653, vol=1.230000e+08
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name HG12) 2.496 0.779 0.779 weight 1.000 ! spec=13C_NOESY, no=253, id=2654, vol=1.230000e+08
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   68 and name  HB1) 2.485 0.772 0.772 weight 1.000 ! spec=13C_NOESY, no=255, id=2656, vol=1.220000e+08
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   85 and name HG22) 2.704 0.914 0.914 weight 1.000 ! spec=13C_NOESY, no=257, id=2658, vol=1.210000e+08
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   75 and name   HN) 2.463 0.758 0.758 weight 1.000 ! spec=13C_NOESY, no=260, id=2661, vol=1.190000e+08
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   10 and name HD12) 2.420 0.732 0.732 weight 1.000 ! spec=13C_NOESY, no=264, id=2665, vol=1.150000e+08
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   10 and name HD11)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   10 and name HD13)
assign (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name HG21) 2.444 0.746 0.746 weight 1.000 ! spec=13C_NOESY, no=276, id=2677, vol=1.120000e+08
    or (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid   23 and name HD12) (segid "   A" and resid   23 and name  HB1) 2.582 0.833 0.833 weight 1.000 ! spec=13C_NOESY, no=279, id=2680, vol=1.110000e+08
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid   23 and name  HB1)
assign (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   76 and name  HB2) 2.916 1.063 1.063 weight 1.000 ! spec=13C_NOESY, no=282, id=2682, vol=1.110000e+08
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name  HB1) 2.083 0.542 0.542 weight 1.000 ! spec=13C_NOESY, no=285, id=2685, vol=1.100000e+08
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG21) 2.945 1.084 1.084 weight 1.000 ! spec=13C_NOESY, no=286, id=2686, vol=1.100000e+08
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG23)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG22) 2.326 0.677 0.677 weight 1.000 ! spec=13C_NOESY, no=287, id=2687, vol=1.090000e+08
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG23)
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   23 and name  HB1) 3.039 1.154 1.154 weight 1.000 ! spec=13C_NOESY, no=291, id=2690, vol=1.070000e+08
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   23 and name  HB1)
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   60 and name  HB2) 2.635 0.868 0.868 weight 1.000 ! spec=13C_NOESY, no=293, id=2692, vol=1.070000e+08
assign (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   68 and name  HB1) 2.703 0.913 0.913 weight 1.000 ! spec=13C_NOESY, no=296, id=2695, vol=1.060000e+08
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HD12) 2.580 0.832 0.832 weight 1.000 ! spec=13C_NOESY, no=297, id=2696, vol=1.060000e+08
    or (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name  HB1) 2.568 0.824 0.824 weight 1.000 ! spec=13C_NOESY, no=299, id=2698, vol=1.060000e+08
assign (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD22) 2.890 1.044 1.044 weight 1.000 ! spec=13C_NOESY, no=304, id=2703, vol=1.050000e+08
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD21)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD23)
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   53 and name  HB1) 2.407 0.724 0.724 weight 1.000 ! spec=13C_NOESY, no=305, id=2704, vol=1.050000e+08
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   53 and name  HB1)
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   13 and name  HB1) 2.825 0.998 0.998 weight 1.000 ! spec=13C_NOESY, no=308, id=2707, vol=1.040000e+08
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   10 and name HG11) 3.192 1.274 1.274 weight 1.000 ! spec=13C_NOESY, no=309, id=2708, vol=1.040000e+08
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   10 and name HG11)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   10 and name HG11)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HB2) 2.788 0.971 0.971 weight 1.000 ! spec=13C_NOESY, no=312, id=2711, vol=1.030000e+08
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name  HB1) 2.457 0.755 0.755 weight 1.000 ! spec=13C_NOESY, no=316, id=2715, vol=1.020000e+08
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   69 and name   HA) 2.593 0.841 0.841 weight 1.000 ! spec=13C_NOESY, no=317, id=2716, vol=1.020000e+08
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   53 and name   HG) 2.411 0.726 0.726 weight 1.000 ! spec=13C_NOESY, no=318, id=2717, vol=1.020000e+08
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   53 and name   HG)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   53 and name   HG)
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   92 and name  HB2) 2.879 1.036 1.036 weight 1.000 ! spec=13C_NOESY, no=320, id=2719, vol=1.020000e+08
    or (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   92 and name  HB1)
    or (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   92 and name  HB3)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name HG11) 2.502 0.783 0.783 weight 1.000 ! spec=13C_NOESY, no=321, id=2720, vol=1.020000e+08
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   32 and name HG22) 3.020 1.140 1.140 weight 1.000 ! spec=13C_NOESY, no=322, id=2721, vol=1.010000e+08
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   18 and name HG12) 2.931 1.074 1.074 weight 1.000 ! spec=13C_NOESY, no=326, id=2725, vol=1.000000e+08
assign (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   81 and name  HB1) 2.531 0.801 0.801 weight 1.000 ! spec=13C_NOESY, no=333, id=2732, vol=9.800000e+07
assign (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   84 and name   HN) 3.015 1.136 1.136 weight 1.000 ! spec=13C_NOESY, no=334, id=2733, vol=9.770000e+07
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HE2) 2.402 0.721 0.721 weight 1.000 ! spec=13C_NOESY, no=339, id=2738, vol=9.600000e+07
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   72 and name   HA) 2.915 1.062 1.062 weight 1.000 ! spec=13C_NOESY, no=340, id=2739, vol=9.580000e+07
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name  HB2) 2.597 0.843 0.843 weight 1.000 ! spec=13C_NOESY, no=341, id=2740, vol=9.570000e+07
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name  HB3)
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  106 and name  HB2) 3.127 1.222 1.222 weight 1.000 ! spec=13C_NOESY, no=343, id=2742, vol=9.550000e+07
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   37 and name HD12) 2.392 0.715 0.715 weight 1.000 ! spec=13C_NOESY, no=345, id=2744, vol=9.540000e+07
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid  101 and name HD12) (segid "   A" and resid  101 and name HG12) 2.443 0.746 0.746 weight 1.000 ! spec=13C_NOESY, no=346, id=2745, vol=9.490000e+07
    or (segid "   A" and resid  101 and name HD11) (segid "   A" and resid  101 and name HG12)
    or (segid "   A" and resid  101 and name HD13) (segid "   A" and resid  101 and name HG12)
assign (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name  HB2) 2.882 1.038 1.038 weight 1.000 ! spec=13C_NOESY, no=351, id=2750, vol=9.400000e+07
assign (segid "   A" and resid   53 and name HD12) (segid "   A" and resid   41 and name HG11) 3.202 1.281 1.281 weight 1.000 ! spec=13C_NOESY, no=353, id=2752, vol=9.340000e+07
    or (segid "   A" and resid   53 and name HD11) (segid "   A" and resid   41 and name HG11)
    or (segid "   A" and resid   53 and name HD13) (segid "   A" and resid   41 and name HG11)
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name   HN) 2.501 0.782 0.782 weight 1.000 ! spec=13C_NOESY, no=354, id=2753, vol=9.280000e+07
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   30 and name  HB2) 3.031 1.148 1.148 weight 1.000 ! spec=13C_NOESY, no=355, id=2754, vol=9.180000e+07
assign (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   68 and name  HB2) 2.471 0.763 0.763 weight 1.000 ! spec=13C_NOESY, no=358, id=2757, vol=9.090000e+07
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name   HB) 2.481 0.769 0.769 weight 1.000 ! spec=13C_NOESY, no=359, id=2758, vol=9.090000e+07
assign (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   41 and name   HN) 2.452 0.751 0.751 weight 1.000 ! spec=13C_NOESY, no=360, id=2759, vol=9.070000e+07
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid   79 and name  HB2) 2.219 0.615 0.615 weight 1.000 ! spec=13C_NOESY, no=361, id=2760, vol=9.060000e+07
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name  HB2) 2.533 0.802 0.802 weight 1.000 ! spec=13C_NOESY, no=363, id=2762, vol=8.860000e+07
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name  HB2) 2.640 0.871 0.871 weight 1.000 ! spec=13C_NOESY, no=364, id=2763, vol=8.850000e+07
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name   HG) 2.502 0.783 0.783 weight 1.000 ! spec=13C_NOESY, no=365, id=2764, vol=8.830000e+07
assign (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name   HN) 2.643 0.873 0.873 weight 1.000 ! spec=13C_NOESY, no=366, id=2765, vol=8.680000e+07
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   21 and name  HB2) 2.752 0.947 0.947 weight 1.000 ! spec=13C_NOESY, no=370, id=2768, vol=8.510000e+07
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   21 and name  HB3)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   70 and name  HB2) 3.030 1.148 1.148 weight 1.000 ! spec=13C_NOESY, no=372, id=2770, vol=8.460000e+07
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   70 and name  HB3)
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD22) 2.698 0.910 0.910 weight 1.000 ! spec=13C_NOESY, no=375, id=2773, vol=8.400000e+07
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   48 and name  HB1) 3.423 1.464 1.464 weight 1.000 ! spec=13C_NOESY, no=376, id=2774, vol=8.390000e+07
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name  HB2) 2.986 1.115 1.115 weight 1.000 ! spec=13C_NOESY, no=377, id=2775, vol=8.370000e+07
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   41 and name HD12) 3.142 1.234 1.234 weight 1.000 ! spec=13C_NOESY, no=378, id=2776, vol=8.350000e+07
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   31 and name  HD2) 2.505 0.784 0.784 weight 1.000 ! spec=13C_NOESY, no=379, id=2777, vol=8.330000e+07
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   56 and name  HG2) 2.484 0.771 0.771 weight 1.000 ! spec=13C_NOESY, no=383, id=2781, vol=8.230000e+07
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   81 and name  HD1) 3.092 1.195 1.195 weight 1.000 ! spec=13C_NOESY, no=386, id=2784, vol=8.180000e+07
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   81 and name  HD1)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   81 and name  HD1)
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   68 and name  HG2) 2.844 1.011 1.011 weight 1.000 ! spec=13C_NOESY, no=389, id=2787, vol=8.110000e+07
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   57 and name  HE2) 2.489 0.774 0.774 weight 1.000 ! spec=13C_NOESY, no=391, id=2789, vol=8.100000e+07
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   57 and name  HE2)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   57 and name  HE2)
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   80 and name HE21) 2.393 0.716 0.716 weight 1.000 ! spec=13C_NOESY, no=394, id=2792, vol=8.050000e+07
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   80 and name HE21)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   80 and name HE21)
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name  HB1) 2.715 0.921 0.921 weight 1.000 ! spec=13C_NOESY, no=395, id=2793, vol=8.050000e+07
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   31 and name  HG2) 2.551 0.813 0.813 weight 1.000 ! spec=13C_NOESY, no=401, id=2799, vol=7.980000e+07
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG11) 2.498 0.780 0.780 weight 1.000 ! spec=13C_NOESY, no=406, id=2804, vol=7.850000e+07
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name   HA) 2.703 0.914 0.914 weight 1.000 ! spec=13C_NOESY, no=408, id=2806, vol=7.830000e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   21 and name   HA) 3.169 1.255 1.255 weight 1.000 ! spec=13C_NOESY, no=411, id=2809, vol=7.800000e+07
assign (segid "   A" and resid    7 and name  HG2) (segid "   A" and resid    7 and name  HB2) 2.739 0.938 0.938 weight 1.000 ! spec=13C_NOESY, no=413, id=2811, vol=7.780000e+07
assign (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   40 and name HD12) 2.788 0.972 0.972 weight 1.000 ! spec=13C_NOESY, no=417, id=2814, vol=7.710000e+07
    or (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name   HN) 2.517 0.792 0.792 weight 1.000 ! spec=13C_NOESY, no=418, id=2815, vol=7.700000e+07
assign (segid "   A" and resid   89 and name   HA) (segid "   A" and resid   90 and name  HD1) 2.824 0.997 0.997 weight 1.000 ! spec=13C_NOESY, no=419, id=2816, vol=7.680000e+07
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD12) 2.692 0.906 0.906 weight 1.000 ! spec=13C_NOESY, no=422, id=2819, vol=7.640000e+07
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD13)
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   32 and name   HB) 2.522 0.795 0.795 weight 1.000 ! spec=13C_NOESY, no=426, id=2823, vol=7.570000e+07
assign (segid "   A" and resid   74 and name   HG) (segid "   A" and resid   81 and name  HD1) 3.244 1.315 1.315 weight 1.000 ! spec=13C_NOESY, no=429, id=2826, vol=7.530000e+07
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name  HB2) 3.021 1.141 1.141 weight 1.000 ! spec=13C_NOESY, no=430, id=2827, vol=7.530000e+07
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   21 and name  HB2) 3.036 1.152 1.152 weight 1.000 ! spec=13C_NOESY, no=433, id=2830, vol=7.480000e+07
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   21 and name  HB3)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   21 and name  HB3)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   21 and name  HB3)
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   33 and name HG21) 2.809 0.986 0.986 weight 1.000 ! spec=13C_NOESY, no=436, id=2832, vol=7.470000e+07
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   33 and name HG23)
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name  HB1) 2.870 1.029 1.029 weight 1.000 ! spec=13C_NOESY, no=439, id=2835, vol=7.420000e+07
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   20 and name   HN) 2.733 0.934 0.934 weight 1.000 ! spec=13C_NOESY, no=440, id=2836, vol=7.420000e+07
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   20 and name   HN)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   20 and name   HN)
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   23 and name HD12) 2.848 1.014 1.014 weight 1.000 ! spec=13C_NOESY, no=442, id=2837, vol=7.410000e+07
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   23 and name HD11)
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   23 and name HD13)
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name   HN) 3.415 1.458 1.458 weight 1.000 ! spec=13C_NOESY, no=443, id=2838, vol=7.410000e+07
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   27 and name  HG2) 2.537 0.805 0.805 weight 1.000 ! spec=13C_NOESY, no=447, id=2842, vol=7.310000e+07
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   27 and name  HG2)
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   27 and name  HG2)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   75 and name HG22) 3.045 1.159 1.159 weight 1.000 ! spec=13C_NOESY, no=452, id=2846, vol=7.250000e+07
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   75 and name HG23)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   75 and name HG22)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   75 and name HG23)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   75 and name HG22)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   75 and name HG23)
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name  HB1) 2.999 1.124 1.124 weight 1.000 ! spec=13C_NOESY, no=453, id=2847, vol=7.240000e+07
assign (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name  HB2) 2.855 1.019 1.019 weight 1.000 ! spec=13C_NOESY, no=456, id=2850, vol=7.200000e+07
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name HG21) 2.675 0.894 0.894 weight 1.000 ! spec=13C_NOESY, no=458, id=2852, vol=7.170000e+07
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   22 and name  HD1) 3.284 1.348 1.348 weight 1.000 ! spec=13C_NOESY, no=464, id=2858, vol=7.110000e+07
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   22 and name  HD1)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   22 and name  HD1)
assign (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   68 and name  HB1) 2.676 0.895 0.895 weight 1.000 ! spec=13C_NOESY, no=467, id=2861, vol=7.010000e+07
assign (segid "   A" and resid   82 and name HG22) (segid "   A" and resid   86 and name  HB2) 2.911 1.059 1.059 weight 1.000 ! spec=13C_NOESY, no=470, id=2864, vol=6.980000e+07
    or (segid "   A" and resid   82 and name HG22) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   82 and name HG22) (segid "   A" and resid   86 and name  HB3)
    or (segid "   A" and resid   82 and name HG21) (segid "   A" and resid   86 and name  HB2)
    or (segid "   A" and resid   82 and name HG21) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   82 and name HG21) (segid "   A" and resid   86 and name  HB3)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid   86 and name  HB2)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid   93 and name  HD1) (segid "   A" and resid   93 and name  HB1) 3.041 1.156 1.156 weight 1.000 ! spec=13C_NOESY, no=472, id=2866, vol=6.930000e+07
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   66 and name  HD1) 3.135 1.229 1.229 weight 1.000 ! spec=13C_NOESY, no=476, id=2870, vol=6.890000e+07
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   66 and name  HD1)
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HG1) 2.883 1.039 1.039 weight 1.000 ! spec=13C_NOESY, no=479, id=2873, vol=6.830000e+07
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name  HG1) 2.511 0.788 0.788 weight 1.000 ! spec=13C_NOESY, no=480, id=2874, vol=6.830000e+07
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG12) 2.864 1.025 1.025 weight 1.000 ! spec=13C_NOESY, no=481, id=2875, vol=6.820000e+07
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name  HB1) 2.670 0.891 0.891 weight 1.000 ! spec=13C_NOESY, no=483, id=2877, vol=6.800000e+07
assign (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   61 and name  HB2) 3.266 1.333 1.333 weight 1.000 ! spec=13C_NOESY, no=484, id=2878, vol=6.750000e+07
    or (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   22 and name   HZ) 2.833 1.003 1.003 weight 1.000 ! spec=13C_NOESY, no=490, id=2884, vol=6.670000e+07
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG11) 2.706 0.915 0.915 weight 1.000 ! spec=13C_NOESY, no=492, id=2886, vol=6.650000e+07
assign (segid "   A" and resid   83 and name  HG2) (segid "   A" and resid   83 and name   HN) 2.379 0.708 0.708 weight 1.000 ! spec=13C_NOESY, no=502, id=2896, vol=6.570000e+07
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   80 and name  HB1) 3.376 1.425 1.425 weight 1.000 ! spec=13C_NOESY, no=504, id=2898, vol=6.550000e+07
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   80 and name  HB1)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   80 and name  HB1)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   19 and name  HG2) 3.033 1.150 1.150 weight 1.000 ! spec=13C_NOESY, no=505, id=2899, vol=6.550000e+07
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   19 and name  HG2)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   19 and name  HG2)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HB2) 2.700 0.911 0.911 weight 1.000 ! spec=13C_NOESY, no=508, id=2902, vol=6.520000e+07
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   35 and name  HB2) 3.073 1.180 1.180 weight 1.000 ! spec=13C_NOESY, no=509, id=2903, vol=6.510000e+07
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   35 and name  HB3)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG12) 3.488 1.520 1.520 weight 1.000 ! spec=13C_NOESY, no=512, id=2906, vol=6.500000e+07
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   87 and name  HG2) (segid "   A" and resid   87 and name  HB2) 2.938 1.079 1.079 weight 1.000 ! spec=13C_NOESY, no=514, id=2908, vol=6.480000e+07
assign (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   85 and name HG22) 3.418 1.460 1.460 weight 1.000 ! spec=13C_NOESY, no=515, id=2909, vol=6.480000e+07
    or (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   86 and name  HB2) 3.299 1.360 1.360 weight 1.000 ! spec=13C_NOESY, no=523, id=2917, vol=6.380000e+07
    or (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   75 and name   HN) 3.041 1.156 1.156 weight 1.000 ! spec=13C_NOESY, no=525, id=2919, vol=6.380000e+07
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   75 and name   HN)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   75 and name   HN)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HB1) 3.050 1.163 1.163 weight 1.000 ! spec=13C_NOESY, no=527, id=2921, vol=6.360000e+07
assign (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   72 and name  HD1) 3.226 1.300 1.300 weight 1.000 ! spec=13C_NOESY, no=528, id=2922, vol=6.350000e+07
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   72 and name  HD1)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   72 and name  HD1)
assign (segid "   A" and resid   89 and name   HA) (segid "   A" and resid   90 and name  HD2) 2.652 0.879 0.879 weight 1.000 ! spec=13C_NOESY, no=530, id=2924, vol=6.310000e+07
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HA) 2.760 0.952 0.952 weight 1.000 ! spec=13C_NOESY, no=531, id=2925, vol=6.300000e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HA)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HA)
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   89 and name  HD1) 3.175 1.260 1.260 weight 1.000 ! spec=13C_NOESY, no=534, id=2928, vol=6.240000e+07
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   89 and name  HD1)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   89 and name  HD1)
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   60 and name  HD1) 2.885 1.041 1.041 weight 1.000 ! spec=13C_NOESY, no=535, id=2929, vol=6.230000e+07
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name   HA) 2.837 1.006 1.006 weight 1.000 ! spec=13C_NOESY, no=538, id=2932, vol=6.190000e+07
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   32 and name HG22) 3.344 1.398 1.398 weight 1.000 ! spec=13C_NOESY, no=541, id=2935, vol=6.180000e+07
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   60 and name  HG2) 2.936 1.078 1.078 weight 1.000 ! spec=13C_NOESY, no=543, id=2937, vol=6.140000e+07
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   83 and name  HG2) 3.222 1.298 1.298 weight 1.000 ! spec=13C_NOESY, no=546, id=2939, vol=6.110000e+07
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG21) 2.733 0.934 0.934 weight 1.000 ! spec=13C_NOESY, no=547, id=2940, vol=6.100000e+07
    or (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG23)
assign (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   68 and name   HN) 2.624 0.861 0.861 weight 1.000 ! spec=13C_NOESY, no=548, id=2941, vol=6.100000e+07
assign (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   74 and name  HB1) 2.961 1.096 1.096 weight 1.000 ! spec=13C_NOESY, no=550, id=2943, vol=6.090000e+07
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   74 and name  HB1)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   74 and name  HB1)
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name  HG1) 2.769 0.958 0.958 weight 1.000 ! spec=13C_NOESY, no=555, id=2948, vol=6.030000e+07
assign (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   48 and name HD22) 3.163 1.251 1.251 weight 1.000 ! spec=13C_NOESY, no=557, id=2950, vol=6.010000e+07
    or (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HB2) 2.539 0.806 0.806 weight 1.000 ! spec=13C_NOESY, no=559, id=2952, vol=5.990000e+07
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name  HB1) 2.722 0.926 0.926 weight 1.000 ! spec=13C_NOESY, no=560, id=2953, vol=5.980000e+07
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name  HB1) 2.704 0.914 0.914 weight 1.000 ! spec=13C_NOESY, no=563, id=2956, vol=5.950000e+07
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name  HE2) 2.710 0.918 0.918 weight 1.000 ! spec=13C_NOESY, no=564, id=2957, vol=5.940000e+07
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    9 and name  HB2) 3.558 1.582 1.582 weight 1.000 ! spec=13C_NOESY, no=567, id=2960, vol=5.920000e+07
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   81 and name  HD1) 3.321 1.379 1.379 weight 1.000 ! spec=13C_NOESY, no=572, id=2964, vol=5.900000e+07
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   39 and name HE22) 3.652 1.667 1.667 weight 1.000 ! spec=13C_NOESY, no=573, id=2965, vol=5.880000e+07
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   39 and name HE22)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   39 and name HE22)
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   37 and name HD12) 2.707 0.916 0.916 weight 1.000 ! spec=13C_NOESY, no=574, id=2966, vol=5.880000e+07
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   75 and name   HA) 2.542 0.808 0.808 weight 1.000 ! spec=13C_NOESY, no=577, id=2969, vol=5.830000e+07
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid    8 and name HG12) 3.460 1.496 1.496 weight 1.000 ! spec=13C_NOESY, no=578, id=2970, vol=5.810000e+07
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid    8 and name HG11)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid    8 and name HG13)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid    8 and name HG12)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid    8 and name HG11)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid    8 and name HG13)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid    8 and name HG12)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid    8 and name HG11)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid    8 and name HG13)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   57 and name  HG2) 3.102 1.203 1.203 weight 1.000 ! spec=13C_NOESY, no=580, id=2972, vol=5.810000e+07
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   57 and name  HG2)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   10 and name HG12) 2.854 1.018 1.018 weight 1.000 ! spec=13C_NOESY, no=581, id=2973, vol=5.800000e+07
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   86 and name  HB2) 3.176 1.261 1.261 weight 1.000 ! spec=13C_NOESY, no=583, id=2975, vol=5.790000e+07
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name   HN) 3.445 1.484 1.484 weight 1.000 ! spec=13C_NOESY, no=584, id=2976, vol=5.780000e+07
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name HD12) 2.757 0.950 0.950 weight 1.000 ! spec=13C_NOESY, no=585, id=2977, vol=5.770000e+07
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   85 and name HD12) 2.630 0.865 0.865 weight 1.000 ! spec=13C_NOESY, no=587, id=2979, vol=5.740000e+07
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HG1) 2.747 0.943 0.943 weight 1.000 ! spec=13C_NOESY, no=592, id=2983, vol=5.700000e+07
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HG2) 2.733 0.934 0.934 weight 1.000 ! spec=13C_NOESY, no=594, id=2985, vol=5.620000e+07
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   70 and name  HB2) 3.081 1.187 1.187 weight 1.000 ! spec=13C_NOESY, no=595, id=2986, vol=5.620000e+07
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   70 and name  HB3)
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name  HD1) 3.185 1.268 1.268 weight 1.000 ! spec=13C_NOESY, no=597, id=2988, vol=5.610000e+07
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   18 and name HG22) 3.099 1.200 1.200 weight 1.000 ! spec=13C_NOESY, no=599, id=2990, vol=5.590000e+07
    or (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   71 and name   HZ) 2.954 1.091 1.091 weight 1.000 ! spec=13C_NOESY, no=600, id=2991, vol=5.570000e+07
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   71 and name   HZ)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   71 and name   HZ)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name  HB1) 3.120 1.217 1.217 weight 1.000 ! spec=13C_NOESY, no=601, id=2992, vol=5.550000e+07
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB2) 3.236 1.309 1.309 weight 1.000 ! spec=13C_NOESY, no=602, id=2993, vol=5.540000e+07
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HD12) 3.620 1.638 1.638 weight 1.000 ! spec=13C_NOESY, no=607, id=2998, vol=5.450000e+07
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name  HB1) 2.740 0.939 0.939 weight 1.000 ! spec=13C_NOESY, no=608, id=2999, vol=5.440000e+07
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   87 and name   HN) 3.040 1.155 1.155 weight 1.000 ! spec=13C_NOESY, no=613, id=3004, vol=5.400000e+07
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   22 and name   HA) 3.487 1.520 1.520 weight 1.000 ! spec=13C_NOESY, no=614, id=3005, vol=5.400000e+07
assign (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   45 and name  HB2) 2.911 1.059 1.059 weight 1.000 ! spec=13C_NOESY, no=615, id=3006, vol=5.390000e+07
assign (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid    8 and name HG22) 3.725 1.734 1.734 weight 1.000 ! spec=13C_NOESY, no=616, id=3007, vol=5.370000e+07
    or (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid    8 and name HG23)
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   75 and name HG12) 2.638 0.870 0.870 weight 1.000 ! spec=13C_NOESY, no=617, id=3008, vol=5.340000e+07
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   85 and name   HB) 3.051 1.163 1.163 weight 1.000 ! spec=13C_NOESY, no=618, id=3009, vol=5.320000e+07
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   53 and name HD12) 2.985 1.114 1.114 weight 1.000 ! spec=13C_NOESY, no=619, id=3010, vol=5.310000e+07
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name  HB1) 3.322 1.379 1.379 weight 1.000 ! spec=13C_NOESY, no=623, id=3013, vol=5.290000e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name  HB1)
assign (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   68 and name   HA) 3.824 1.828 1.828 weight 1.000 ! spec=13C_NOESY, no=624, id=3014, vol=5.280000e+07
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   36 and name  HE2) 2.971 1.104 1.104 weight 1.000 ! spec=13C_NOESY, no=626, id=3016, vol=5.180000e+07
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HB2) 2.863 1.025 1.025 weight 1.000 ! spec=13C_NOESY, no=627, id=3017, vol=5.160000e+07
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    8 and name HG22) 3.266 1.333 1.333 weight 1.000 ! spec=13C_NOESY, no=628, id=3018, vol=5.140000e+07
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    8 and name HG23)
assign (segid "   A" and resid   53 and name HD12) (segid "   A" and resid   53 and name  HB1) 3.071 1.179 1.179 weight 1.000 ! spec=13C_NOESY, no=638, id=3028, vol=5.090000e+07
    or (segid "   A" and resid   53 and name HD11) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   53 and name HD13) (segid "   A" and resid   53 and name  HB1)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   32 and name   HB) 3.344 1.398 1.398 weight 1.000 ! spec=13C_NOESY, no=639, id=3029, vol=5.080000e+07
assign (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   31 and name  HD2) 3.136 1.229 1.229 weight 1.000 ! spec=13C_NOESY, no=642, id=3032, vol=5.060000e+07
assign (segid "   A" and resid   51 and name  HG2) (segid "   A" and resid   51 and name   HA) 3.192 1.274 1.274 weight 1.000 ! spec=13C_NOESY, no=643, id=3033, vol=5.060000e+07
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name   HB) 2.842 1.010 1.010 weight 1.000 ! spec=13C_NOESY, no=644, id=3034, vol=5.060000e+07
assign (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   75 and name HG12) 2.987 1.115 1.115 weight 1.000 ! spec=13C_NOESY, no=645, id=3035, vol=5.020000e+07
    or (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   69 and name   HN) 2.952 1.090 1.090 weight 1.000 ! spec=13C_NOESY, no=648, id=3038, vol=5.010000e+07
assign (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  101 and name HG12) 2.807 0.985 0.985 weight 1.000 ! spec=13C_NOESY, no=651, id=3041, vol=5.000000e+07
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   85 and name HG12) 3.645 1.660 1.660 weight 1.000 ! spec=13C_NOESY, no=657, id=3046, vol=4.960000e+07
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   85 and name HG12)
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name   HB) 2.813 0.989 0.989 weight 1.000 ! spec=13C_NOESY, no=658, id=3047, vol=4.950000e+07
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB1) 2.900 1.052 1.052 weight 1.000 ! spec=13C_NOESY, no=666, id=3054, vol=4.880000e+07
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   48 and name HD22) 3.217 1.293 1.293 weight 1.000 ! spec=13C_NOESY, no=667, id=3055, vol=4.860000e+07
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name HG22) 2.711 0.919 0.919 weight 1.000 ! spec=13C_NOESY, no=668, id=3056, vol=4.860000e+07
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name HG23)
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   31 and name  HG1) 2.793 0.975 0.975 weight 1.000 ! spec=13C_NOESY, no=674, id=3062, vol=4.770000e+07
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   13 and name  HB1) 3.545 1.571 1.571 weight 1.000 ! spec=13C_NOESY, no=677, id=3064, vol=4.760000e+07
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name  HB2) 3.043 1.157 1.157 weight 1.000 ! spec=13C_NOESY, no=678, id=3065, vol=4.760000e+07
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   18 and name HG22) 2.994 1.120 1.120 weight 1.000 ! spec=13C_NOESY, no=679, id=3066, vol=4.750000e+07
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HD22) 3.279 1.344 1.344 weight 1.000 ! spec=13C_NOESY, no=680, id=3067, vol=4.730000e+07
    or (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HD21)
    or (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name HD23)
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HD12) 3.373 1.422 1.422 weight 1.000 ! spec=13C_NOESY, no=684, id=3071, vol=4.710000e+07
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HD11)
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HD13)
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   20 and name HG21) 3.092 1.195 1.195 weight 1.000 ! spec=13C_NOESY, no=689, id=3076, vol=4.680000e+07
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   20 and name HG21)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   20 and name HG21)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   20 and name HG23)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name HG12) 2.682 0.899 0.899 weight 1.000 ! spec=13C_NOESY, no=691, id=3078, vol=4.680000e+07
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name HG22) 3.008 1.131 1.131 weight 1.000 ! spec=13C_NOESY, no=694, id=3081, vol=4.630000e+07
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HB1) 3.089 1.193 1.193 weight 1.000 ! spec=13C_NOESY, no=695, id=3082, vol=4.630000e+07
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   21 and name  HB2) 3.166 1.253 1.253 weight 1.000 ! spec=13C_NOESY, no=700, id=3087, vol=4.590000e+07
    or (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   21 and name  HB3)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   21 and name  HB3)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   21 and name  HB3)
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   32 and name   HB) 2.822 0.995 0.995 weight 1.000 ! spec=13C_NOESY, no=701, id=3088, vol=4.580000e+07
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   55 and name   HN) 3.545 1.571 1.571 weight 1.000 ! spec=13C_NOESY, no=702, id=3089, vol=4.580000e+07
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   27 and name HE22) 3.240 1.313 1.313 weight 1.000 ! spec=13C_NOESY, no=706, id=3093, vol=4.530000e+07
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   68 and name  HB1) 3.602 1.622 1.622 weight 1.000 ! spec=13C_NOESY, no=707, id=3094, vol=4.520000e+07
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   68 and name  HB1)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   68 and name  HB1)
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   97 and name  HG2) 2.794 0.976 0.976 weight 1.000 ! spec=13C_NOESY, no=709, id=3096, vol=4.500000e+07
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   86 and name  HB2) 2.778 0.964 0.964 weight 1.000 ! spec=13C_NOESY, no=710, id=3097, vol=4.480000e+07
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid    8 and name HG12) (segid "   A" and resid   76 and name  HB2) 3.140 1.232 1.232 weight 1.000 ! spec=13C_NOESY, no=711, id=3098, vol=4.450000e+07
    or (segid "   A" and resid    8 and name HG12) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid    8 and name HG12) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid    8 and name HG11) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid    8 and name HG11) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid    8 and name HG11) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid    8 and name HG13) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid    8 and name HG13) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid    8 and name HG13) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name  HD1) 3.307 1.367 1.367 weight 1.000 ! spec=13C_NOESY, no=712, id=3099, vol=4.440000e+07
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   68 and name   HN) 2.936 1.077 1.077 weight 1.000 ! spec=13C_NOESY, no=713, id=3100, vol=4.440000e+07
assign (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   46 and name  HB2) 3.723 1.732 1.732 weight 1.000 ! spec=13C_NOESY, no=714, id=3101, vol=4.430000e+07
assign (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   48 and name   HN) 2.844 1.011 1.011 weight 1.000 ! spec=13C_NOESY, no=723, id=3110, vol=4.310000e+07
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   86 and name  HB2) 3.228 1.302 1.302 weight 1.000 ! spec=13C_NOESY, no=724, id=3111, vol=4.310000e+07
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   86 and name  HB3)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   86 and name  HB2)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   86 and name  HB3)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   86 and name  HB2)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HD12) 2.999 1.124 1.124 weight 1.000 ! spec=13C_NOESY, no=725, id=3112, vol=4.310000e+07
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HD11)
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HD13)
assign (segid "   A" and resid   10 and name HG11) (segid "   A" and resid   10 and name   HN) 2.610 0.851 0.851 weight 1.000 ! spec=13C_NOESY, no=726, id=3113, vol=4.300000e+07
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   88 and name  HB1) 2.820 0.994 0.994 weight 1.000 ! spec=13C_NOESY, no=727, id=3114, vol=4.290000e+07
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   45 and name  HB1) 3.217 1.294 1.294 weight 1.000 ! spec=13C_NOESY, no=728, id=3115, vol=4.290000e+07
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name  HB1)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   45 and name  HB1)
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name HD22) 3.246 1.317 1.317 weight 1.000 ! spec=13C_NOESY, no=731, id=3118, vol=4.280000e+07
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   72 and name  HD1) 3.268 1.335 1.335 weight 1.000 ! spec=13C_NOESY, no=735, id=3122, vol=4.250000e+07
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   72 and name  HD1)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   72 and name  HD1)
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HB1) 3.326 1.383 1.383 weight 1.000 ! spec=13C_NOESY, no=738, id=3125, vol=4.220000e+07
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   66 and name  HB2) 3.437 1.477 1.477 weight 1.000 ! spec=13C_NOESY, no=739, id=3126, vol=4.220000e+07
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   66 and name  HB2)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   66 and name  HB2)
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   57 and name  HB1) 2.874 1.033 1.033 weight 1.000 ! spec=13C_NOESY, no=740, id=3127, vol=4.220000e+07
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   57 and name  HB1)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   57 and name  HB1)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   61 and name  HB2) 3.757 1.764 1.764 weight 1.000 ! spec=13C_NOESY, no=741, id=3128, vol=4.210000e+07
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   82 and name HG22) 3.551 1.576 1.576 weight 1.000 ! spec=13C_NOESY, no=743, id=3130, vol=4.210000e+07
    or (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   82 and name HG23)
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HD12) 3.366 1.416 1.416 weight 1.000 ! spec=13C_NOESY, no=746, id=3133, vol=4.190000e+07
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   93 and name  HB1) (segid "   A" and resid   94 and name   HN) 2.971 1.103 1.103 weight 1.000 ! spec=13C_NOESY, no=749, id=3136, vol=4.170000e+07
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   41 and name   HN) 3.770 1.777 1.777 weight 1.000 ! spec=13C_NOESY, no=755, id=3142, vol=4.140000e+07
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   41 and name   HN)
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name   HB) 2.703 0.913 0.913 weight 1.000 ! spec=13C_NOESY, no=759, id=3145, vol=4.090000e+07
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   37 and name HD12) 3.295 1.357 1.357 weight 1.000 ! spec=13C_NOESY, no=760, id=3146, vol=4.070000e+07
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   75 and name   HB) 2.967 1.100 1.100 weight 1.000 ! spec=13C_NOESY, no=762, id=3148, vol=4.060000e+07
assign (segid "   A" and resid   56 and name  HG2) (segid "   A" and resid   56 and name   HN) 3.384 1.432 1.432 weight 1.000 ! spec=13C_NOESY, no=763, id=3149, vol=4.050000e+07
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name  HB2) 3.216 1.293 1.293 weight 1.000 ! spec=13C_NOESY, no=766, id=3152, vol=4.040000e+07
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name   HB) 2.946 1.085 1.085 weight 1.000 ! spec=13C_NOESY, no=770, id=3156, vol=3.980000e+07
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   71 and name   HZ) 2.855 1.019 1.019 weight 1.000 ! spec=13C_NOESY, no=773, id=3159, vol=3.970000e+07
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   85 and name HD12) 3.587 1.609 1.609 weight 1.000 ! spec=13C_NOESY, no=775, id=3161, vol=3.960000e+07
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   82 and name HG22) (segid "   A" and resid   14 and name  HB2) 2.864 1.026 1.026 weight 1.000 ! spec=13C_NOESY, no=776, id=3162, vol=3.960000e+07
    or (segid "   A" and resid   82 and name HG21) (segid "   A" and resid   14 and name  HB2)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid   14 and name  HB2)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HG2) 3.494 1.526 1.526 weight 1.000 ! spec=13C_NOESY, no=780, id=3166, vol=3.940000e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   32 and name HG12) 3.152 1.242 1.242 weight 1.000 ! spec=13C_NOESY, no=781, id=3167, vol=3.940000e+07
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   76 and name  HB2) 3.397 1.443 1.443 weight 1.000 ! spec=13C_NOESY, no=786, id=3172, vol=3.890000e+07
    or (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HG11) 3.004 1.128 1.128 weight 1.000 ! spec=13C_NOESY, no=790, id=3175, vol=3.860000e+07
assign (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   31 and name  HD2) 2.847 1.013 1.013 weight 1.000 ! spec=13C_NOESY, no=791, id=3176, vol=3.840000e+07
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   17 and name  HB2) 2.801 0.980 0.980 weight 1.000 ! spec=13C_NOESY, no=792, id=3177, vol=3.840000e+07
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   81 and name  HD1) 3.501 1.533 1.533 weight 1.000 ! spec=13C_NOESY, no=793, id=3178, vol=3.830000e+07
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name  HB1) 3.364 1.415 1.415 weight 1.000 ! spec=13C_NOESY, no=796, id=3181, vol=3.820000e+07
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name  HE2) 3.591 1.612 1.612 weight 1.000 ! spec=13C_NOESY, no=797, id=3182, vol=3.810000e+07
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   71 and name   HZ) 3.546 1.572 1.572 weight 1.000 ! spec=13C_NOESY, no=799, id=3184, vol=3.780000e+07
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   72 and name  HE1) 3.602 1.622 1.622 weight 1.000 ! spec=13C_NOESY, no=800, id=3185, vol=3.770000e+07
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   32 and name HG12) 3.950 1.950 1.950 weight 1.000 ! spec=13C_NOESY, no=802, id=3187, vol=3.760000e+07
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name  HB1) 3.010 1.133 1.133 weight 1.000 ! spec=13C_NOESY, no=803, id=3188, vol=3.760000e+07
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name  HD2) 3.516 1.545 1.545 weight 1.000 ! spec=13C_NOESY, no=807, id=3192, vol=3.720000e+07
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   36 and name  HE2) 3.576 1.598 1.598 weight 1.000 ! spec=13C_NOESY, no=810, id=3194, vol=3.700000e+07
    or (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   35 and name  HB3) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   35 and name  HB3) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   35 and name  HB3) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   54 and name   HA) 3.139 1.232 1.232 weight 1.000 ! spec=13C_NOESY, no=813, id=3197, vol=3.690000e+07
assign (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name   HA) 3.019 1.139 1.139 weight 1.000 ! spec=13C_NOESY, no=818, id=3202, vol=3.660000e+07
assign (segid "   A" and resid   31 and name  HE2) (segid "   A" and resid   31 and name  HG1) 3.716 1.726 1.726 weight 1.000 ! spec=13C_NOESY, no=825, id=3208, vol=3.610000e+07
assign (segid "   A" and resid   66 and name  HE1) (segid "   A" and resid   37 and name HG22) 3.580 1.602 1.602 weight 1.000 ! spec=13C_NOESY, no=826, id=3209, vol=3.590000e+07
    or (segid "   A" and resid   66 and name  HE1) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   66 and name  HE1) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   41 and name HD12) 3.306 1.366 1.366 weight 1.000 ! spec=13C_NOESY, no=831, id=3214, vol=3.570000e+07
    or (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   80 and name  HG2) (segid "   A" and resid   44 and name  HB2) 3.263 1.331 1.331 weight 1.000 ! spec=13C_NOESY, no=832, id=3215, vol=3.560000e+07
    or (segid "   A" and resid   80 and name  HG2) (segid "   A" and resid   44 and name  HB1)
    or (segid "   A" and resid   80 and name  HG2) (segid "   A" and resid   44 and name  HB3)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name HD12) 3.786 1.792 1.792 weight 1.000 ! spec=13C_NOESY, no=837, id=3219, vol=3.510000e+07
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid    8 and name HG22) 3.617 1.635 1.635 weight 1.000 ! spec=13C_NOESY, no=840, id=3222, vol=3.490000e+07
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid    8 and name HG23)
assign (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  106 and name   HN) 3.374 1.423 1.423 weight 1.000 ! spec=13C_NOESY, no=841, id=3223, vol=3.480000e+07
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name  HD1) 3.615 1.634 1.634 weight 1.000 ! spec=13C_NOESY, no=847, id=3229, vol=3.460000e+07
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   97 and name  HB2) 3.074 1.181 1.181 weight 1.000 ! spec=13C_NOESY, no=848, id=3230, vol=3.450000e+07
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   57 and name  HE1) 3.741 1.749 1.749 weight 1.000 ! spec=13C_NOESY, no=849, id=3231, vol=3.450000e+07
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   57 and name  HE1)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   57 and name  HE1)
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   21 and name  HB2) 3.669 1.683 1.683 weight 1.000 ! spec=13C_NOESY, no=852, id=3233, vol=3.450000e+07
    or (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   21 and name  HB3)
assign (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   61 and name  HB2) 3.233 1.307 1.307 weight 1.000 ! spec=13C_NOESY, no=854, id=3235, vol=3.420000e+07
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG22) 3.065 1.174 1.174 weight 1.000 ! spec=13C_NOESY, no=855, id=3236, vol=3.410000e+07
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid   91 and name   HN) 3.454 1.491 1.491 weight 1.000 ! spec=13C_NOESY, no=857, id=3238, vol=3.390000e+07
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   64 and name HD22) 3.332 1.388 1.388 weight 1.000 ! spec=13C_NOESY, no=860, id=3240, vol=3.390000e+07
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   64 and name HD22)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   64 and name HD22)
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid   16 and name  HB2) 3.708 1.718 1.718 weight 1.000 ! spec=13C_NOESY, no=861, id=3241, vol=3.380000e+07
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid   16 and name  HB2)
    or (segid "   A" and resid  103 and name  HB3) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   40 and name HD22) 3.232 1.306 1.306 weight 1.000 ! spec=13C_NOESY, no=863, id=3243, vol=3.370000e+07
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name  HB1) 3.424 1.466 1.466 weight 1.000 ! spec=13C_NOESY, no=872, id=3250, vol=3.290000e+07
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name   HG) 2.947 1.086 1.086 weight 1.000 ! spec=13C_NOESY, no=880, id=3258, vol=3.270000e+07
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   57 and name  HE2) 3.339 1.394 1.394 weight 1.000 ! spec=13C_NOESY, no=881, id=3259, vol=3.270000e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   57 and name  HE2)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   57 and name  HE2)
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   20 and name HG21) 3.412 1.456 1.456 weight 1.000 ! spec=13C_NOESY, no=882, id=3260, vol=3.270000e+07
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   20 and name HG23)
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   30 and name   HN) 3.084 1.189 1.189 weight 1.000 ! spec=13C_NOESY, no=883, id=3261, vol=3.260000e+07
assign (segid "   A" and resid   53 and name HD12) (segid "   A" and resid   42 and name   HN) 3.499 1.530 1.530 weight 1.000 ! spec=13C_NOESY, no=886, id=3264, vol=3.250000e+07
    or (segid "   A" and resid   53 and name HD11) (segid "   A" and resid   42 and name   HN)
    or (segid "   A" and resid   53 and name HD13) (segid "   A" and resid   42 and name   HN)
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HG2) 3.290 1.353 1.353 weight 1.000 ! spec=13C_NOESY, no=888, id=3266, vol=3.240000e+07
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG12) 3.256 1.325 1.325 weight 1.000 ! spec=13C_NOESY, no=889, id=3267, vol=3.230000e+07
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name  HB2) 2.966 1.100 1.100 weight 1.000 ! spec=13C_NOESY, no=894, id=3272, vol=3.200000e+07
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   28 and name   HN) 3.902 1.903 1.903 weight 1.000 ! spec=13C_NOESY, no=895, id=3273, vol=3.200000e+07
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   28 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   28 and name   HN)
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   76 and name  HB2) 3.357 1.409 1.409 weight 1.000 ! spec=13C_NOESY, no=896, id=3274, vol=3.190000e+07
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   32 and name HG12) 3.437 1.477 1.477 weight 1.000 ! spec=13C_NOESY, no=898, id=3276, vol=3.180000e+07
    or (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name   HB) 3.147 1.238 1.238 weight 1.000 ! spec=13C_NOESY, no=899, id=3277, vol=3.180000e+07
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   57 and name  HE2) 3.527 1.555 1.555 weight 1.000 ! spec=13C_NOESY, no=900, id=3278, vol=3.170000e+07
assign (segid "   A" and resid   85 and name HG12) (segid "   A" and resid   85 and name   HN) 3.114 1.212 1.212 weight 1.000 ! spec=13C_NOESY, no=906, id=3283, vol=3.150000e+07
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   32 and name HG12) 3.388 1.435 1.435 weight 1.000 ! spec=13C_NOESY, no=908, id=3285, vol=3.130000e+07
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   81 and name  HD1) 3.489 1.521 1.521 weight 1.000 ! spec=13C_NOESY, no=910, id=3287, vol=3.130000e+07
assign (segid "   A" and resid   51 and name  HG1) (segid "   A" and resid   50 and name  HE3) 3.385 1.432 1.432 weight 1.000 ! spec=13C_NOESY, no=911, id=3288, vol=3.110000e+07
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HD22) 3.122 1.219 1.219 weight 1.000 ! spec=13C_NOESY, no=913, id=3290, vol=3.110000e+07
    or (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   82 and name HG12) 3.091 1.194 1.194 weight 1.000 ! spec=13C_NOESY, no=916, id=3293, vol=3.100000e+07
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   83 and name  HG2) 2.693 0.907 0.907 weight 1.000 ! spec=13C_NOESY, no=918, id=3295, vol=3.100000e+07
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name  HG2) 3.821 1.825 1.825 weight 1.000 ! spec=13C_NOESY, no=919, id=3296, vol=3.100000e+07
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   86 and name  HB2) 3.928 1.929 1.929 weight 1.000 ! spec=13C_NOESY, no=920, id=3297, vol=3.090000e+07
    or (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name   HB) 3.064 1.174 1.174 weight 1.000 ! spec=13C_NOESY, no=924, id=3300, vol=3.070000e+07
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   22 and name  HB2) 3.837 1.840 1.840 weight 1.000 ! spec=13C_NOESY, no=929, id=3305, vol=3.050000e+07
assign (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   39 and name   HA) 3.229 1.304 1.304 weight 1.000 ! spec=13C_NOESY, no=933, id=3309, vol=3.040000e+07
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG22) 3.607 1.626 1.626 weight 1.000 ! spec=13C_NOESY, no=935, id=3311, vol=3.040000e+07
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   48 and name HD12) 3.436 1.476 1.476 weight 1.000 ! spec=13C_NOESY, no=939, id=3314, vol=3.010000e+07
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   48 and name HD13)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name  HB2) 3.346 1.399 1.399 weight 1.000 ! spec=13C_NOESY, no=941, id=3316, vol=2.990000e+07
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  102 and name  HB2) 3.160 1.248 1.248 weight 1.000 ! spec=13C_NOESY, no=942, id=3317, vol=2.990000e+07
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   21 and name  HB2) 3.743 1.751 1.751 weight 1.000 ! spec=13C_NOESY, no=943, id=3318, vol=2.980000e+07
    or (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   21 and name  HB3)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name  HB2) 3.212 1.290 1.290 weight 1.000 ! spec=13C_NOESY, no=947, id=3322, vol=2.970000e+07
assign (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   22 and name  HD1) 3.539 1.565 1.565 weight 1.000 ! spec=13C_NOESY, no=948, id=3323, vol=2.960000e+07
assign (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   31 and name  HB2) 3.967 1.967 1.967 weight 1.000 ! spec=13C_NOESY, no=949, id=3324, vol=2.960000e+07
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   75 and name HG12) 3.605 1.625 1.625 weight 1.000 ! spec=13C_NOESY, no=951, id=3326, vol=2.950000e+07
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   75 and name HG22) 3.741 1.750 1.750 weight 1.000 ! spec=13C_NOESY, no=955, id=3330, vol=2.930000e+07
    or (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   75 and name HG23)
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   52 and name   HN) 3.111 1.210 1.210 weight 1.000 ! spec=13C_NOESY, no=956, id=3331, vol=2.930000e+07
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   16 and name HE21) 3.979 1.979 1.979 weight 1.000 ! spec=13C_NOESY, no=957, id=3332, vol=2.920000e+07
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   70 and name  HB2) 3.412 1.455 1.455 weight 1.000 ! spec=13C_NOESY, no=958, id=3333, vol=2.920000e+07
    or (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   70 and name  HB3)
assign (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   26 and name  HB2) 3.897 1.898 1.898 weight 1.000 ! spec=13C_NOESY, no=964, id=3339, vol=2.870000e+07
    or (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name  HG2) 3.420 1.462 1.462 weight 1.000 ! spec=13C_NOESY, no=965, id=3340, vol=2.860000e+07
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HG1) 3.825 1.829 1.829 weight 1.000 ! spec=13C_NOESY, no=966, id=3341, vol=2.860000e+07
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   74 and name HD22) 3.634 1.651 1.651 weight 1.000 ! spec=13C_NOESY, no=967, id=3342, vol=2.850000e+07
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   74 and name HD21)
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   74 and name HD23)
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   14 and name  HB1) 3.828 1.831 1.831 weight 1.000 ! spec=13C_NOESY, no=968, id=3343, vol=2.840000e+07
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   66 and name  HB2) 3.061 1.171 1.171 weight 1.000 ! spec=13C_NOESY, no=969, id=3344, vol=2.840000e+07
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name  HB2) 2.758 0.951 0.951 weight 1.000 ! spec=13C_NOESY, no=972, id=3347, vol=2.780000e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   40 and name  HB1) 3.031 1.148 1.148 weight 1.000 ! spec=13C_NOESY, no=974, id=3348, vol=2.770000e+07
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid  102 and name  HB1) 3.767 1.774 1.774 weight 1.000 ! spec=13C_NOESY, no=975, id=3349, vol=2.760000e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   40 and name   HN) 3.120 1.217 1.217 weight 1.000 ! spec=13C_NOESY, no=978, id=3352, vol=2.730000e+07
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   36 and name  HE2) 3.391 1.437 1.437 weight 1.000 ! spec=13C_NOESY, no=980, id=3354, vol=2.730000e+07
    or (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   40 and name HD12) 3.438 1.478 1.478 weight 1.000 ! spec=13C_NOESY, no=983, id=3357, vol=2.710000e+07
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   22 and name   HZ) (segid "   A" and resid   68 and name  HD2) 4.041 2.041 2.041 weight 1.000 ! spec=13C_NOESY, no=986, id=3360, vol=2.710000e+07
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   40 and name   HN) 4.020 2.020 2.020 weight 1.000 ! spec=13C_NOESY, no=988, id=3362, vol=2.700000e+07
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   40 and name   HN)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   40 and name   HN)
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   66 and name   HN) 4.054 2.055 2.055 weight 1.000 ! spec=13C_NOESY, no=991, id=3365, vol=2.690000e+07
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   37 and name HG22) 3.920 1.921 1.921 weight 1.000 ! spec=13C_NOESY, no=993, id=3367, vol=2.690000e+07
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   41 and name   HN) 2.984 1.113 1.113 weight 1.000 ! spec=13C_NOESY, no=994, id=3368, vol=2.680000e+07
assign (segid "   A" and resid   59 and name  HA1) (segid "   A" and resid   60 and name  HD1) 3.620 1.638 1.638 weight 1.000 ! spec=13C_NOESY, no=996, id=3370, vol=2.680000e+07
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   86 and name   HA) 4.260 2.269 2.269 weight 1.000 ! spec=13C_NOESY, no=999, id=3373, vol=2.670000e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   23 and name   HG) 3.711 1.721 1.721 weight 1.000 ! spec=13C_NOESY, no=1001, id=3375, vol=2.660000e+07
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   32 and name HG22) 3.347 1.400 1.400 weight 1.000 ! spec=13C_NOESY, no=1003, id=3377, vol=2.650000e+07
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HD12) 3.852 1.855 1.855 weight 1.000 ! spec=13C_NOESY, no=1005, id=3379, vol=2.640000e+07
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   10 and name HG12) 3.206 1.284 1.284 weight 1.000 ! spec=13C_NOESY, no=1007, id=3380, vol=2.630000e+07
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   10 and name HG12)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   10 and name HG12)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HG2) 3.703 1.714 1.714 weight 1.000 ! spec=13C_NOESY, no=1012, id=3385, vol=2.610000e+07
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   57 and name  HB2) 3.578 1.600 1.600 weight 1.000 ! spec=13C_NOESY, no=1015, id=3388, vol=2.610000e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HG12) 3.309 1.369 1.369 weight 1.000 ! spec=13C_NOESY, no=1019, id=3391, vol=2.590000e+07
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   60 and name  HD1) 3.219 1.295 1.295 weight 1.000 ! spec=13C_NOESY, no=1025, id=3397, vol=2.560000e+07
assign (segid "   A" and resid  110 and name   HA) (segid "   A" and resid  110 and name  HB2) 3.254 1.323 1.323 weight 1.000 ! spec=13C_NOESY, no=1026, id=3398, vol=2.550000e+07
assign (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   56 and name  HB2) 4.227 2.234 2.234 weight 1.000 ! spec=13C_NOESY, no=1028, id=3400, vol=2.550000e+07
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name   HB) 3.252 1.322 1.322 weight 1.000 ! spec=13C_NOESY, no=1033, id=3405, vol=2.520000e+07
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   91 and name   HA) 3.291 1.354 1.354 weight 1.000 ! spec=13C_NOESY, no=1041, id=3412, vol=2.490000e+07
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   22 and name  HD1) 3.802 1.807 1.807 weight 1.000 ! spec=13C_NOESY, no=1043, id=3414, vol=2.480000e+07
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   76 and name   HN) 3.242 1.313 1.313 weight 1.000 ! spec=13C_NOESY, no=1049, id=3419, vol=2.460000e+07
assign (segid "   A" and resid   31 and name  HE2) (segid "   A" and resid   31 and name  HB2) 3.551 1.576 1.576 weight 1.000 ! spec=13C_NOESY, no=1053, id=3422, vol=2.440000e+07
assign (segid "   A" and resid   29 and name  HG2) (segid "   A" and resid   27 and name HE21) 3.460 1.496 1.496 weight 1.000 ! spec=13C_NOESY, no=1054, id=3423, vol=2.430000e+07
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   84 and name   HN) 3.551 1.576 1.576 weight 1.000 ! spec=13C_NOESY, no=1063, id=3432, vol=2.400000e+07
assign (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   53 and name HD22) 3.630 1.647 1.647 weight 1.000 ! spec=13C_NOESY, no=1064, id=3433, vol=2.400000e+07
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid  112 and name  HB1) (segid "   A" and resid  110 and name  HB2) 3.651 1.666 1.666 weight 1.000 ! spec=13C_NOESY, no=1065, id=3434, vol=2.390000e+07
assign (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   31 and name  HG2) 4.250 2.258 2.258 weight 1.000 ! spec=13C_NOESY, no=1068, id=3437, vol=2.380000e+07
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   69 and name   HN) 3.558 1.583 1.583 weight 1.000 ! spec=13C_NOESY, no=1070, id=3439, vol=2.370000e+07
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   15 and name HG21) 3.915 1.916 1.916 weight 1.000 ! spec=13C_NOESY, no=1072, id=3441, vol=2.360000e+07
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   81 and name  HE1) 3.892 1.893 1.893 weight 1.000 ! spec=13C_NOESY, no=1073, id=3442, vol=2.360000e+07
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   81 and name  HE1)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   81 and name  HE1)
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   12 and name  HD2) 3.603 1.623 1.623 weight 1.000 ! spec=13C_NOESY, no=1081, id=3449, vol=2.340000e+07
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   85 and name   HN) 3.315 1.374 1.374 weight 1.000 ! spec=13C_NOESY, no=1082, id=3450, vol=2.330000e+07
assign (segid "   A" and resid   51 and name  HG2) (segid "   A" and resid   50 and name  HE3) 3.546 1.572 1.572 weight 1.000 ! spec=13C_NOESY, no=1085, id=3453, vol=2.330000e+07
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   15 and name HG21) 3.830 1.833 1.833 weight 1.000 ! spec=13C_NOESY, no=1090, id=3457, vol=2.310000e+07
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    8 and name HG12) 3.781 1.787 1.787 weight 1.000 ! spec=13C_NOESY, no=1092, id=3459, vol=2.300000e+07
    or (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    8 and name HG11)
    or (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    8 and name HG13)
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   75 and name   HA) 3.650 1.665 1.665 weight 1.000 ! spec=13C_NOESY, no=1100, id=3465, vol=2.250000e+07
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   75 and name   HA)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   75 and name   HA)
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   31 and name   HN) 3.375 1.424 1.424 weight 1.000 ! spec=13C_NOESY, no=1103, id=3468, vol=2.220000e+07
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   20 and name HG21) 3.577 1.599 1.599 weight 1.000 ! spec=13C_NOESY, no=1105, id=3470, vol=2.220000e+07
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   20 and name HG23)
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name  HB2) 3.400 1.445 1.445 weight 1.000 ! spec=13C_NOESY, no=1106, id=3471, vol=2.210000e+07
assign (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   76 and name  HB2) 3.472 1.507 1.507 weight 1.000 ! spec=13C_NOESY, no=1108, id=3472, vol=2.210000e+07
    or (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB2) 3.704 1.715 1.715 weight 1.000 ! spec=13C_NOESY, no=1110, id=3474, vol=2.200000e+07
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   57 and name   HN) 4.381 2.400 2.400 weight 1.000 ! spec=13C_NOESY, no=1118, id=3482, vol=2.150000e+07
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   57 and name   HN)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   57 and name   HN)
assign (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   74 and name   HN) 4.004 2.004 2.004 weight 1.000 ! spec=13C_NOESY, no=1120, id=3483, vol=2.150000e+07
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   74 and name   HN)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   74 and name   HN)
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   35 and name   HN) 3.849 1.852 1.852 weight 1.000 ! spec=13C_NOESY, no=1123, id=3486, vol=2.140000e+07
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   35 and name   HN)
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   35 and name   HN)
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   53 and name HD12) 3.730 1.739 1.739 weight 1.000 ! spec=13C_NOESY, no=1125, id=3488, vol=2.130000e+07
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name  HB2) 4.183 2.187 2.187 weight 1.000 ! spec=13C_NOESY, no=1129, id=3492, vol=2.110000e+07
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HB2) 3.378 1.427 1.427 weight 1.000 ! spec=13C_NOESY, no=1133, id=3496, vol=2.090000e+07
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   35 and name  HB2) 4.097 2.098 2.098 weight 1.000 ! spec=13C_NOESY, no=1135, id=3498, vol=2.080000e+07
    or (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   35 and name  HB3)
assign (segid "   A" and resid   54 and name HE22) (segid "   A" and resid   54 and name  HG2) 3.082 1.187 1.187 weight 1.000 ! spec=13C_NOESY, no=1136, id=3499, vol=2.070000e+07
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   21 and name   HA) 3.731 1.740 1.740 weight 1.000 ! spec=13C_NOESY, no=1137, id=3500, vol=2.060000e+07
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   74 and name HD12) 3.821 1.825 1.825 weight 1.000 ! spec=13C_NOESY, no=1143, id=3506, vol=2.010000e+07
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    9 and name  HD2) 3.285 1.349 1.349 weight 1.000 ! spec=13C_NOESY, no=1145, id=3508, vol=2.010000e+07
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   53 and name HD22) 3.937 1.937 1.937 weight 1.000 ! spec=13C_NOESY, no=1146, id=3509, vol=2.000000e+07
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   53 and name HD23)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   53 and name HD22)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   53 and name HD23)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   53 and name HD22)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD22) 3.838 1.841 1.841 weight 1.000 ! spec=13C_NOESY, no=1150, id=3513, vol=1.960000e+07
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   49 and name   HN) 4.309 2.321 2.321 weight 1.000 ! spec=13C_NOESY, no=1151, id=3514, vol=1.950000e+07
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   49 and name   HN)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   49 and name   HN)
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HD12) 3.306 1.366 1.366 weight 1.000 ! spec=13C_NOESY, no=1153, id=3516, vol=1.950000e+07
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD12) 3.666 1.680 1.680 weight 1.000 ! spec=13C_NOESY, no=1155, id=3518, vol=1.940000e+07
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   48 and name HD12) 3.969 1.970 1.970 weight 1.000 ! spec=13C_NOESY, no=1158, id=3521, vol=1.930000e+07
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   48 and name HD13)
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   23 and name   HN) 4.399 2.418 2.418 weight 1.000 ! spec=13C_NOESY, no=1169, id=3530, vol=1.900000e+07
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   23 and name   HN)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   23 and name   HN)
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   36 and name  HE2) 3.805 1.810 1.810 weight 1.000 ! spec=13C_NOESY, no=1171, id=3532, vol=1.880000e+07
    or (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   60 and name  HD2) 3.293 1.356 1.356 weight 1.000 ! spec=13C_NOESY, no=1176, id=3537, vol=1.860000e+07
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   72 and name  HB1) 4.208 2.213 2.213 weight 1.000 ! spec=13C_NOESY, no=1179, id=3540, vol=1.860000e+07
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   40 and name HD22) 3.514 1.544 1.544 weight 1.000 ! spec=13C_NOESY, no=1180, id=3541, vol=1.840000e+07
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   37 and name HG22) 4.270 2.279 2.279 weight 1.000 ! spec=13C_NOESY, no=1181, id=3542, vol=1.840000e+07
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   74 and name HD22) 4.198 2.202 2.202 weight 1.000 ! spec=13C_NOESY, no=1189, id=3550, vol=1.790000e+07
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   74 and name HD21)
    or (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   74 and name HD23)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HB2) 3.313 1.372 1.372 weight 1.000 ! spec=13C_NOESY, no=1190, id=3551, vol=1.790000e+07
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   20 and name HG21) 3.940 1.940 1.940 weight 1.000 ! spec=13C_NOESY, no=1192, id=3553, vol=1.780000e+07
    or (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   20 and name HG23)
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   28 and name  HA2) 4.634 2.684 2.684 weight 1.000 ! spec=13C_NOESY, no=1195, id=3556, vol=1.760000e+07
assign (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   14 and name  HB1) 4.376 2.393 2.393 weight 1.000 ! spec=13C_NOESY, no=1201, id=3562, vol=1.720000e+07
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   14 and name  HB1)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   14 and name  HB1)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   10 and name HG22) 4.138 2.140 2.140 weight 1.000 ! spec=13C_NOESY, no=1203, id=3564, vol=1.690000e+07
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   10 and name HG23)
assign (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  101 and name HD12) 3.551 1.577 1.577 weight 1.000 ! spec=13C_NOESY, no=1205, id=3565, vol=1.660000e+07
    or (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  101 and name HD11)
    or (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  101 and name HD13)
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   13 and name   HN) 3.611 1.630 1.630 weight 1.000 ! spec=13C_NOESY, no=1208, id=3568, vol=1.640000e+07
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   35 and name  HB2) 4.187 2.191 2.191 weight 1.000 ! spec=13C_NOESY, no=1209, id=3569, vol=1.630000e+07
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   35 and name  HB3)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   10 and name   HB) 4.499 2.530 2.530 weight 1.000 ! spec=13C_NOESY, no=1211, id=3571, vol=1.610000e+07
assign (segid "   A" and resid   10 and name HG12) (segid "   A" and resid    8 and name HG12) 4.544 2.581 2.581 weight 1.000 ! spec=13C_NOESY, no=1219, id=3576, vol=1.540000e+07
    or (segid "   A" and resid   10 and name HG12) (segid "   A" and resid    8 and name HG11)
    or (segid "   A" and resid   10 and name HG12) (segid "   A" and resid    8 and name HG13)
assign (segid "   A" and resid   46 and name  HG2) (segid "   A" and resid   42 and name  HB2) 4.479 2.508 2.508 weight 1.000 ! spec=13C_NOESY, no=1221, id=3578, vol=1.520000e+07
assign (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid   16 and name  HB2) 3.138 1.231 1.231 weight 1.000 ! spec=13C_NOESY, no=1222, id=3579, vol=1.510000e+07
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name   HG) 3.623 1.641 1.641 weight 1.000 ! spec=13C_NOESY, no=1226, id=3583, vol=1.480000e+07
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   21 and name   HA) 4.546 2.583 2.583 weight 1.000 ! spec=13C_NOESY, no=1227, id=3584, vol=1.480000e+07
assign (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   19 and name  HD2) 3.740 1.749 1.749 weight 1.000 ! spec=13C_NOESY, no=1229, id=3586, vol=1.470000e+07
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   19 and name  HD2)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   19 and name  HD2)
assign (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   41 and name   HB) 4.344 2.358 2.358 weight 1.000 ! spec=13C_NOESY, no=1230, id=3587, vol=1.470000e+07
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   33 and name HG21) 4.280 2.290 2.290 weight 1.000 ! spec=13C_NOESY, no=1233, id=3589, vol=1.450000e+07
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   33 and name HG23)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG12) 3.556 1.581 1.581 weight 1.000 ! spec=13C_NOESY, no=1236, id=3591, vol=1.430000e+07
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   76 and name  HB2) 4.305 2.316 2.316 weight 1.000 ! spec=13C_NOESY, no=1237, id=3592, vol=1.430000e+07
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   58 and name   HN) 4.198 2.202 2.202 weight 1.000 ! spec=13C_NOESY, no=1238, id=3593, vol=1.410000e+07
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   58 and name   HN)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   58 and name   HN)
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   69 and name   HN) 4.403 2.424 2.424 weight 1.000 ! spec=13C_NOESY, no=1239, id=3594, vol=1.400000e+07
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   69 and name   HN)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   69 and name   HN)
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   63 and name  HB2) 4.629 2.678 2.678 weight 1.000 ! spec=13C_NOESY, no=1243, id=3598, vol=1.350000e+07
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   63 and name  HB1)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   63 and name  HB3)
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   19 and name  HE2) 3.649 1.664 1.664 weight 1.000 ! spec=13C_NOESY, no=1246, id=3600, vol=1.330000e+07
assign (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   31 and name  HB2) 4.460 2.486 2.486 weight 1.000 ! spec=13C_NOESY, no=1248, id=3602, vol=1.300000e+07
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   26 and name  HB2) 4.193 2.197 2.197 weight 1.000 ! spec=13C_NOESY, no=1258, id=3611, vol=1.220000e+07
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   71 and name  HD1) 4.068 2.068 2.068 weight 1.000 ! spec=13C_NOESY, no=1259, id=3612, vol=1.210000e+07
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   71 and name  HD1)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   71 and name  HD1)
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   90 and name  HD2) 4.215 2.220 2.220 weight 1.000 ! spec=13C_NOESY, no=1262, id=3613, vol=1.210000e+07
assign (segid "   A" and resid   94 and name  HG2) (segid "   A" and resid   94 and name   HN) 3.869 1.871 1.871 weight 1.000 ! spec=13C_NOESY, no=1265, id=3616, vol=1.180000e+07
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    8 and name HG22) 4.460 2.486 2.486 weight 1.000 ! spec=13C_NOESY, no=1266, id=3617, vol=1.180000e+07
    or (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    8 and name HG23)
assign (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   74 and name HD22) 4.344 2.359 2.359 weight 1.000 ! spec=13C_NOESY, no=1270, id=3621, vol=1.140000e+07
    or (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   74 and name HD21)
    or (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   74 and name HD23)
assign (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   44 and name  HB2) 4.280 2.289 2.289 weight 1.000 ! spec=13C_NOESY, no=1271, id=3622, vol=1.140000e+07
    or (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   44 and name  HB1)
    or (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   44 and name  HB3)
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   90 and name  HD1) 3.699 1.710 1.710 weight 1.000 ! spec=13C_NOESY, no=1272, id=3623, vol=1.140000e+07
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   41 and name HD12) 4.348 2.363 2.363 weight 1.000 ! spec=13C_NOESY, no=1273, id=3624, vol=1.130000e+07
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   83 and name  HD2) 4.381 2.399 2.399 weight 1.000 ! spec=13C_NOESY, no=1274, id=3625, vol=1.130000e+07
assign (segid "   A" and resid   66 and name  HE1) (segid "   A" and resid   74 and name   HG) 4.554 2.593 2.593 weight 1.000 ! spec=13C_NOESY, no=1277, id=3628, vol=1.110000e+07
assign (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name   HB) 3.670 1.684 1.684 weight 1.000 ! spec=13C_NOESY, no=1280, id=3631, vol=1.090000e+07
assign (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   23 and name HD12) 3.914 1.915 1.915 weight 1.000 ! spec=13C_NOESY, no=1283, id=3634, vol=1.050000e+07
    or (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   23 and name HD11)
    or (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   23 and name HD13)
assign (segid "   A" and resid   23 and name HD12) (segid "   A" and resid   68 and name  HB1) 4.368 2.385 2.385 weight 1.000 ! spec=13C_NOESY, no=1284, id=3635, vol=1.030000e+07
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid   68 and name  HB1)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid   68 and name  HB1)
assign (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   36 and name  HE2) 4.048 2.048 2.048 weight 1.000 ! spec=13C_NOESY, no=1287, id=3638, vol=1.010000e+07
    or (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   36 and name  HE2) 4.639 2.690 2.690 weight 1.000 ! spec=13C_NOESY, no=1288, id=3639, vol=1.010000e+07
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   20 and name HG21) 4.299 2.310 2.310 weight 1.000 ! spec=13C_NOESY, no=1290, id=3641, vol=1.000000e+07
    or (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   20 and name HG23)
assign (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HD12) 4.179 2.183 2.183 weight 1.000 ! spec=13C_NOESY, no=1298, id=3648, vol=9.380000e+06
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HD11)
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HD13)
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   60 and name  HD2) 4.474 2.502 2.502 weight 1.000 ! spec=13C_NOESY, no=1301, id=3650, vol=9.110000e+06
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   36 and name  HG1) 4.691 2.750 2.750 weight 1.000 ! spec=13C_NOESY, no=1305, id=3654, vol=8.440000e+06
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   26 and name   HN) 4.451 2.476 2.476 weight 1.000 ! spec=13C_NOESY, no=1307, id=3656, vol=8.340000e+06
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   26 and name   HN)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   26 and name   HN)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   39 and name HE21) 4.824 2.908 2.908 weight 1.000 ! spec=13C_NOESY, no=1309, id=3658, vol=8.160000e+06
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   39 and name HE21)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   39 and name HE21)
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   56 and name   HN) 5.040 3.175 3.175 weight 1.000 ! spec=13C_NOESY, no=1311, id=3660, vol=7.920000e+06
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   37 and name   HB) 4.328 2.341 2.341 weight 1.000 ! spec=13C_NOESY, no=1313, id=3662, vol=7.820000e+06
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   57 and name  HG2) 4.828 2.914 2.914 weight 1.000 ! spec=13C_NOESY, no=1316, id=3664, vol=7.300000e+06
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   89 and name  HE1) 4.886 2.984 2.984 weight 1.000 ! spec=13C_NOESY, no=1318, id=3666, vol=7.180000e+06
assign (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   74 and name  HB2) 4.204 2.210 2.210 weight 1.000 ! spec=13C_NOESY, no=1323, id=3671, vol=6.740000e+06
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   74 and name  HB2)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   74 and name  HB2)
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name HD22) 3.952 1.952 1.952 weight 1.000 ! spec=13C_NOESY, no=1324, id=3672, vol=6.700000e+06
    or (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   53 and name HD12) (segid "   A" and resid   48 and name  HB1) 4.706 2.769 2.769 weight 1.000 ! spec=13C_NOESY, no=1327, id=3675, vol=6.170000e+06
    or (segid "   A" and resid   53 and name HD11) (segid "   A" and resid   48 and name  HB1)
    or (segid "   A" and resid   53 and name HD13) (segid "   A" and resid   48 and name  HB1)
assign (segid "   A" and resid   64 and name  HB1) (segid "   A" and resid   57 and name  HE1) 4.918 3.024 3.024 weight 1.000 ! spec=13C_NOESY, no=1328, id=3676, vol=6.110000e+06
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD12) 4.598 2.643 2.643 weight 1.000 ! spec=13C_NOESY, no=1333, id=3681, vol=5.580000e+06
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid  104 and name   HG) (segid "   A" and resid  104 and name HD12) 4.017 2.017 2.017 weight 1.000 ! spec=13C_NOESY, no=1339, id=3686, vol=5.070000e+06
    or (segid "   A" and resid  104 and name   HG) (segid "   A" and resid  104 and name HD11)
    or (segid "   A" and resid  104 and name   HG) (segid "   A" and resid  104 and name HD13)
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   18 and name HD12) 4.402 2.422 2.422 weight 1.000 ! spec=13C_NOESY, no=1342, id=3687, vol=4.730000e+06
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   18 and name HD12) 5.221 3.407 3.407 weight 1.000 ! spec=13C_NOESY, no=1343, id=3688, vol=4.590000e+06
    or (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD22) 4.158 2.161 2.161 weight 1.000 ! spec=13C_NOESY, no=1347, id=3691, vol=3.900000e+06
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   31 and name  HE2) (segid "   A" and resid   31 and name  HG2) 5.053 3.191 3.191 weight 1.000 ! spec=13C_NOESY, no=1353, id=3696, vol=3.420000e+06
assign (segid "   A" and resid    8 and name   HB) (segid "   A" and resid   10 and name HD12) 5.182 3.356 3.356 weight 1.000 ! spec=13C_NOESY, no=1355, id=3698, vol=2.940000e+06
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid   10 and name HD11)
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid   10 and name HD13)
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   88 and name   HN) 5.451 3.714 3.714 weight 1.000 ! spec=13C_NOESY, no=1358, id=3701, vol=2.550000e+06
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name   HN) 6.054 4.581 4.581 weight 1.000 ! spec=13C_NOESY, no=1360, id=3702, vol=2.310000e+06
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name   HN)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name   HN)
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   26 and name   HN) 5.478 3.751 3.751 weight 1.000 ! spec=13C_NOESY, no=1362, id=3704, vol=2.220000e+06
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   26 and name   HN)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   26 and name   HN)
assign (segid "   A" and resid  104 and name   HA) (segid "   A" and resid  104 and name  HB2) 5.263 3.462 3.462 weight 1.000 ! spec=13C_NOESY, no=1367, id=3709, vol=1.810000e+06
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   19 and name  HE2) 6.101 4.653 4.653 weight 1.000 ! spec=13C_NOESY, no=1370, id=3712, vol=1.700000e+06
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE2) 7.069 6.246 6.246 weight 1.000 ! spec=13C_NOESY, no=1378, id=3718, vol=4.760000e+05
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   32 and name HG12) 16.583 16.583 34.374 weight 1.000 ! spec=13C_NOESY, no=1380, id=3720, vol=2.070000e+03
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid   10 and name   HN) 6.935 6.012 6.012 weight 1.000 ! spec=13C_NOESY, no=1382, id=3722, vol=4.370000e+05
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   25 and name  HD1) 6.255 4.890 4.890 weight 1.000 ! spec=13C_NOESY, no=1384, id=3723, vol=1.140000e+06
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HG22) 6.000 4.500 4.500 weight 1.000 ! spec=13C_NOESY, no=1385, id=3724, vol=1.370000e+06
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   23 and name HD12) (segid "   A" and resid   25 and name  HE1) 4.934 3.043 3.043 weight 1.000 ! spec=13C_NOESY, no=1389, id=3726, vol=1.840000e+06
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid   25 and name  HE1)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid   25 and name  HE1)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   66 and name  HE1) 5.907 4.362 4.362 weight 1.000 ! spec=13C_NOESY, no=1390, id=3727, vol=1.880000e+06
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   66 and name  HE1)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   66 and name  HE1)
assign (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   85 and name HG22) 6.093 4.641 4.641 weight 1.000 ! spec=13C_NOESY, no=1391, id=3728, vol=1.880000e+06
    or (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   89 and name  HB2) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name  HB2) 4.945 3.057 3.057 weight 1.000 ! spec=13C_NOESY, no=1394, id=3731, vol=2.950000e+06
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   53 and name   HG) 5.798 4.202 4.202 weight 1.000 ! spec=13C_NOESY, no=1396, id=3733, vol=3.120000e+06
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  105 and name  HB1) 5.303 3.515 3.515 weight 1.000 ! spec=13C_NOESY, no=1402, id=3739, vol=3.620000e+06
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  105 and name  HB1)
    or (segid "   A" and resid  103 and name  HB3) (segid "   A" and resid  105 and name  HB1)
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HE1) 4.931 3.040 3.040 weight 1.000 ! spec=13C_NOESY, no=1403, id=3740, vol=3.650000e+06
assign (segid "   A" and resid   88 and name  HB1) (segid "   A" and resid   87 and name  HB2) 4.886 2.984 2.984 weight 1.000 ! spec=13C_NOESY, no=1404, id=3741, vol=3.670000e+06
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name  HB2) 5.218 3.404 3.404 weight 1.000 ! spec=13C_NOESY, no=1414, id=3749, vol=4.580000e+06
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name  HB3)
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HG2) 4.461 2.487 2.487 weight 1.000 ! spec=13C_NOESY, no=1416, id=3751, vol=4.790000e+06
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid  103 and name  HB2) 3.901 1.902 1.902 weight 1.000 ! spec=13C_NOESY, no=1421, id=3756, vol=5.790000e+06
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name HG12) 4.733 2.800 2.800 weight 1.000 ! spec=13C_NOESY, no=1423, id=3758, vol=6.690000e+06
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   36 and name  HE2) 4.444 2.469 2.469 weight 1.000 ! spec=13C_NOESY, no=1424, id=3759, vol=6.820000e+06
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   60 and name   HN) 5.075 3.219 3.219 weight 1.000 ! spec=13C_NOESY, no=1426, id=3760, vol=7.070000e+06
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   60 and name   HN)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   60 and name   HN)
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   85 and name HG22) 4.085 2.086 2.086 weight 1.000 ! spec=13C_NOESY, no=1428, id=3762, vol=7.400000e+06
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   16 and name HE21) 4.591 2.634 2.634 weight 1.000 ! spec=13C_NOESY, no=1437, id=3768, vol=9.080000e+06
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   36 and name  HE2) 4.203 2.208 2.208 weight 1.000 ! spec=13C_NOESY, no=1438, id=3769, vol=9.200000e+06
    or (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  104 and name   HG) 4.263 2.271 2.271 weight 1.000 ! spec=13C_NOESY, no=1441, id=3772, vol=9.600000e+06
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   45 and name   HZ) 3.955 1.956 1.956 weight 1.000 ! spec=13C_NOESY, no=1443, id=3774, vol=1.040000e+07
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   45 and name   HZ)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   45 and name   HZ)
assign (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   36 and name  HE2) 4.394 2.413 2.413 weight 1.000 ! spec=13C_NOESY, no=1458, id=3787, vol=1.360000e+07
    or (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   33 and name HG21) 3.943 1.943 1.943 weight 1.000 ! spec=13C_NOESY, no=1459, id=3788, vol=1.390000e+07
    or (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   33 and name HG21)
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   33 and name HG21)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   33 and name HG23)
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   74 and name  HB2) 4.415 2.436 2.436 weight 1.000 ! spec=13C_NOESY, no=1461, id=3790, vol=1.460000e+07
assign (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   36 and name  HE2) 3.835 1.838 1.838 weight 1.000 ! spec=13C_NOESY, no=1465, id=3793, vol=1.560000e+07
    or (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG21) 4.293 2.304 2.304 weight 1.000 ! spec=13C_NOESY, no=1466, id=3794, vol=1.580000e+07
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG23)
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   53 and name HD12) 3.917 1.918 1.918 weight 1.000 ! spec=13C_NOESY, no=1469, id=3797, vol=1.600000e+07
    or (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   40 and name  HB2) 3.784 1.790 1.790 weight 1.000 ! spec=13C_NOESY, no=1476, id=3802, vol=1.730000e+07
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   83 and name  HB2) 4.143 2.145 2.145 weight 1.000 ! spec=13C_NOESY, no=1483, id=3809, vol=1.920000e+07
assign (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   66 and name  HE1) 3.878 1.880 1.880 weight 1.000 ! spec=13C_NOESY, no=1484, id=3810, vol=1.960000e+07
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   61 and name  HB2) 3.662 1.676 1.676 weight 1.000 ! spec=13C_NOESY, no=1485, id=3811, vol=1.980000e+07
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   40 and name HD12) 4.302 2.313 2.313 weight 1.000 ! spec=13C_NOESY, no=1489, id=3814, vol=2.240000e+07
    or (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   55 and name  HG1) 3.971 1.971 1.971 weight 1.000 ! spec=13C_NOESY, no=1490, id=3815, vol=2.280000e+07
assign (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   75 and name HG12) 3.701 1.712 1.712 weight 1.000 ! spec=13C_NOESY, no=1491, id=3816, vol=2.310000e+07
    or (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid  103 and name  HB2) 4.368 2.384 2.384 weight 1.000 ! spec=13C_NOESY, no=1492, id=3817, vol=2.320000e+07
    or (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   18 and name   HA) 3.999 1.999 1.999 weight 1.000 ! spec=13C_NOESY, no=1494, id=3819, vol=2.440000e+07
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   18 and name   HA)
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid  103 and name  HB2) 3.194 1.275 1.275 weight 1.000 ! spec=13C_NOESY, no=1510, id=3834, vol=3.780000e+07
    or (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   66 and name  HE1) 3.182 1.265 1.265 weight 1.000 ! spec=13C_NOESY, no=1511, id=3835, vol=3.870000e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   66 and name  HE1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   66 and name  HE1)
assign (segid "   A" and resid   19 and name  HD2) (segid "   A" and resid  103 and name  HB2) 3.189 1.272 1.272 weight 1.000 ! spec=13C_NOESY, no=1513, id=3837, vol=4.050000e+07
    or (segid "   A" and resid   19 and name  HD2) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   19 and name  HD2) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HB1) 2.907 1.057 1.057 weight 1.000 ! spec=13C_NOESY, no=1517, id=3840, vol=4.410000e+07
assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   81 and name  HE1) 3.298 1.360 1.360 weight 1.000 ! spec=13C_NOESY, no=1518, id=3841, vol=4.530000e+07
assign (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  103 and name  HB2) 3.041 1.156 1.156 weight 1.000 ! spec=13C_NOESY, no=1520, id=3842, vol=4.620000e+07
    or (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name HD12) 2.809 0.986 0.986 weight 1.000 ! spec=13C_NOESY, no=1521, id=3843, vol=4.690000e+07
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   17 and name  HB2) 2.681 0.899 0.899 weight 1.000 ! spec=13C_NOESY, no=1522, id=3844, vol=4.740000e+07
assign (segid "   A" and resid  101 and name HG11) (segid "   A" and resid  103 and name  HB2) 3.716 1.726 1.726 weight 1.000 ! spec=13C_NOESY, no=1523, id=3845, vol=4.780000e+07
    or (segid "   A" and resid  101 and name HG11) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  101 and name HG11) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   45 and name  HD1) 3.385 1.432 1.432 weight 1.000 ! spec=13C_NOESY, no=1525, id=3846, vol=4.840000e+07
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   45 and name  HD1)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   45 and name  HD1)
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG12) 2.720 0.925 0.925 weight 1.000 ! spec=13C_NOESY, no=1528, id=3847, vol=5.040000e+07
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   60 and name  HD1) (segid "   A" and resid   60 and name  HG2) 2.840 1.008 1.008 weight 1.000 ! spec=13C_NOESY, no=1532, id=3851, vol=5.670000e+07
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name  HB2) 2.764 0.955 0.955 weight 1.000 ! spec=13C_NOESY, no=1534, id=3853, vol=6.020000e+07
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   81 and name  HE1) 3.243 1.315 1.315 weight 1.000 ! spec=13C_NOESY, no=1537, id=3856, vol=6.720000e+07
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   81 and name  HE1)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   81 and name  HE1)
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   89 and name  HD1) 3.286 1.350 1.350 weight 1.000 ! spec=13C_NOESY, no=1539, id=3858, vol=6.930000e+07
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   89 and name  HD1)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   89 and name  HD1)
assign (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name  HG2) 2.908 1.057 1.057 weight 1.000 ! spec=13C_NOESY, no=1541, id=3860, vol=7.270000e+07
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   89 and name  HD1) 3.176 1.261 1.261 weight 1.000 ! spec=13C_NOESY, no=1543, id=3862, vol=7.440000e+07
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   25 and name  HB2) 3.333 1.389 1.389 weight 1.000 ! spec=13C_NOESY, no=1546, id=3863, vol=8.050000e+07
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name  HB2) 2.648 0.876 0.876 weight 1.000 ! spec=13C_NOESY, no=1547, id=3864, vol=8.110000e+07
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   41 and name HG22) 2.674 0.893 0.893 weight 1.000 ! spec=13C_NOESY, no=1551, id=3867, vol=9.550000e+07
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name  HD1) 2.851 1.016 1.016 weight 1.000 ! spec=13C_NOESY, no=1553, id=3869, vol=1.000000e+08
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG12) 2.490 0.775 0.775 weight 1.000 ! spec=13C_NOESY, no=1555, id=3870, vol=1.040000e+08
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  104 and name   HG) 2.548 0.812 0.812 weight 1.000 ! spec=13C_NOESY, no=1557, id=3872, vol=1.080000e+08
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  104 and name   HG)
    or (segid "   A" and resid  103 and name  HB3) (segid "   A" and resid  104 and name   HG)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   40 and name HD12) 2.577 0.830 0.830 weight 1.000 ! spec=13C_NOESY, no=1558, id=3873, vol=1.120000e+08
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   40 and name  HB1) 2.464 0.759 0.759 weight 1.000 ! spec=13C_NOESY, no=1560, id=3874, vol=1.130000e+08
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   25 and name  HE1) 3.222 1.298 1.298 weight 1.000 ! spec=13C_NOESY, no=1561, id=3875, vol=1.150000e+08
assign (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   45 and name  HD1) 3.465 1.501 1.501 weight 1.000 ! spec=13C_NOESY, no=1562, id=3876, vol=1.330000e+08
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   89 and name  HD1) 2.805 0.983 0.983 weight 1.000 ! spec=13C_NOESY, no=1563, id=3877, vol=1.350000e+08
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   27 and name  HG2) 2.594 0.841 0.841 weight 1.000 ! spec=13C_NOESY, no=1566, id=3880, vol=1.490000e+08
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   27 and name  HG2)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   27 and name  HG2)
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name  HG2) 2.649 0.877 0.877 weight 1.000 ! spec=13C_NOESY, no=1568, id=3882, vol=1.580000e+08
assign (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   22 and name  HD1) 2.816 0.991 0.991 weight 1.000 ! spec=13C_NOESY, no=1575, id=3886, vol=2.220000e+08
assign (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   45 and name   HZ) 2.331 0.679 0.679 weight 1.000 ! spec=13C_NOESY, no=1579, id=3889, vol=5.620000e+08
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   21 and name   HN) 2.273 0.646 0.646 weight 1.000 ! spec=15N_NOESY, no=6, id=3896, vol=3.450000e+09
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   21 and name   HN)
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   73 and name   HN) 2.548 0.811 0.811 weight 1.000 ! spec=15N_NOESY, no=11, id=3900, vol=1.780000e+09
assign (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   49 and name   HN) 2.549 0.812 0.812 weight 1.000 ! spec=15N_NOESY, no=12, id=3901, vol=1.230000e+09
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   33 and name   HN) 2.978 1.109 1.109 weight 1.000 ! spec=15N_NOESY, no=13, id=3902, vol=1.050000e+09
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   75 and name   HN) 2.509 0.787 0.787 weight 1.000 ! spec=15N_NOESY, no=14, id=3903, vol=1.040000e+09
assign (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name   HN) 2.606 0.849 0.849 weight 1.000 ! spec=15N_NOESY, no=15, id=3904, vol=1.000000e+09
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   86 and name   HN) 2.639 0.871 0.871 weight 1.000 ! spec=15N_NOESY, no=16, id=3905, vol=9.930000e+08
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name   HN) 3.283 1.347 1.347 weight 1.000 ! spec=15N_NOESY, no=17, id=3906, vol=9.660000e+08
assign (segid "   A" and resid   54 and name  HG2) (segid "   A" and resid   55 and name   HN) 2.762 0.954 0.954 weight 1.000 ! spec=15N_NOESY, no=18, id=3907, vol=9.470000e+08
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   17 and name   HN) 2.717 0.922 0.922 weight 1.000 ! spec=15N_NOESY, no=19, id=3908, vol=8.120000e+08
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid   99 and name  HB2) 2.967 1.101 1.101 weight 1.000 ! spec=15N_NOESY, no=20, id=3909, vol=6.260000e+08
assign (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name   HN) 2.944 1.083 1.083 weight 1.000 ! spec=15N_NOESY, no=22, id=3911, vol=6.060000e+08
assign (segid "   A" and resid   53 and name HD12) (segid "   A" and resid   53 and name   HN) 3.810 1.815 1.815 weight 1.000 ! spec=15N_NOESY, no=23, id=3912, vol=5.770000e+08
    or (segid "   A" and resid   53 and name HD11) (segid "   A" and resid   53 and name   HN)
    or (segid "   A" and resid   53 and name HD13) (segid "   A" and resid   53 and name   HN)
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   52 and name   HN) 2.976 1.107 1.107 weight 1.000 ! spec=15N_NOESY, no=24, id=3913, vol=5.300000e+08
assign (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name   HN) 3.207 1.286 1.286 weight 1.000 ! spec=15N_NOESY, no=27, id=3916, vol=4.430000e+08
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name   HN) 3.128 1.223 1.223 weight 1.000 ! spec=15N_NOESY, no=30, id=3919, vol=3.610000e+08
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   89 and name   HN) 3.407 1.451 1.451 weight 1.000 ! spec=15N_NOESY, no=31, id=3920, vol=3.300000e+08
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name   HN) 3.209 1.287 1.287 weight 1.000 ! spec=15N_NOESY, no=33, id=3922, vol=3.080000e+08
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid  100 and name   HN) 3.545 1.571 1.571 weight 1.000 ! spec=15N_NOESY, no=34, id=3923, vol=3.050000e+08
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name   HN) 3.321 1.379 1.379 weight 1.000 ! spec=15N_NOESY, no=35, id=3924, vol=2.900000e+08
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   68 and name   HN) 3.757 1.765 1.765 weight 1.000 ! spec=15N_NOESY, no=36, id=3925, vol=2.760000e+08
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   68 and name   HN)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   68 and name   HN)
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   77 and name   HN) 4.443 2.467 2.467 weight 1.000 ! spec=15N_NOESY, no=39, id=3928, vol=2.240000e+08
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   41 and name   HN) 4.489 2.519 2.519 weight 1.000 ! spec=15N_NOESY, no=42, id=3931, vol=1.790000e+08
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   22 and name   HN) 3.881 1.883 1.883 weight 1.000 ! spec=15N_NOESY, no=43, id=3932, vol=1.590000e+08
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   75 and name   HN) 3.669 1.683 1.683 weight 1.000 ! spec=15N_NOESY, no=44, id=3933, vol=1.590000e+08
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   14 and name   HN) 3.895 1.897 1.897 weight 1.000 ! spec=15N_NOESY, no=45, id=3934, vol=1.530000e+08
assign (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  102 and name   HN) 4.767 2.841 2.841 weight 1.000 ! spec=15N_NOESY, no=49, id=3937, vol=3.240000e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   21 and name   HN) 5.078 3.223 3.223 weight 1.000 ! spec=15N_NOESY, no=51, id=3939, vol=2.710000e+07
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   13 and name   HN) 6.237 4.862 4.862 weight 1.000 ! spec=15N_NOESY, no=52, id=3940, vol=2.550000e+07
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   58 and name   HN) 6.773 5.735 5.735 weight 1.000 ! spec=15N_NOESY, no=56, id=3944, vol=6.220000e+06
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   41 and name   HN) 6.041 4.562 4.562 weight 1.000 ! spec=15N_NOESY, no=59, id=3947, vol=1.120000e+07
assign (segid "   A" and resid   64 and name   HN) (segid "   A" and resid   63 and name   HN) 5.462 3.729 3.729 weight 1.000 ! spec=15N_NOESY, no=60, id=3948, vol=1.300000e+07
assign (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   49 and name   HN) 6.893 5.940 5.940 weight 1.000 ! spec=15N_NOESY, no=61, id=3949, vol=1.340000e+07
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name   HN) 5.096 3.247 3.247 weight 1.000 ! spec=15N_NOESY, no=64, id=3952, vol=2.480000e+07
assign (segid "   A" and resid   52 and name  HG2) (segid "   A" and resid   52 and name HE22) 5.067 3.209 3.209 weight 1.000 ! spec=15N_NOESY, no=70, id=3958, vol=5.350000e+07
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   38 and name   HN) 4.787 2.864 2.864 weight 1.000 ! spec=15N_NOESY, no=71, id=3959, vol=5.460000e+07
assign (segid "   A" and resid  103 and name   HN) (segid "   A" and resid   19 and name   HN) 5.046 3.183 3.183 weight 1.000 ! spec=15N_NOESY, no=76, id=3964, vol=6.270000e+07
assign (segid "   A" and resid   29 and name HE22) (segid "   A" and resid   29 and name   HN) 5.267 3.467 3.467 weight 1.000 ! spec=15N_NOESY, no=82, id=3969, vol=8.980000e+07
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name HE21) 5.643 3.980 3.980 weight 1.000 ! spec=15N_NOESY, no=83, id=3970, vol=8.990000e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   23 and name   HN) 4.342 2.357 2.357 weight 1.000 ! spec=15N_NOESY, no=84, id=3971, vol=9.280000e+07
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   35 and name   HN) 4.287 2.298 2.298 weight 1.000 ! spec=15N_NOESY, no=85, id=3972, vol=9.340000e+07
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   55 and name   HN) 4.076 2.076 2.076 weight 1.000 ! spec=15N_NOESY, no=86, id=3973, vol=1.030000e+08
assign (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   16 and name HE21) 4.507 2.539 2.539 weight 1.000 ! spec=15N_NOESY, no=87, id=3974, vol=1.030000e+08
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name   HN) 3.956 1.956 1.956 weight 1.000 ! spec=15N_NOESY, no=88, id=3975, vol=1.070000e+08
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   39 and name HE21) 4.713 2.776 2.776 weight 1.000 ! spec=15N_NOESY, no=97, id=3984, vol=1.250000e+08
assign (segid "   A" and resid   60 and name  HG2) (segid "   A" and resid   70 and name   HN) 3.821 1.825 1.825 weight 1.000 ! spec=15N_NOESY, no=101, id=3988, vol=1.330000e+08
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   80 and name HE22) 4.758 2.830 2.830 weight 1.000 ! spec=15N_NOESY, no=102, id=3989, vol=1.340000e+08
assign (segid "   A" and resid   54 and name HE22) (segid "   A" and resid   50 and name  HZ3) 4.122 2.124 2.124 weight 1.000 ! spec=15N_NOESY, no=103, id=3990, vol=1.350000e+08
assign (segid "   A" and resid   84 and name  HE1) (segid "   A" and resid   39 and name HE22) 4.740 2.808 2.808 weight 1.000 ! spec=15N_NOESY, no=104, id=3991, vol=1.350000e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   21 and name   HN) 3.734 1.743 1.743 weight 1.000 ! spec=15N_NOESY, no=107, id=3994, vol=1.410000e+08
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   86 and name   HN) 4.177 2.181 2.181 weight 1.000 ! spec=15N_NOESY, no=108, id=3995, vol=1.410000e+08
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   86 and name   HN)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   86 and name   HN)
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   26 and name   HN) 4.136 2.138 2.138 weight 1.000 ! spec=15N_NOESY, no=111, id=3997, vol=1.430000e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   19 and name   HN) 4.308 2.320 2.320 weight 1.000 ! spec=15N_NOESY, no=112, id=3998, vol=1.440000e+08
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   55 and name   HN) 3.972 1.973 1.973 weight 1.000 ! spec=15N_NOESY, no=113, id=3999, vol=1.460000e+08
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   89 and name   HN) 4.178 2.182 2.182 weight 1.000 ! spec=15N_NOESY, no=115, id=4001, vol=1.500000e+08
assign (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   49 and name   HN) 3.569 1.593 1.593 weight 1.000 ! spec=15N_NOESY, no=120, id=4005, vol=1.640000e+08
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   77 and name   HN) 4.490 2.520 2.520 weight 1.000 ! spec=15N_NOESY, no=122, id=4007, vol=1.660000e+08
assign (segid "   A" and resid   80 and name HE21) (segid "   A" and resid   82 and name   HN) 4.457 2.483 2.483 weight 1.000 ! spec=15N_NOESY, no=123, id=4008, vol=1.700000e+08
assign (segid "   A" and resid   29 and name  HG2) (segid "   A" and resid   29 and name HE21) 4.223 2.229 2.229 weight 1.000 ! spec=15N_NOESY, no=124, id=4009, vol=1.730000e+08
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   86 and name   HN) 4.283 2.293 2.293 weight 1.000 ! spec=15N_NOESY, no=126, id=4011, vol=1.750000e+08
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   89 and name   HN) 3.923 1.924 1.924 weight 1.000 ! spec=15N_NOESY, no=128, id=4013, vol=1.750000e+08
assign (segid "   A" and resid  109 and name  HB2) (segid "   A" and resid  110 and name   HN) 4.221 2.227 2.227 weight 1.000 ! spec=15N_NOESY, no=130, id=4015, vol=1.810000e+08
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name   HN) 3.614 1.632 1.632 weight 1.000 ! spec=15N_NOESY, no=131, id=4016, vol=1.820000e+08
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name   HN) 3.198 1.279 1.279 weight 1.000 ! spec=15N_NOESY, no=132, id=4017, vol=1.850000e+08
assign (segid "   A" and resid   81 and name  HD1) (segid "   A" and resid   80 and name HE22) 4.766 2.840 2.840 weight 1.000 ! spec=15N_NOESY, no=134, id=4019, vol=1.930000e+08
assign (segid "   A" and resid  110 and name   HN) (segid "   A" and resid  110 and name  HB2) 3.710 1.720 1.720 weight 1.000 ! spec=15N_NOESY, no=136, id=4021, vol=1.950000e+08
assign (segid "   A" and resid   60 and name  HG2) (segid "   A" and resid   67 and name   HN) 3.666 1.680 1.680 weight 1.000 ! spec=15N_NOESY, no=138, id=4023, vol=2.000000e+08
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   67 and name   HN) 3.618 1.636 1.636 weight 1.000 ! spec=15N_NOESY, no=142, id=4027, vol=2.010000e+08
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   78 and name   HN) 3.671 1.684 1.684 weight 1.000 ! spec=15N_NOESY, no=143, id=4028, vol=2.060000e+08
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   66 and name   HN) 4.493 2.523 2.523 weight 1.000 ! spec=15N_NOESY, no=144, id=4029, vol=2.060000e+08
assign (segid "   A" and resid   29 and name  HG2) (segid "   A" and resid   29 and name HE22) 3.411 1.454 1.454 weight 1.000 ! spec=15N_NOESY, no=145, id=4030, vol=2.130000e+08
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   18 and name HG11) 4.209 2.214 2.214 weight 1.000 ! spec=15N_NOESY, no=146, id=4031, vol=2.130000e+08
assign (segid "   A" and resid   66 and name   HN) (segid "   A" and resid   65 and name   HN) 3.375 1.424 1.424 weight 1.000 ! spec=15N_NOESY, no=147, id=4032, vol=2.140000e+08
assign (segid "   A" and resid  111 and name  HA1) (segid "   A" and resid  112 and name   HN) 3.545 1.571 1.571 weight 1.000 ! spec=15N_NOESY, no=148, id=4033, vol=2.150000e+08
assign (segid "   A" and resid   56 and name   HN) (segid "   A" and resid   58 and name   HN) 3.660 1.675 1.675 weight 1.000 ! spec=15N_NOESY, no=151, id=4036, vol=2.170000e+08
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   14 and name   HN) 4.165 2.168 2.168 weight 1.000 ! spec=15N_NOESY, no=152, id=4037, vol=2.170000e+08
assign (segid "   A" and resid   59 and name  HA1) (segid "   A" and resid   60 and name   HN) 3.479 1.513 1.513 weight 1.000 ! spec=15N_NOESY, no=153, id=4038, vol=2.170000e+08
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   60 and name   HN) 5.618 3.945 3.945 weight 1.000 ! spec=15N_NOESY, no=154, id=4039, vol=2.190000e+08
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name HE21) 3.754 1.762 1.762 weight 1.000 ! spec=15N_NOESY, no=155, id=4040, vol=2.190000e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   30 and name   HN) 4.362 2.379 2.379 weight 1.000 ! spec=15N_NOESY, no=158, id=4043, vol=2.260000e+08
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   35 and name   HN) 3.432 1.472 1.472 weight 1.000 ! spec=15N_NOESY, no=161, id=4045, vol=2.290000e+08
assign (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   95 and name   HN) 3.483 1.516 1.516 weight 1.000 ! spec=15N_NOESY, no=162, id=4046, vol=2.310000e+08
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   38 and name   HN) 3.599 1.619 1.619 weight 1.000 ! spec=15N_NOESY, no=168, id=4052, vol=2.400000e+08
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name   HN) 3.666 1.680 1.680 weight 1.000 ! spec=15N_NOESY, no=169, id=4053, vol=2.410000e+08
assign (segid "   A" and resid   81 and name  HD1) (segid "   A" and resid   81 and name   HN) 3.992 1.992 1.992 weight 1.000 ! spec=15N_NOESY, no=170, id=4054, vol=2.440000e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   31 and name   HN) 4.353 2.368 2.368 weight 1.000 ! spec=15N_NOESY, no=174, id=4057, vol=2.480000e+08
assign (segid "   A" and resid   46 and name  HD2) (segid "   A" and resid   45 and name   HN) 4.320 2.332 2.332 weight 1.000 ! spec=15N_NOESY, no=176, id=4059, vol=2.490000e+08
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name   HN) 4.186 2.191 2.191 weight 1.000 ! spec=15N_NOESY, no=177, id=4060, vol=2.510000e+08
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   48 and name   HN) 3.399 1.444 1.444 weight 1.000 ! spec=15N_NOESY, no=181, id=4064, vol=2.580000e+08
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   78 and name   HN) 3.616 1.634 1.634 weight 1.000 ! spec=15N_NOESY, no=184, id=4067, vol=2.600000e+08
assign (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   10 and name   HN) 4.022 2.022 2.022 weight 1.000 ! spec=15N_NOESY, no=185, id=4068, vol=2.600000e+08
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   10 and name   HN)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   10 and name   HN)
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   80 and name   HN) 3.735 1.744 1.744 weight 1.000 ! spec=15N_NOESY, no=186, id=4069, vol=2.600000e+08
assign (segid "   A" and resid    8 and name HG12) (segid "   A" and resid   10 and name   HN) 3.654 1.669 1.669 weight 1.000 ! spec=15N_NOESY, no=188, id=4071, vol=2.620000e+08
    or (segid "   A" and resid    8 and name HG11) (segid "   A" and resid   10 and name   HN)
    or (segid "   A" and resid    8 and name HG13) (segid "   A" and resid   10 and name   HN)
assign (segid "   A" and resid   31 and name  HG2) (segid "   A" and resid   32 and name   HN) 4.496 2.527 2.527 weight 1.000 ! spec=15N_NOESY, no=189, id=4072, vol=2.620000e+08
assign (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   56 and name   HN) 3.814 1.819 1.819 weight 1.000 ! spec=15N_NOESY, no=192, id=4075, vol=2.680000e+08
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   88 and name   HN) 3.666 1.680 1.680 weight 1.000 ! spec=15N_NOESY, no=193, id=4076, vol=2.690000e+08
assign (segid "   A" and resid   64 and name  HB1) (segid "   A" and resid   64 and name HD21) 3.398 1.443 1.443 weight 1.000 ! spec=15N_NOESY, no=194, id=4077, vol=2.700000e+08
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   79 and name   HN) 3.684 1.697 1.697 weight 1.000 ! spec=15N_NOESY, no=198, id=4080, vol=2.750000e+08
assign (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   64 and name HD22) 3.776 1.782 1.782 weight 1.000 ! spec=15N_NOESY, no=199, id=4081, vol=2.750000e+08
    or (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   64 and name HD22)
    or (segid "   A" and resid   63 and name  HB3) (segid "   A" and resid   64 and name HD22)
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   65 and name   HN) 3.815 1.819 1.819 weight 1.000 ! spec=15N_NOESY, no=204, id=4086, vol=2.800000e+08
    or (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   65 and name   HN)
    or (segid "   A" and resid   62 and name  HB3) (segid "   A" and resid   65 and name   HN)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   39 and name HE22) 3.405 1.449 1.449 weight 1.000 ! spec=15N_NOESY, no=206, id=4088, vol=2.810000e+08
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   39 and name HE22)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   39 and name HE22)
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   73 and name   HN) 3.943 1.943 1.943 weight 1.000 ! spec=15N_NOESY, no=207, id=4089, vol=2.820000e+08
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   73 and name   HN)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   73 and name   HN)
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HD1) 4.245 2.252 2.252 weight 1.000 ! spec=15N_NOESY, no=208, id=4090, vol=2.830000e+08
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   11 and name   HN) 3.209 1.287 1.287 weight 1.000 ! spec=15N_NOESY, no=210, id=4092, vol=2.840000e+08
assign (segid "   A" and resid  101 and name HG12) (segid "   A" and resid  101 and name   HN) 2.931 1.074 1.074 weight 1.000 ! spec=15N_NOESY, no=212, id=4094, vol=2.890000e+08
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  105 and name   HN) 3.698 1.709 1.709 weight 1.000 ! spec=15N_NOESY, no=213, id=4095, vol=2.900000e+08
assign (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid   55 and name   HN) 3.940 1.940 1.940 weight 1.000 ! spec=15N_NOESY, no=214, id=4096, vol=2.900000e+08
assign (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid   92 and name   HN) 3.368 1.418 1.418 weight 1.000 ! spec=15N_NOESY, no=215, id=4097, vol=2.930000e+08
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   27 and name HE22) 4.462 2.488 2.488 weight 1.000 ! spec=15N_NOESY, no=216, id=4098, vol=2.930000e+08
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   27 and name HE22)
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   27 and name HE22)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   91 and name   HN) 5.663 4.009 4.009 weight 1.000 ! spec=15N_NOESY, no=218, id=4100, vol=2.940000e+08
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   87 and name   HN) 3.484 1.517 1.517 weight 1.000 ! spec=15N_NOESY, no=219, id=4101, vol=2.950000e+08
assign (segid "   A" and resid   64 and name HD22) (segid "   A" and resid   50 and name  HE1) 3.065 1.174 1.174 weight 1.000 ! spec=15N_NOESY, no=222, id=4104, vol=2.990000e+08
assign (segid "   A" and resid  101 and name HD12) (segid "   A" and resid  101 and name   HN) 3.462 1.498 1.498 weight 1.000 ! spec=15N_NOESY, no=223, id=4105, vol=3.000000e+08
    or (segid "   A" and resid  101 and name HD11) (segid "   A" and resid  101 and name   HN)
    or (segid "   A" and resid  101 and name HD13) (segid "   A" and resid  101 and name   HN)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   26 and name   HN) 3.539 1.566 1.566 weight 1.000 ! spec=15N_NOESY, no=224, id=4106, vol=3.020000e+08
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   27 and name   HN) 3.335 1.390 1.390 weight 1.000 ! spec=15N_NOESY, no=225, id=4107, vol=3.020000e+08
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name HD12) 4.017 2.017 2.017 weight 1.000 ! spec=15N_NOESY, no=228, id=4110, vol=3.040000e+08
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name HD11)
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name HD13)
assign (segid "   A" and resid   93 and name  HD1) (segid "   A" and resid   94 and name   HN) 4.148 2.151 2.151 weight 1.000 ! spec=15N_NOESY, no=231, id=4113, vol=3.080000e+08
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   54 and name   HN) 3.395 1.441 1.441 weight 1.000 ! spec=15N_NOESY, no=233, id=4115, vol=3.110000e+08
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   54 and name   HN)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   54 and name   HN)
assign (segid "   A" and resid   39 and name HE21) (segid "   A" and resid   39 and name  HG2) 3.324 1.381 1.381 weight 1.000 ! spec=15N_NOESY, no=235, id=4117, vol=3.140000e+08
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   72 and name   HN) 3.764 1.771 1.771 weight 1.000 ! spec=15N_NOESY, no=238, id=4120, vol=3.170000e+08
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   72 and name   HN)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   72 and name   HN)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   37 and name   HN) 3.318 1.376 1.376 weight 1.000 ! spec=15N_NOESY, no=242, id=4124, vol=3.210000e+08
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   27 and name HE21) 4.074 2.075 2.075 weight 1.000 ! spec=15N_NOESY, no=243, id=4125, vol=3.220000e+08
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   27 and name HE21)
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   27 and name HE21)
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   83 and name   HN) 3.815 1.819 1.819 weight 1.000 ! spec=15N_NOESY, no=244, id=4126, vol=3.220000e+08
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   49 and name   HN) 3.446 1.485 1.485 weight 1.000 ! spec=15N_NOESY, no=246, id=4127, vol=3.230000e+08
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   41 and name   HN) 3.553 1.578 1.578 weight 1.000 ! spec=15N_NOESY, no=252, id=4132, vol=3.330000e+08
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   41 and name   HN)
assign (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   16 and name   HN) 3.835 1.838 1.838 weight 1.000 ! spec=15N_NOESY, no=254, id=4134, vol=3.360000e+08
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   16 and name   HN)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   16 and name   HN)
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   69 and name   HN) 3.154 1.243 1.243 weight 1.000 ! spec=15N_NOESY, no=255, id=4135, vol=3.370000e+08
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   26 and name   HN) 3.355 1.407 1.407 weight 1.000 ! spec=15N_NOESY, no=256, id=4136, vol=3.370000e+08
assign (segid "   A" and resid   27 and name HE22) (segid "   A" and resid   29 and name HE22) 3.314 1.373 1.373 weight 1.000 ! spec=15N_NOESY, no=261, id=4141, vol=3.400000e+08
assign (segid "   A" and resid   49 and name   HN) (segid "   A" and resid   48 and name   HN) 3.842 1.845 1.845 weight 1.000 ! spec=15N_NOESY, no=263, id=4143, vol=3.410000e+08
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   80 and name   HN) 4.254 2.262 2.262 weight 1.000 ! spec=15N_NOESY, no=266, id=4146, vol=3.450000e+08
assign (segid "   A" and resid   23 and name HD12) (segid "   A" and resid   24 and name   HN) 4.124 2.126 2.126 weight 1.000 ! spec=15N_NOESY, no=267, id=4147, vol=3.460000e+08
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid   24 and name   HN)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid   24 and name   HN)
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  104 and name   HN) 3.242 1.314 1.314 weight 1.000 ! spec=15N_NOESY, no=268, id=4148, vol=3.470000e+08
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid  103 and name  HB3) (segid "   A" and resid  104 and name   HN)
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   35 and name   HN) 3.779 1.785 1.785 weight 1.000 ! spec=15N_NOESY, no=269, id=4149, vol=3.480000e+08
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   28 and name   HN) 4.085 2.086 2.086 weight 1.000 ! spec=15N_NOESY, no=270, id=4150, vol=3.480000e+08
assign (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   78 and name   HN) 3.311 1.371 1.371 weight 1.000 ! spec=15N_NOESY, no=272, id=4152, vol=3.490000e+08
assign (segid "   A" and resid  101 and name   HN) (segid "   A" and resid  105 and name   HN) 3.989 1.989 1.989 weight 1.000 ! spec=15N_NOESY, no=273, id=4153, vol=3.490000e+08
assign (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   63 and name   HN) 3.207 1.286 1.286 weight 1.000 ! spec=15N_NOESY, no=274, id=4154, vol=3.490000e+08
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   89 and name   HN) 3.341 1.395 1.395 weight 1.000 ! spec=15N_NOESY, no=275, id=4155, vol=3.500000e+08
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   89 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   89 and name   HN)
assign (segid "   A" and resid   90 and name  HD1) (segid "   A" and resid   89 and name   HN) 3.366 1.416 1.416 weight 1.000 ! spec=15N_NOESY, no=276, id=4156, vol=3.500000e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   92 and name   HN) 4.167 2.170 2.170 weight 1.000 ! spec=15N_NOESY, no=277, id=4157, vol=3.510000e+08
assign (segid "   A" and resid   31 and name  HG1) (segid "   A" and resid   31 and name   HN) 3.225 1.300 1.300 weight 1.000 ! spec=15N_NOESY, no=280, id=4160, vol=3.520000e+08
assign (segid "   A" and resid  101 and name HG11) (segid "   A" and resid  101 and name   HN) 3.385 1.432 1.432 weight 1.000 ! spec=15N_NOESY, no=281, id=4161, vol=3.560000e+08
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   38 and name   HN) 3.162 1.250 1.250 weight 1.000 ! spec=15N_NOESY, no=282, id=4162, vol=3.560000e+08
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name   HN) 3.278 1.343 1.343 weight 1.000 ! spec=15N_NOESY, no=283, id=4163, vol=3.560000e+08
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   62 and name  HB2) 3.964 1.964 1.964 weight 1.000 ! spec=15N_NOESY, no=284, id=4164, vol=3.590000e+08
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   62 and name  HB3)
assign (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   76 and name   HN) 3.566 1.589 1.589 weight 1.000 ! spec=15N_NOESY, no=285, id=4165, vol=3.600000e+08
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   26 and name   HN) 3.482 1.516 1.516 weight 1.000 ! spec=15N_NOESY, no=286, id=4166, vol=3.610000e+08
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   26 and name   HN)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   26 and name   HN)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   33 and name   HN) 3.416 1.459 1.459 weight 1.000 ! spec=15N_NOESY, no=287, id=4167, vol=3.610000e+08
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   33 and name   HN) 3.576 1.598 1.598 weight 1.000 ! spec=15N_NOESY, no=288, id=4168, vol=3.620000e+08
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   33 and name   HN)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   33 and name   HN)
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   56 and name   HN) 3.838 1.842 1.842 weight 1.000 ! spec=15N_NOESY, no=289, id=4169, vol=3.620000e+08
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   56 and name   HN)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   56 and name   HN)
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   43 and name   HN) 3.840 1.843 1.843 weight 1.000 ! spec=15N_NOESY, no=290, id=4170, vol=3.620000e+08
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   43 and name   HN)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   43 and name   HN)
assign (segid "   A" and resid   31 and name  HG2) (segid "   A" and resid   31 and name   HN) 3.127 1.222 1.222 weight 1.000 ! spec=15N_NOESY, no=291, id=4171, vol=3.630000e+08
assign (segid "   A" and resid   56 and name  HD2) (segid "   A" and resid   52 and name HE21) 3.555 1.580 1.580 weight 1.000 ! spec=15N_NOESY, no=292, id=4172, vol=3.630000e+08
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name   HN) 3.465 1.501 1.501 weight 1.000 ! spec=15N_NOESY, no=293, id=4173, vol=3.630000e+08
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name   HN)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name   HN)
assign (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   80 and name   HN) 3.813 1.817 1.817 weight 1.000 ! spec=15N_NOESY, no=294, id=4174, vol=3.630000e+08
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   87 and name   HN) 3.392 1.438 1.438 weight 1.000 ! spec=15N_NOESY, no=295, id=4175, vol=3.640000e+08
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   81 and name   HN) 2.988 1.116 1.116 weight 1.000 ! spec=15N_NOESY, no=297, id=4177, vol=3.640000e+08
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   17 and name   HN) 3.505 1.536 1.536 weight 1.000 ! spec=15N_NOESY, no=299, id=4179, vol=3.660000e+08
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   57 and name   HN) 4.278 2.288 2.288 weight 1.000 ! spec=15N_NOESY, no=301, id=4181, vol=3.680000e+08
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   57 and name   HN)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   57 and name   HN)
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   81 and name   HN) 3.293 1.356 1.356 weight 1.000 ! spec=15N_NOESY, no=302, id=4182, vol=3.680000e+08
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   28 and name   HN) 3.178 1.263 1.263 weight 1.000 ! spec=15N_NOESY, no=303, id=4183, vol=3.700000e+08
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   10 and name   HN) 3.068 1.176 1.176 weight 1.000 ! spec=15N_NOESY, no=304, id=4184, vol=3.710000e+08
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   45 and name   HN) 3.726 1.735 1.735 weight 1.000 ! spec=15N_NOESY, no=306, id=4186, vol=3.730000e+08
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   45 and name   HN)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   45 and name   HN)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   81 and name   HN) 3.744 1.753 1.753 weight 1.000 ! spec=15N_NOESY, no=307, id=4187, vol=3.740000e+08
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   22 and name   HN) 3.464 1.500 1.500 weight 1.000 ! spec=15N_NOESY, no=309, id=4189, vol=3.780000e+08
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   22 and name   HN)
assign (segid "   A" and resid  110 and name  HG2) (segid "   A" and resid  110 and name   HN) 3.342 1.396 1.396 weight 1.000 ! spec=15N_NOESY, no=310, id=4190, vol=3.790000e+08
assign (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   33 and name   HN) 3.157 1.245 1.245 weight 1.000 ! spec=15N_NOESY, no=312, id=4192, vol=3.810000e+08
assign (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   82 and name   HN) 3.195 1.276 1.276 weight 1.000 ! spec=15N_NOESY, no=313, id=4193, vol=3.810000e+08
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   36 and name   HN) 3.225 1.300 1.300 weight 1.000 ! spec=15N_NOESY, no=314, id=4194, vol=3.820000e+08
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   66 and name   HN) 3.291 1.354 1.354 weight 1.000 ! spec=15N_NOESY, no=315, id=4195, vol=3.820000e+08
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   66 and name   HN)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   66 and name   HN)
assign (segid "   A" and resid   50 and name  HE3) (segid "   A" and resid   51 and name   HN) 3.461 1.498 1.498 weight 1.000 ! spec=15N_NOESY, no=316, id=4196, vol=3.830000e+08
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   57 and name   HN) 3.530 1.558 1.558 weight 1.000 ! spec=15N_NOESY, no=317, id=4197, vol=3.850000e+08
assign (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   94 and name   HN) 3.403 1.448 1.448 weight 1.000 ! spec=15N_NOESY, no=318, id=4198, vol=3.860000e+08
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   78 and name   HN) 3.407 1.451 1.451 weight 1.000 ! spec=15N_NOESY, no=320, id=4200, vol=3.880000e+08
assign (segid "   A" and resid   59 and name  HA2) (segid "   A" and resid   60 and name   HN) 3.311 1.370 1.370 weight 1.000 ! spec=15N_NOESY, no=321, id=4201, vol=3.910000e+08
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   75 and name   HN) 3.380 1.428 1.428 weight 1.000 ! spec=15N_NOESY, no=325, id=4205, vol=3.920000e+08
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   21 and name   HN) 3.603 1.623 1.623 weight 1.000 ! spec=15N_NOESY, no=326, id=4206, vol=3.930000e+08
assign (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   30 and name   HN) 2.872 1.031 1.031 weight 1.000 ! spec=15N_NOESY, no=327, id=4207, vol=3.940000e+08
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   43 and name   HN) 3.247 1.318 1.318 weight 1.000 ! spec=15N_NOESY, no=328, id=4208, vol=3.940000e+08
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   32 and name   HN) 3.475 1.510 1.510 weight 1.000 ! spec=15N_NOESY, no=330, id=4210, vol=3.960000e+08
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   32 and name   HN)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   32 and name   HN)
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   22 and name   HN) 2.982 1.112 1.112 weight 1.000 ! spec=15N_NOESY, no=331, id=4211, vol=3.970000e+08
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   22 and name   HN)
assign (segid "   A" and resid   81 and name  HD1) (segid "   A" and resid   77 and name   HN) 3.973 1.973 1.973 weight 1.000 ! spec=15N_NOESY, no=332, id=4212, vol=3.970000e+08
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   38 and name   HN) 3.666 1.680 1.680 weight 1.000 ! spec=15N_NOESY, no=333, id=4213, vol=3.980000e+08
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   26 and name   HN) 3.371 1.421 1.421 weight 1.000 ! spec=15N_NOESY, no=334, id=4214, vol=3.990000e+08
assign (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name   HN) 3.023 1.143 1.143 weight 1.000 ! spec=15N_NOESY, no=335, id=4215, vol=4.000000e+08
assign (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   16 and name   HN) 3.071 1.179 1.179 weight 1.000 ! spec=15N_NOESY, no=337, id=4217, vol=4.010000e+08
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   84 and name   HN) 3.468 1.503 1.503 weight 1.000 ! spec=15N_NOESY, no=338, id=4218, vol=4.020000e+08
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   11 and name   HN) 3.615 1.634 1.634 weight 1.000 ! spec=15N_NOESY, no=341, id=4221, vol=4.090000e+08
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name   HN) 3.111 1.210 1.210 weight 1.000 ! spec=15N_NOESY, no=344, id=4224, vol=4.100000e+08
assign (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   23 and name   HN) 3.523 1.551 1.551 weight 1.000 ! spec=15N_NOESY, no=346, id=4226, vol=4.160000e+08
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   42 and name   HN) 3.376 1.425 1.425 weight 1.000 ! spec=15N_NOESY, no=347, id=4227, vol=4.190000e+08
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   80 and name HE21) 3.947 1.947 1.947 weight 1.000 ! spec=15N_NOESY, no=348, id=4228, vol=4.190000e+08
assign (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   14 and name   HN) 3.693 1.705 1.705 weight 1.000 ! spec=15N_NOESY, no=349, id=4229, vol=4.210000e+08
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   14 and name   HN)
assign (segid "   A" and resid   10 and name HG11) (segid "   A" and resid    8 and name   HN) 3.093 1.196 1.196 weight 1.000 ! spec=15N_NOESY, no=352, id=4232, vol=4.300000e+08
assign (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   76 and name   HN) 3.141 1.233 1.233 weight 1.000 ! spec=15N_NOESY, no=353, id=4233, vol=4.340000e+08
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   32 and name   HN) 3.060 1.170 1.170 weight 1.000 ! spec=15N_NOESY, no=354, id=4234, vol=4.370000e+08
assign (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   51 and name   HN) 3.256 1.325 1.325 weight 1.000 ! spec=15N_NOESY, no=355, id=4235, vol=4.380000e+08
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   31 and name   HN) 3.642 1.658 1.658 weight 1.000 ! spec=15N_NOESY, no=357, id=4237, vol=4.390000e+08
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   31 and name   HN)
assign (segid "   A" and resid   23 and name HD12) (segid "   A" and resid   23 and name   HN) 3.855 1.857 1.857 weight 1.000 ! spec=15N_NOESY, no=358, id=4238, vol=4.390000e+08
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid   23 and name   HN)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid   23 and name   HN)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   38 and name   HN) 3.195 1.276 1.276 weight 1.000 ! spec=15N_NOESY, no=359, id=4239, vol=4.400000e+08
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   38 and name   HN)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   38 and name   HN)
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   78 and name   HN) 3.319 1.377 1.377 weight 1.000 ! spec=15N_NOESY, no=360, id=4240, vol=4.410000e+08
assign (segid "   A" and resid   53 and name   HG) (segid "   A" and resid   54 and name   HN) 3.400 1.445 1.445 weight 1.000 ! spec=15N_NOESY, no=361, id=4241, vol=4.420000e+08
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   85 and name   HN) 3.293 1.356 1.356 weight 1.000 ! spec=15N_NOESY, no=362, id=4242, vol=4.440000e+08
assign (segid "   A" and resid   84 and name  HD1) (segid "   A" and resid   85 and name   HN) 3.894 1.895 1.895 weight 1.000 ! spec=15N_NOESY, no=363, id=4243, vol=4.440000e+08
assign (segid "   A" and resid   45 and name   HN) (segid "   A" and resid   46 and name  HD1) 3.409 1.453 1.453 weight 1.000 ! spec=15N_NOESY, no=364, id=4244, vol=4.440000e+08
assign (segid "   A" and resid   80 and name  HG2) (segid "   A" and resid   80 and name   HN) 3.564 1.588 1.588 weight 1.000 ! spec=15N_NOESY, no=365, id=4245, vol=4.450000e+08
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name  HD1) 3.893 1.895 1.895 weight 1.000 ! spec=15N_NOESY, no=366, id=4246, vol=4.450000e+08
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   58 and name   HN) 3.176 1.261 1.261 weight 1.000 ! spec=15N_NOESY, no=367, id=4247, vol=4.450000e+08
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   86 and name   HN) 3.647 1.663 1.663 weight 1.000 ! spec=15N_NOESY, no=372, id=4252, vol=4.490000e+08
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   81 and name   HN) 3.580 1.602 1.602 weight 1.000 ! spec=15N_NOESY, no=373, id=4253, vol=4.490000e+08
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   80 and name   HN) 3.682 1.694 1.694 weight 1.000 ! spec=15N_NOESY, no=377, id=4257, vol=4.560000e+08
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name   HN) 2.966 1.100 1.100 weight 1.000 ! spec=15N_NOESY, no=378, id=4258, vol=4.560000e+08
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HG2) 2.727 0.929 0.929 weight 1.000 ! spec=15N_NOESY, no=379, id=4259, vol=4.570000e+08
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   52 and name   HN) 3.405 1.449 1.449 weight 1.000 ! spec=15N_NOESY, no=381, id=4261, vol=4.580000e+08
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   13 and name   HN) 3.218 1.295 1.295 weight 1.000 ! spec=15N_NOESY, no=382, id=4262, vol=4.580000e+08
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   33 and name   HN) 3.042 1.157 1.157 weight 1.000 ! spec=15N_NOESY, no=383, id=4263, vol=4.600000e+08
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   56 and name   HN) 2.784 0.969 0.969 weight 1.000 ! spec=15N_NOESY, no=384, id=4264, vol=4.610000e+08
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name HD21) 2.489 0.775 0.775 weight 1.000 ! spec=15N_NOESY, no=385, id=4265, vol=4.640000e+08
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   39 and name   HN) 3.166 1.253 1.253 weight 1.000 ! spec=15N_NOESY, no=386, id=4266, vol=4.680000e+08
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   20 and name   HN) 3.195 1.276 1.276 weight 1.000 ! spec=15N_NOESY, no=388, id=4267, vol=4.700000e+08
assign (segid "   A" and resid   88 and name  HB2) (segid "   A" and resid   89 and name   HN) 3.574 1.597 1.597 weight 1.000 ! spec=15N_NOESY, no=389, id=4268, vol=4.700000e+08
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name   HN) 3.891 1.893 1.893 weight 1.000 ! spec=15N_NOESY, no=391, id=4270, vol=4.710000e+08
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name   HN)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name   HN)
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   32 and name   HN) 3.013 1.135 1.135 weight 1.000 ! spec=15N_NOESY, no=393, id=4272, vol=4.740000e+08
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   21 and name   HN) 2.996 1.122 1.122 weight 1.000 ! spec=15N_NOESY, no=398, id=4277, vol=4.780000e+08
assign (segid "   A" and resid   94 and name   HN) (segid "   A" and resid   95 and name   HN) 2.956 1.092 1.092 weight 1.000 ! spec=15N_NOESY, no=402, id=4281, vol=4.830000e+08
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   42 and name   HN) 3.612 1.631 1.631 weight 1.000 ! spec=15N_NOESY, no=403, id=4282, vol=4.830000e+08
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   42 and name   HN)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   42 and name   HN)
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   17 and name   HN) 3.547 1.573 1.573 weight 1.000 ! spec=15N_NOESY, no=404, id=4283, vol=4.840000e+08
assign (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   22 and name   HN) 4.054 2.054 2.054 weight 1.000 ! spec=15N_NOESY, no=405, id=4284, vol=4.840000e+08
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name   HN) 3.315 1.374 1.374 weight 1.000 ! spec=15N_NOESY, no=406, id=4285, vol=4.850000e+08
assign (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   44 and name   HN) 2.803 0.982 0.982 weight 1.000 ! spec=15N_NOESY, no=407, id=4286, vol=4.860000e+08
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   27 and name HE21) 3.546 1.572 1.572 weight 1.000 ! spec=15N_NOESY, no=409, id=4288, vol=4.920000e+08
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   52 and name   HN) 3.211 1.288 1.288 weight 1.000 ! spec=15N_NOESY, no=410, id=4289, vol=4.930000e+08
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   54 and name   HN) 2.817 0.992 0.992 weight 1.000 ! spec=15N_NOESY, no=411, id=4290, vol=4.930000e+08
assign (segid "   A" and resid  100 and name  HB2) (segid "   A" and resid  101 and name   HN) 2.948 1.086 1.086 weight 1.000 ! spec=15N_NOESY, no=412, id=4291, vol=4.960000e+08
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name   HN) 2.875 1.033 1.033 weight 1.000 ! spec=15N_NOESY, no=414, id=4293, vol=5.020000e+08
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   43 and name   HN) 3.048 1.162 1.162 weight 1.000 ! spec=15N_NOESY, no=416, id=4294, vol=5.070000e+08
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   16 and name HE21) 3.534 1.561 1.561 weight 1.000 ! spec=15N_NOESY, no=418, id=4296, vol=5.070000e+08
assign (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   49 and name   HN) 3.348 1.401 1.401 weight 1.000 ! spec=15N_NOESY, no=420, id=4298, vol=5.130000e+08
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name   HN) 3.018 1.138 1.138 weight 1.000 ! spec=15N_NOESY, no=421, id=4299, vol=5.140000e+08
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   86 and name   HN) 3.208 1.286 1.286 weight 1.000 ! spec=15N_NOESY, no=422, id=4300, vol=5.140000e+08
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   42 and name   HN) 3.183 1.266 1.266 weight 1.000 ! spec=15N_NOESY, no=423, id=4301, vol=5.140000e+08
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   67 and name   HN) 3.038 1.154 1.154 weight 1.000 ! spec=15N_NOESY, no=424, id=4302, vol=5.150000e+08
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid    9 and name   HN) 2.819 0.993 0.993 weight 1.000 ! spec=15N_NOESY, no=425, id=4303, vol=5.150000e+08
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   38 and name   HN) 3.569 1.592 1.592 weight 1.000 ! spec=15N_NOESY, no=426, id=4304, vol=5.150000e+08
assign (segid "   A" and resid   47 and name  HA1) (segid "   A" and resid   47 and name   HN) 3.082 1.187 1.187 weight 1.000 ! spec=15N_NOESY, no=428, id=4306, vol=5.160000e+08
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   76 and name   HN) 3.573 1.596 1.596 weight 1.000 ! spec=15N_NOESY, no=430, id=4308, vol=5.180000e+08
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   26 and name   HN) 2.916 1.063 1.063 weight 1.000 ! spec=15N_NOESY, no=431, id=4309, vol=5.190000e+08
assign (segid "   A" and resid   81 and name  HD1) (segid "   A" and resid   80 and name HE21) 3.366 1.416 1.416 weight 1.000 ! spec=15N_NOESY, no=432, id=4310, vol=5.200000e+08
assign (segid "   A" and resid   95 and name   HN) (segid "   A" and resid   95 and name  HG2) 3.068 1.177 1.177 weight 1.000 ! spec=15N_NOESY, no=433, id=4311, vol=5.210000e+08
assign (segid "   A" and resid   68 and name  HB2) (segid "   A" and resid   69 and name   HN) 3.512 1.542 1.542 weight 1.000 ! spec=15N_NOESY, no=434, id=4312, vol=5.220000e+08
assign (segid "   A" and resid   47 and name  HA1) (segid "   A" and resid   48 and name   HN) 3.040 1.155 1.155 weight 1.000 ! spec=15N_NOESY, no=435, id=4313, vol=5.240000e+08
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   14 and name   HN) 3.107 1.207 1.207 weight 1.000 ! spec=15N_NOESY, no=440, id=4318, vol=5.260000e+08
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   20 and name   HN) 3.159 1.248 1.248 weight 1.000 ! spec=15N_NOESY, no=444, id=4322, vol=5.320000e+08
assign (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   22 and name   HN) 3.624 1.642 1.642 weight 1.000 ! spec=15N_NOESY, no=445, id=4323, vol=5.320000e+08
assign (segid "   A" and resid   47 and name  HA2) (segid "   A" and resid   47 and name   HN) 2.979 1.109 1.109 weight 1.000 ! spec=15N_NOESY, no=448, id=4326, vol=5.340000e+08
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   78 and name   HN) 3.199 1.279 1.279 weight 1.000 ! spec=15N_NOESY, no=449, id=4327, vol=5.360000e+08
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   91 and name   HN) 2.995 1.121 1.121 weight 1.000 ! spec=15N_NOESY, no=452, id=4330, vol=5.460000e+08
assign (segid "   A" and resid   28 and name  HA1) (segid "   A" and resid   29 and name   HN) 2.856 1.020 1.020 weight 1.000 ! spec=15N_NOESY, no=453, id=4331, vol=5.470000e+08
assign (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   86 and name   HN) 3.175 1.260 1.260 weight 1.000 ! spec=15N_NOESY, no=456, id=4334, vol=5.490000e+08
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   11 and name   HN) 2.288 0.654 0.654 weight 1.000 ! spec=15N_NOESY, no=457, id=4335, vol=5.490000e+08
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   71 and name   HN) 3.039 1.154 1.154 weight 1.000 ! spec=15N_NOESY, no=458, id=4336, vol=5.500000e+08
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name   HN) 3.400 1.445 1.445 weight 1.000 ! spec=15N_NOESY, no=459, id=4337, vol=5.510000e+08
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name   HN) 2.802 0.981 0.981 weight 1.000 ! spec=15N_NOESY, no=460, id=4338, vol=5.510000e+08
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name   HN) 2.990 1.117 1.117 weight 1.000 ! spec=15N_NOESY, no=461, id=4339, vol=5.520000e+08
assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   40 and name   HN) 3.449 1.487 1.487 weight 1.000 ! spec=15N_NOESY, no=462, id=4340, vol=5.550000e+08
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name   HN) 2.709 0.917 0.917 weight 1.000 ! spec=15N_NOESY, no=463, id=4341, vol=5.550000e+08
assign (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   25 and name   HN) 3.141 1.233 1.233 weight 1.000 ! spec=15N_NOESY, no=465, id=4343, vol=5.570000e+08
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   66 and name   HN) 3.060 1.171 1.171 weight 1.000 ! spec=15N_NOESY, no=466, id=4344, vol=5.570000e+08
assign (segid "   A" and resid   47 and name  HA2) (segid "   A" and resid   48 and name   HN) 3.214 1.291 1.291 weight 1.000 ! spec=15N_NOESY, no=467, id=4345, vol=5.580000e+08
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   91 and name   HN) 2.592 0.840 0.840 weight 1.000 ! spec=15N_NOESY, no=469, id=4347, vol=5.620000e+08
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   53 and name   HN) 3.070 1.178 1.178 weight 1.000 ! spec=15N_NOESY, no=471, id=4349, vol=5.650000e+08
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name   HN) 2.979 1.109 1.109 weight 1.000 ! spec=15N_NOESY, no=475, id=4351, vol=5.820000e+08
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   77 and name   HN) 3.035 1.152 1.152 weight 1.000 ! spec=15N_NOESY, no=477, id=4353, vol=5.870000e+08
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   77 and name   HN)
    or (segid "   A" and resid   76 and name  HB3) (segid "   A" and resid   77 and name   HN)
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name   HN) 2.941 1.081 1.081 weight 1.000 ! spec=15N_NOESY, no=478, id=4354, vol=5.930000e+08
assign (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   82 and name   HN) 2.682 0.899 0.899 weight 1.000 ! spec=15N_NOESY, no=479, id=4355, vol=5.940000e+08
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   66 and name   HN) 2.889 1.043 1.043 weight 1.000 ! spec=15N_NOESY, no=480, id=4356, vol=5.940000e+08
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name   HN) 2.826 0.998 0.998 weight 1.000 ! spec=15N_NOESY, no=482, id=4358, vol=5.980000e+08
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name   HN) 2.750 0.945 0.945 weight 1.000 ! spec=15N_NOESY, no=485, id=4361, vol=6.030000e+08
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   45 and name   HN) 2.942 1.082 1.082 weight 1.000 ! spec=15N_NOESY, no=486, id=4362, vol=6.030000e+08
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name   HN) 3.017 1.138 1.138 weight 1.000 ! spec=15N_NOESY, no=488, id=4364, vol=6.060000e+08
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name   HN) 2.910 1.059 1.059 weight 1.000 ! spec=15N_NOESY, no=490, id=4366, vol=6.090000e+08
assign (segid "   A" and resid   51 and name  HG1) (segid "   A" and resid   51 and name   HN) 2.975 1.107 1.107 weight 1.000 ! spec=15N_NOESY, no=492, id=4368, vol=6.130000e+08
assign (segid "   A" and resid    8 and name HG22) (segid "   A" and resid   79 and name   HN) 3.133 1.227 1.227 weight 1.000 ! spec=15N_NOESY, no=495, id=4371, vol=6.150000e+08
    or (segid "   A" and resid    8 and name HG21) (segid "   A" and resid   79 and name   HN)
    or (segid "   A" and resid    8 and name HG23) (segid "   A" and resid   79 and name   HN)
assign (segid "   A" and resid  109 and name  HG2) (segid "   A" and resid  109 and name   HN) 3.019 1.139 1.139 weight 1.000 ! spec=15N_NOESY, no=496, id=4372, vol=6.150000e+08
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   24 and name   HN) 3.076 1.182 1.182 weight 1.000 ! spec=15N_NOESY, no=497, id=4373, vol=6.150000e+08
assign (segid "   A" and resid   52 and name  HG2) (segid "   A" and resid   49 and name   HN) 3.393 1.439 1.439 weight 1.000 ! spec=15N_NOESY, no=499, id=4375, vol=6.190000e+08
assign (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   15 and name   HN) 3.197 1.277 1.277 weight 1.000 ! spec=15N_NOESY, no=501, id=4377, vol=6.200000e+08
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   15 and name   HN)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   15 and name   HN)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name   HN) 2.898 1.050 1.050 weight 1.000 ! spec=15N_NOESY, no=502, id=4378, vol=6.230000e+08
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name   HN) 2.935 1.077 1.077 weight 1.000 ! spec=15N_NOESY, no=504, id=4380, vol=6.280000e+08
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name   HN) 3.143 1.235 1.235 weight 1.000 ! spec=15N_NOESY, no=507, id=4383, vol=6.350000e+08
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   25 and name   HN) 3.403 1.447 1.447 weight 1.000 ! spec=15N_NOESY, no=508, id=4384, vol=6.360000e+08
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   45 and name   HN) 3.214 1.291 1.291 weight 1.000 ! spec=15N_NOESY, no=511, id=4387, vol=6.390000e+08
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name   HN) 3.469 1.504 1.504 weight 1.000 ! spec=15N_NOESY, no=512, id=4388, vol=6.400000e+08
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   27 and name HE22) 3.380 1.428 1.428 weight 1.000 ! spec=15N_NOESY, no=513, id=4389, vol=6.420000e+08
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   34 and name   HN) 3.587 1.609 1.609 weight 1.000 ! spec=15N_NOESY, no=514, id=4390, vol=6.420000e+08
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   34 and name   HN)
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   34 and name   HN)
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   16 and name HE22) 2.590 0.839 0.839 weight 1.000 ! spec=15N_NOESY, no=515, id=4391, vol=6.420000e+08
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   14 and name   HN) 3.240 1.312 1.312 weight 1.000 ! spec=15N_NOESY, no=516, id=4392, vol=6.430000e+08
assign (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   31 and name   HN) 3.485 1.518 1.518 weight 1.000 ! spec=15N_NOESY, no=517, id=4393, vol=6.430000e+08
assign (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   11 and name   HN) 3.448 1.486 1.486 weight 1.000 ! spec=15N_NOESY, no=519, id=4395, vol=6.450000e+08
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   11 and name   HN)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   11 and name   HN)
assign (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  103 and name   HN) 3.290 1.353 1.353 weight 1.000 ! spec=15N_NOESY, no=521, id=4397, vol=6.460000e+08
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  103 and name   HN)
    or (segid "   A" and resid  103 and name  HB3) (segid "   A" and resid  103 and name   HN)
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   37 and name   HN) 2.980 1.110 1.110 weight 1.000 ! spec=15N_NOESY, no=525, id=4401, vol=6.530000e+08
assign (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   39 and name   HN) 3.215 1.292 1.292 weight 1.000 ! spec=15N_NOESY, no=527, id=4403, vol=6.550000e+08
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   56 and name   HN) 3.275 1.340 1.340 weight 1.000 ! spec=15N_NOESY, no=529, id=4405, vol=6.560000e+08
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   34 and name   HN) 2.844 1.011 1.011 weight 1.000 ! spec=15N_NOESY, no=530, id=4406, vol=6.570000e+08
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   88 and name   HN) 2.930 1.073 1.073 weight 1.000 ! spec=15N_NOESY, no=531, id=4407, vol=6.580000e+08
assign (segid "   A" and resid   89 and name   HA) (segid "   A" and resid   89 and name   HN) 2.873 1.032 1.032 weight 1.000 ! spec=15N_NOESY, no=533, id=4409, vol=6.660000e+08
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   47 and name   HN) 2.802 0.982 0.982 weight 1.000 ! spec=15N_NOESY, no=534, id=4410, vol=6.670000e+08
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   56 and name   HN) 3.515 1.544 1.544 weight 1.000 ! spec=15N_NOESY, no=535, id=4411, vol=6.680000e+08
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   63 and name   HN) 3.918 1.919 1.919 weight 1.000 ! spec=15N_NOESY, no=536, id=4412, vol=6.710000e+08
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   53 and name   HN) 3.478 1.512 1.512 weight 1.000 ! spec=15N_NOESY, no=537, id=4413, vol=6.720000e+08
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   53 and name   HN)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   53 and name   HN)
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   53 and name   HN) 2.892 1.045 1.045 weight 1.000 ! spec=15N_NOESY, no=539, id=4415, vol=6.730000e+08
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name   HN) 2.759 0.952 0.952 weight 1.000 ! spec=15N_NOESY, no=541, id=4416, vol=6.770000e+08
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   45 and name   HN) 2.942 1.082 1.082 weight 1.000 ! spec=15N_NOESY, no=542, id=4417, vol=6.800000e+08
assign (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   79 and name   HN) 3.619 1.637 1.637 weight 1.000 ! spec=15N_NOESY, no=543, id=4418, vol=6.820000e+08
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   78 and name   HN) 2.682 0.899 0.899 weight 1.000 ! spec=15N_NOESY, no=546, id=4421, vol=6.850000e+08
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    9 and name   HN) 2.720 0.925 0.925 weight 1.000 ! spec=15N_NOESY, no=547, id=4422, vol=6.880000e+08
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name   HN) 2.798 0.978 0.978 weight 1.000 ! spec=15N_NOESY, no=548, id=4423, vol=6.880000e+08
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name   HN) 2.816 0.991 0.991 weight 1.000 ! spec=15N_NOESY, no=549, id=4424, vol=6.880000e+08
assign (segid "   A" and resid    8 and name HG12) (segid "   A" and resid   78 and name   HN) 3.079 1.185 1.185 weight 1.000 ! spec=15N_NOESY, no=551, id=4426, vol=6.890000e+08
    or (segid "   A" and resid    8 and name HG11) (segid "   A" and resid   78 and name   HN)
    or (segid "   A" and resid    8 and name HG13) (segid "   A" and resid   78 and name   HN)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name   HN) 2.824 0.997 0.997 weight 1.000 ! spec=15N_NOESY, no=552, id=4427, vol=6.890000e+08
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   51 and name   HN) 2.972 1.104 1.104 weight 1.000 ! spec=15N_NOESY, no=553, id=4428, vol=6.930000e+08
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name   HN) 3.329 1.385 1.385 weight 1.000 ! spec=15N_NOESY, no=554, id=4429, vol=6.930000e+08
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   41 and name   HN) 3.014 1.135 1.135 weight 1.000 ! spec=15N_NOESY, no=555, id=4430, vol=6.960000e+08
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   78 and name   HN) 3.342 1.396 1.396 weight 1.000 ! spec=15N_NOESY, no=556, id=4431, vol=6.980000e+08
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   86 and name   HN) 3.028 1.146 1.146 weight 1.000 ! spec=15N_NOESY, no=557, id=4432, vol=7.010000e+08
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   86 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   86 and name   HN)
assign (segid "   A" and resid   32 and name   HN) (segid "   A" and resid   66 and name   HN) 2.784 0.969 0.969 weight 1.000 ! spec=15N_NOESY, no=559, id=4434, vol=7.060000e+08
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   75 and name   HN) 2.997 1.123 1.123 weight 1.000 ! spec=15N_NOESY, no=560, id=4435, vol=7.070000e+08
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   19 and name   HN) 2.777 0.964 0.964 weight 1.000 ! spec=15N_NOESY, no=562, id=4437, vol=7.100000e+08
assign (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   32 and name   HN) 3.088 1.192 1.192 weight 1.000 ! spec=15N_NOESY, no=563, id=4438, vol=7.120000e+08
assign (segid "   A" and resid   88 and name  HB2) (segid "   A" and resid   88 and name   HN) 3.500 1.531 1.531 weight 1.000 ! spec=15N_NOESY, no=565, id=4440, vol=7.200000e+08
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name   HN) 2.977 1.108 1.108 weight 1.000 ! spec=15N_NOESY, no=567, id=4442, vol=7.230000e+08
assign (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   88 and name   HN) 2.859 1.022 1.022 weight 1.000 ! spec=15N_NOESY, no=571, id=4446, vol=7.310000e+08
assign (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  105 and name   HN) 3.252 1.322 1.322 weight 1.000 ! spec=15N_NOESY, no=574, id=4449, vol=7.350000e+08
assign (segid "   A" and resid   71 and name   HZ) (segid "   A" and resid   22 and name   HN) 3.377 1.426 1.426 weight 1.000 ! spec=15N_NOESY, no=575, id=4450, vol=7.360000e+08
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   58 and name   HN) 3.650 1.665 1.665 weight 1.000 ! spec=15N_NOESY, no=577, id=4452, vol=7.400000e+08
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   37 and name   HN) 3.108 1.207 1.207 weight 1.000 ! spec=15N_NOESY, no=578, id=4453, vol=7.410000e+08
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name   HN) 2.808 0.985 0.985 weight 1.000 ! spec=15N_NOESY, no=579, id=4454, vol=7.430000e+08
assign (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   10 and name   HN) 3.305 1.366 1.366 weight 1.000 ! spec=15N_NOESY, no=582, id=4457, vol=7.510000e+08
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name   HN) 2.805 0.984 0.984 weight 1.000 ! spec=15N_NOESY, no=583, id=4458, vol=7.520000e+08
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   18 and name   HN) 3.047 1.161 1.161 weight 1.000 ! spec=15N_NOESY, no=584, id=4459, vol=7.540000e+08
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   18 and name   HN)
assign (segid "   A" and resid   99 and name   HA) (segid "   A" and resid  100 and name   HN) 2.746 0.943 0.943 weight 1.000 ! spec=15N_NOESY, no=588, id=4463, vol=7.620000e+08
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   35 and name   HN) 3.321 1.379 1.379 weight 1.000 ! spec=15N_NOESY, no=589, id=4464, vol=7.670000e+08
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   49 and name   HN) 2.857 1.020 1.020 weight 1.000 ! spec=15N_NOESY, no=591, id=4466, vol=7.690000e+08
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name   HN) 2.691 0.905 0.905 weight 1.000 ! spec=15N_NOESY, no=592, id=4467, vol=7.710000e+08
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   60 and name   HN) 2.782 0.968 0.968 weight 1.000 ! spec=15N_NOESY, no=593, id=4468, vol=7.720000e+08
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   70 and name   HN) 2.955 1.092 1.092 weight 1.000 ! spec=15N_NOESY, no=594, id=4469, vol=7.790000e+08
assign (segid "   A" and resid   60 and name  HG2) (segid "   A" and resid   60 and name   HN) 3.446 1.484 1.484 weight 1.000 ! spec=15N_NOESY, no=595, id=4470, vol=7.820000e+08
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   67 and name   HN) 2.680 0.898 0.898 weight 1.000 ! spec=15N_NOESY, no=596, id=4471, vol=7.850000e+08
assign (segid "   A" and resid   40 and name   HN) (segid "   A" and resid   41 and name   HN) 2.756 0.950 0.950 weight 1.000 ! spec=15N_NOESY, no=597, id=4472, vol=7.860000e+08
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   55 and name   HN) 2.546 0.810 0.810 weight 1.000 ! spec=15N_NOESY, no=601, id=4476, vol=7.950000e+08
assign (segid "   A" and resid   41 and name HG22) (segid "   A" and resid   42 and name   HN) 2.983 1.112 1.112 weight 1.000 ! spec=15N_NOESY, no=604, id=4479, vol=8.020000e+08
    or (segid "   A" and resid   41 and name HG21) (segid "   A" and resid   42 and name   HN)
    or (segid "   A" and resid   41 and name HG23) (segid "   A" and resid   42 and name   HN)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   29 and name   HN) 3.567 1.590 1.590 weight 1.000 ! spec=15N_NOESY, no=607, id=4482, vol=8.100000e+08
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   29 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   29 and name   HN)
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   37 and name   HN) 2.696 0.908 0.908 weight 1.000 ! spec=15N_NOESY, no=609, id=4484, vol=8.140000e+08
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   79 and name   HN) (segid "   A" and resid   80 and name   HN) 2.713 0.920 0.920 weight 1.000 ! spec=15N_NOESY, no=616, id=4491, vol=8.250000e+08
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   39 and name   HN) 3.077 1.183 1.183 weight 1.000 ! spec=15N_NOESY, no=617, id=4492, vol=8.270000e+08
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   33 and name   HN) 2.604 0.847 0.847 weight 1.000 ! spec=15N_NOESY, no=618, id=4493, vol=8.300000e+08
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   47 and name   HN) 2.773 0.961 0.961 weight 1.000 ! spec=15N_NOESY, no=619, id=4494, vol=8.310000e+08
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HN) 2.768 0.958 0.958 weight 1.000 ! spec=15N_NOESY, no=620, id=4495, vol=8.360000e+08
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name   HN) 2.580 0.832 0.832 weight 1.000 ! spec=15N_NOESY, no=621, id=4496, vol=8.380000e+08
assign (segid "   A" and resid   48 and name HD22) (segid "   A" and resid   49 and name   HN) 3.438 1.478 1.478 weight 1.000 ! spec=15N_NOESY, no=622, id=4497, vol=8.450000e+08
    or (segid "   A" and resid   48 and name HD21) (segid "   A" and resid   49 and name   HN)
    or (segid "   A" and resid   48 and name HD23) (segid "   A" and resid   49 and name   HN)
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   86 and name   HN) 2.660 0.884 0.884 weight 1.000 ! spec=15N_NOESY, no=624, id=4499, vol=8.510000e+08
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   77 and name   HN) 2.772 0.960 0.960 weight 1.000 ! spec=15N_NOESY, no=627, id=4502, vol=8.530000e+08
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   31 and name   HN) 2.515 0.791 0.791 weight 1.000 ! spec=15N_NOESY, no=628, id=4503, vol=8.550000e+08
assign (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   69 and name   HN) 2.840 1.008 1.008 weight 1.000 ! spec=15N_NOESY, no=629, id=4504, vol=8.600000e+08
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   73 and name   HN) 3.416 1.458 1.458 weight 1.000 ! spec=15N_NOESY, no=630, id=4505, vol=8.620000e+08
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   67 and name   HN) 2.593 0.840 0.840 weight 1.000 ! spec=15N_NOESY, no=634, id=4509, vol=8.630000e+08
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   11 and name   HN) 3.585 1.607 1.607 weight 1.000 ! spec=15N_NOESY, no=636, id=4511, vol=8.650000e+08
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   83 and name   HN) 2.590 0.839 0.839 weight 1.000 ! spec=15N_NOESY, no=637, id=4512, vol=8.660000e+08
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name   HN) 2.760 0.952 0.952 weight 1.000 ! spec=15N_NOESY, no=638, id=4513, vol=8.660000e+08
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   27 and name   HN) 2.774 0.962 0.962 weight 1.000 ! spec=15N_NOESY, no=639, id=4514, vol=8.660000e+08
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   70 and name   HN) 2.964 1.098 1.098 weight 1.000 ! spec=15N_NOESY, no=641, id=4516, vol=8.680000e+08
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   92 and name   HN) 3.286 1.350 1.350 weight 1.000 ! spec=15N_NOESY, no=643, id=4517, vol=8.680000e+08
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   78 and name   HN) 2.733 0.933 0.933 weight 1.000 ! spec=15N_NOESY, no=644, id=4518, vol=8.710000e+08
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   79 and name   HN) 2.737 0.936 0.936 weight 1.000 ! spec=15N_NOESY, no=645, id=4519, vol=8.720000e+08
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name   HN) 2.723 0.927 0.927 weight 1.000 ! spec=15N_NOESY, no=646, id=4520, vol=8.740000e+08
assign (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   68 and name   HN) 3.168 1.254 1.254 weight 1.000 ! spec=15N_NOESY, no=647, id=4521, vol=8.740000e+08
assign (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   81 and name   HN) 2.656 0.882 0.882 weight 1.000 ! spec=15N_NOESY, no=652, id=4526, vol=8.870000e+08
assign (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name   HN) 2.589 0.838 0.838 weight 1.000 ! spec=15N_NOESY, no=653, id=4527, vol=8.910000e+08
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   13 and name   HN) 2.626 0.862 0.862 weight 1.000 ! spec=15N_NOESY, no=655, id=4529, vol=8.930000e+08
assign (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   65 and name   HN) 2.658 0.883 0.883 weight 1.000 ! spec=15N_NOESY, no=656, id=4530, vol=8.960000e+08
assign (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   86 and name   HN) 2.695 0.908 0.908 weight 1.000 ! spec=15N_NOESY, no=658, id=4532, vol=8.970000e+08
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name HD22) 3.866 1.869 1.869 weight 1.000 ! spec=15N_NOESY, no=661, id=4535, vol=9.010000e+08
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   71 and name   HN) 3.294 1.356 1.356 weight 1.000 ! spec=15N_NOESY, no=662, id=4536, vol=9.020000e+08
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name   HN) 2.736 0.936 0.936 weight 1.000 ! spec=15N_NOESY, no=663, id=4537, vol=9.050000e+08
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   19 and name   HN) 3.007 1.130 1.130 weight 1.000 ! spec=15N_NOESY, no=664, id=4538, vol=9.080000e+08
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   19 and name   HN)
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   38 and name   HN) 2.632 0.866 0.866 weight 1.000 ! spec=15N_NOESY, no=667, id=4541, vol=9.110000e+08
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name   HN) 2.738 0.937 0.937 weight 1.000 ! spec=15N_NOESY, no=670, id=4544, vol=9.170000e+08
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   33 and name   HN) 2.499 0.781 0.781 weight 1.000 ! spec=15N_NOESY, no=671, id=4545, vol=9.170000e+08
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   33 and name   HN)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   33 and name   HN)
assign (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   53 and name   HN) 2.685 0.901 0.901 weight 1.000 ! spec=15N_NOESY, no=672, id=4546, vol=9.190000e+08
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   42 and name   HN) 2.635 0.868 0.868 weight 1.000 ! spec=15N_NOESY, no=673, id=4547, vol=9.240000e+08
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   27 and name HE21) 3.089 1.193 1.193 weight 1.000 ! spec=15N_NOESY, no=675, id=4549, vol=9.320000e+08
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name   HN) 2.711 0.919 0.919 weight 1.000 ! spec=15N_NOESY, no=676, id=4550, vol=9.320000e+08
assign (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   43 and name   HN) 2.819 0.993 0.993 weight 1.000 ! spec=15N_NOESY, no=677, id=4551, vol=9.350000e+08
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   15 and name   HN) 3.141 1.234 1.234 weight 1.000 ! spec=15N_NOESY, no=678, id=4552, vol=9.360000e+08
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   48 and name   HN) 3.218 1.295 1.295 weight 1.000 ! spec=15N_NOESY, no=679, id=4553, vol=9.370000e+08
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   83 and name   HN) 2.532 0.802 0.802 weight 1.000 ! spec=15N_NOESY, no=681, id=4555, vol=9.420000e+08
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name   HN) 2.802 0.981 0.981 weight 1.000 ! spec=15N_NOESY, no=682, id=4556, vol=9.430000e+08
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   97 and name   HN) 2.806 0.984 0.984 weight 1.000 ! spec=15N_NOESY, no=683, id=4557, vol=9.430000e+08
assign (segid "   A" and resid   72 and name   HN) (segid "   A" and resid   71 and name   HN) 2.697 0.909 0.909 weight 1.000 ! spec=15N_NOESY, no=685, id=4559, vol=9.490000e+08
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name   HN) 2.578 0.831 0.831 weight 1.000 ! spec=15N_NOESY, no=687, id=4561, vol=9.570000e+08
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   28 and name   HN) 2.425 0.735 0.735 weight 1.000 ! spec=15N_NOESY, no=688, id=4562, vol=9.600000e+08
assign (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  105 and name   HN) 2.565 0.823 0.823 weight 1.000 ! spec=15N_NOESY, no=690, id=4564, vol=9.620000e+08
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   11 and name   HN) 2.537 0.804 0.804 weight 1.000 ! spec=15N_NOESY, no=691, id=4565, vol=9.630000e+08
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   85 and name   HN) 2.668 0.890 0.890 weight 1.000 ! spec=15N_NOESY, no=692, id=4566, vol=9.650000e+08
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name   HN) 2.862 1.024 1.024 weight 1.000 ! spec=15N_NOESY, no=693, id=4567, vol=9.670000e+08
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   72 and name   HN) 2.630 0.864 0.864 weight 1.000 ! spec=15N_NOESY, no=694, id=4568, vol=9.700000e+08
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name   HN) 2.704 0.914 0.914 weight 1.000 ! spec=15N_NOESY, no=695, id=4569, vol=9.710000e+08
assign (segid "   A" and resid   83 and name   HN) (segid "   A" and resid   85 and name   HN) 3.115 1.213 1.213 weight 1.000 ! spec=15N_NOESY, no=696, id=4570, vol=9.720000e+08
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   51 and name   HN) 2.654 0.880 0.880 weight 1.000 ! spec=15N_NOESY, no=697, id=4571, vol=9.730000e+08
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   24 and name   HN) 3.348 1.401 1.401 weight 1.000 ! spec=15N_NOESY, no=698, id=4572, vol=9.760000e+08
assign (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   76 and name   HN) 2.639 0.870 0.870 weight 1.000 ! spec=15N_NOESY, no=699, id=4573, vol=9.830000e+08
assign (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   34 and name   HN) 2.644 0.874 0.874 weight 1.000 ! spec=15N_NOESY, no=700, id=4574, vol=9.830000e+08
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   81 and name   HN) 3.302 1.363 1.363 weight 1.000 ! spec=15N_NOESY, no=701, id=4575, vol=9.850000e+08
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   52 and name   HN) 2.678 0.897 0.897 weight 1.000 ! spec=15N_NOESY, no=703, id=4577, vol=9.910000e+08
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   21 and name   HN) 2.938 1.079 1.079 weight 1.000 ! spec=15N_NOESY, no=704, id=4578, vol=9.910000e+08
assign (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  102 and name   HN) 2.705 0.915 0.915 weight 1.000 ! spec=15N_NOESY, no=705, id=4579, vol=9.990000e+08
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   54 and name   HN) 3.084 1.189 1.189 weight 1.000 ! spec=15N_NOESY, no=706, id=4580, vol=1.000000e+09
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name   HN) 2.593 0.840 0.840 weight 1.000 ! spec=15N_NOESY, no=708, id=4582, vol=1.010000e+09
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   15 and name   HN) 2.639 0.871 0.871 weight 1.000 ! spec=15N_NOESY, no=709, id=4583, vol=1.010000e+09
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   14 and name   HN) 2.495 0.778 0.778 weight 1.000 ! spec=15N_NOESY, no=710, id=4584, vol=1.010000e+09
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   17 and name   HN) 2.566 0.823 0.823 weight 1.000 ! spec=15N_NOESY, no=711, id=4585, vol=1.020000e+09
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   72 and name   HN) 2.706 0.915 0.915 weight 1.000 ! spec=15N_NOESY, no=712, id=4586, vol=1.020000e+09
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name   HN) 2.683 0.900 0.900 weight 1.000 ! spec=15N_NOESY, no=714, id=4588, vol=1.020000e+09
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name   HN) 3.355 1.407 1.407 weight 1.000 ! spec=15N_NOESY, no=715, id=4589, vol=1.020000e+09
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HN) 2.599 0.844 0.844 weight 1.000 ! spec=15N_NOESY, no=716, id=4590, vol=1.030000e+09
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   80 and name HE22) 2.679 0.897 0.897 weight 1.000 ! spec=15N_NOESY, no=717, id=4591, vol=1.030000e+09
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name   HN) 2.696 0.908 0.908 weight 1.000 ! spec=15N_NOESY, no=718, id=4592, vol=1.040000e+09
assign (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   51 and name   HN) 2.592 0.840 0.840 weight 1.000 ! spec=15N_NOESY, no=719, id=4593, vol=1.040000e+09
assign (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   58 and name   HN) 2.630 0.865 0.865 weight 1.000 ! spec=15N_NOESY, no=720, id=4594, vol=1.040000e+09
assign (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name   HN) 2.740 0.939 0.939 weight 1.000 ! spec=15N_NOESY, no=721, id=4595, vol=1.040000e+09
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   72 and name   HN) 2.710 0.918 0.918 weight 1.000 ! spec=15N_NOESY, no=722, id=4596, vol=1.040000e+09
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   85 and name   HN) 2.935 1.077 1.077 weight 1.000 ! spec=15N_NOESY, no=723, id=4597, vol=1.050000e+09
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   35 and name   HN) 2.624 0.861 0.861 weight 1.000 ! spec=15N_NOESY, no=724, id=4598, vol=1.060000e+09
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   85 and name   HN) 2.590 0.839 0.839 weight 1.000 ! spec=15N_NOESY, no=725, id=4599, vol=1.060000e+09
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   72 and name   HN) 2.645 0.875 0.875 weight 1.000 ! spec=15N_NOESY, no=726, id=4600, vol=1.060000e+09
assign (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   48 and name   HN) 3.421 1.463 1.463 weight 1.000 ! spec=15N_NOESY, no=727, id=4601, vol=1.060000e+09
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   48 and name   HN)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   48 and name   HN)
assign (segid "   A" and resid   71 and name  HB1) (segid "   A" and resid   71 and name   HN) 2.706 0.915 0.915 weight 1.000 ! spec=15N_NOESY, no=728, id=4602, vol=1.060000e+09
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   28 and name   HN) 2.919 1.065 1.065 weight 1.000 ! spec=15N_NOESY, no=729, id=4603, vol=1.060000e+09
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   23 and name   HN) 2.703 0.913 0.913 weight 1.000 ! spec=15N_NOESY, no=730, id=4604, vol=1.060000e+09
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   65 and name   HN) 2.430 0.738 0.738 weight 1.000 ! spec=15N_NOESY, no=734, id=4608, vol=1.070000e+09
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   45 and name   HN) 2.745 0.942 0.942 weight 1.000 ! spec=15N_NOESY, no=736, id=4610, vol=1.090000e+09
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name   HN)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   45 and name   HN)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name   HN) 2.698 0.910 0.910 weight 1.000 ! spec=15N_NOESY, no=737, id=4611, vol=1.090000e+09
assign (segid "   A" and resid   45 and name  HD1) (segid "   A" and resid   45 and name   HN) 2.982 1.111 1.111 weight 1.000 ! spec=15N_NOESY, no=739, id=4613, vol=1.100000e+09
assign (segid "   A" and resid   53 and name   HN) (segid "   A" and resid   54 and name  HB1) 3.228 1.303 1.303 weight 1.000 ! spec=15N_NOESY, no=740, id=4614, vol=1.100000e+09
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   42 and name   HN) 2.666 0.888 0.888 weight 1.000 ! spec=15N_NOESY, no=743, id=4617, vol=1.120000e+09
assign (segid "   A" and resid   74 and name  HB1) (segid "   A" and resid   74 and name   HN) 2.529 0.799 0.799 weight 1.000 ! spec=15N_NOESY, no=744, id=4618, vol=1.120000e+09
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   66 and name   HN) 3.010 1.132 1.132 weight 1.000 ! spec=15N_NOESY, no=745, id=4619, vol=1.120000e+09
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   73 and name   HN) 2.621 0.859 0.859 weight 1.000 ! spec=15N_NOESY, no=747, id=4621, vol=1.130000e+09
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  103 and name   HN) 2.690 0.905 0.905 weight 1.000 ! spec=15N_NOESY, no=748, id=4622, vol=1.130000e+09
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   14 and name   HN) 2.943 1.082 1.082 weight 1.000 ! spec=15N_NOESY, no=749, id=4623, vol=1.140000e+09
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   32 and name   HN) 2.849 1.015 1.015 weight 1.000 ! spec=15N_NOESY, no=750, id=4624, vol=1.140000e+09
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   32 and name   HN)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   32 and name   HN)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name   HN) 2.566 0.823 0.823 weight 1.000 ! spec=15N_NOESY, no=751, id=4625, vol=1.150000e+09
assign (segid "   A" and resid  102 and name  HB1) (segid "   A" and resid  102 and name   HN) 2.769 0.958 0.958 weight 1.000 ! spec=15N_NOESY, no=753, id=4627, vol=1.160000e+09
assign (segid "   A" and resid   52 and name   HN) (segid "   A" and resid   53 and name   HN) 2.533 0.802 0.802 weight 1.000 ! spec=15N_NOESY, no=754, id=4628, vol=1.170000e+09
assign (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   87 and name   HN) 2.524 0.796 0.796 weight 1.000 ! spec=15N_NOESY, no=755, id=4629, vol=1.170000e+09
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name   HN) 2.822 0.995 0.995 weight 1.000 ! spec=15N_NOESY, no=756, id=4630, vol=1.170000e+09
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name   HN) 2.534 0.802 0.802 weight 1.000 ! spec=15N_NOESY, no=757, id=4631, vol=1.170000e+09
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   60 and name   HN) 2.446 0.748 0.748 weight 1.000 ! spec=15N_NOESY, no=759, id=4633, vol=1.180000e+09
assign (segid "   A" and resid   45 and name  HD1) (segid "   A" and resid   44 and name   HN) 3.380 1.428 1.428 weight 1.000 ! spec=15N_NOESY, no=760, id=4634, vol=1.180000e+09
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   21 and name   HN) 2.541 0.807 0.807 weight 1.000 ! spec=15N_NOESY, no=761, id=4635, vol=1.180000e+09
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name   HN) 2.789 0.972 0.972 weight 1.000 ! spec=15N_NOESY, no=762, id=4636, vol=1.190000e+09
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   30 and name   HN) 2.540 0.806 0.806 weight 1.000 ! spec=15N_NOESY, no=763, id=4637, vol=1.190000e+09
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name   HN) 2.460 0.756 0.756 weight 1.000 ! spec=15N_NOESY, no=764, id=4638, vol=1.190000e+09
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   24 and name   HN) 2.587 0.837 0.837 weight 1.000 ! spec=15N_NOESY, no=768, id=4641, vol=1.220000e+09
assign (segid "   A" and resid   81 and name  HD1) (segid "   A" and resid   78 and name   HN) 3.061 1.171 1.171 weight 1.000 ! spec=15N_NOESY, no=769, id=4642, vol=1.230000e+09
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   32 and name   HN) 3.162 1.250 1.250 weight 1.000 ! spec=15N_NOESY, no=771, id=4644, vol=1.230000e+09
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name   HN) 2.603 0.847 0.847 weight 1.000 ! spec=15N_NOESY, no=773, id=4646, vol=1.230000e+09
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   68 and name   HN) 2.339 0.684 0.684 weight 1.000 ! spec=15N_NOESY, no=774, id=4647, vol=1.240000e+09
assign (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   65 and name   HN) 2.644 0.874 0.874 weight 1.000 ! spec=15N_NOESY, no=777, id=4650, vol=1.270000e+09
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name   HN) 3.089 1.193 1.193 weight 1.000 ! spec=15N_NOESY, no=778, id=4651, vol=1.270000e+09
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   83 and name   HN) 2.327 0.677 0.677 weight 1.000 ! spec=15N_NOESY, no=783, id=4655, vol=1.280000e+09
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   37 and name   HN) 2.446 0.748 0.748 weight 1.000 ! spec=15N_NOESY, no=784, id=4656, vol=1.280000e+09
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name   HN) 2.523 0.795 0.795 weight 1.000 ! spec=15N_NOESY, no=785, id=4657, vol=1.280000e+09
assign (segid "   A" and resid   28 and name  HA1) (segid "   A" and resid   28 and name   HN) 2.732 0.933 0.933 weight 1.000 ! spec=15N_NOESY, no=786, id=4658, vol=1.290000e+09
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name   HN) 2.571 0.826 0.826 weight 1.000 ! spec=15N_NOESY, no=789, id=4661, vol=1.300000e+09
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   25 and name   HN) 2.502 0.782 0.782 weight 1.000 ! spec=15N_NOESY, no=790, id=4662, vol=1.300000e+09
assign (segid "   A" and resid   54 and name  HG2) (segid "   A" and resid   54 and name   HN) 2.462 0.758 0.758 weight 1.000 ! spec=15N_NOESY, no=791, id=4663, vol=1.310000e+09
assign (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   62 and name   HN) 2.530 0.800 0.800 weight 1.000 ! spec=15N_NOESY, no=794, id=4666, vol=1.320000e+09
assign (segid "   A" and resid   71 and name  HB2) (segid "   A" and resid   71 and name   HN) 2.492 0.776 0.776 weight 1.000 ! spec=15N_NOESY, no=795, id=4667, vol=1.320000e+09
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name   HN) 2.563 0.821 0.821 weight 1.000 ! spec=15N_NOESY, no=796, id=4668, vol=1.320000e+09
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   68 and name   HN) 3.108 1.207 1.207 weight 1.000 ! spec=15N_NOESY, no=797, id=4669, vol=1.330000e+09
assign (segid "   A" and resid    8 and name HG12) (segid "   A" and resid    8 and name   HN) 2.585 0.835 0.835 weight 1.000 ! spec=15N_NOESY, no=801, id=4673, vol=1.340000e+09
    or (segid "   A" and resid    8 and name HG11) (segid "   A" and resid    8 and name   HN)
    or (segid "   A" and resid    8 and name HG13) (segid "   A" and resid    8 and name   HN)
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name   HN) 2.509 0.787 0.787 weight 1.000 ! spec=15N_NOESY, no=802, id=4674, vol=1.350000e+09
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name   HN) 2.472 0.764 0.764 weight 1.000 ! spec=15N_NOESY, no=803, id=4675, vol=1.350000e+09
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   38 and name   HN) 2.440 0.744 0.744 weight 1.000 ! spec=15N_NOESY, no=804, id=4676, vol=1.350000e+09
assign (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   94 and name   HN) 2.554 0.815 0.815 weight 1.000 ! spec=15N_NOESY, no=805, id=4677, vol=1.350000e+09
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   40 and name   HN) 2.394 0.717 0.717 weight 1.000 ! spec=15N_NOESY, no=806, id=4678, vol=1.360000e+09
assign (segid "   A" and resid   70 and name   HN) (segid "   A" and resid   71 and name   HN) 2.495 0.778 0.778 weight 1.000 ! spec=15N_NOESY, no=807, id=4679, vol=1.360000e+09
assign (segid "   A" and resid   88 and name  HB1) (segid "   A" and resid   88 and name   HN) 2.415 0.729 0.729 weight 1.000 ! spec=15N_NOESY, no=809, id=4681, vol=1.380000e+09
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name   HN) 2.565 0.823 0.823 weight 1.000 ! spec=15N_NOESY, no=810, id=4682, vol=1.380000e+09
assign (segid "   A" and resid   58 and name  HG2) (segid "   A" and resid   58 and name   HN) 2.451 0.751 0.751 weight 1.000 ! spec=15N_NOESY, no=813, id=4685, vol=1.400000e+09
assign (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   81 and name   HN) 2.315 0.670 0.670 weight 1.000 ! spec=15N_NOESY, no=814, id=4686, vol=1.400000e+09
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   75 and name   HN) 2.518 0.792 0.792 weight 1.000 ! spec=15N_NOESY, no=815, id=4687, vol=1.410000e+09
assign (segid "   A" and resid   92 and name  HB2) (segid "   A" and resid   92 and name   HN) 2.534 0.803 0.803 weight 1.000 ! spec=15N_NOESY, no=818, id=4690, vol=1.430000e+09
    or (segid "   A" and resid   92 and name  HB1) (segid "   A" and resid   92 and name   HN)
    or (segid "   A" and resid   92 and name  HB3) (segid "   A" and resid   92 and name   HN)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   17 and name   HN) 2.292 0.657 0.657 weight 1.000 ! spec=15N_NOESY, no=819, id=4691, vol=1.430000e+09
assign (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid   54 and name   HN) 2.381 0.709 0.709 weight 1.000 ! spec=15N_NOESY, no=820, id=4692, vol=1.430000e+09
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   31 and name   HN) 2.291 0.656 0.656 weight 1.000 ! spec=15N_NOESY, no=823, id=4695, vol=1.460000e+09
assign (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   77 and name   HN) 2.539 0.806 0.806 weight 1.000 ! spec=15N_NOESY, no=824, id=4696, vol=1.470000e+09
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   94 and name   HN) 2.541 0.807 0.807 weight 1.000 ! spec=15N_NOESY, no=825, id=4697, vol=1.490000e+09
assign (segid "   A" and resid   50 and name  HD1) (segid "   A" and resid   50 and name  HE1) 2.522 0.795 0.795 weight 1.000 ! spec=15N_NOESY, no=826, id=4698, vol=1.490000e+09
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name   HN) 2.653 0.880 0.880 weight 1.000 ! spec=15N_NOESY, no=827, id=4699, vol=1.530000e+09
assign (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   91 and name   HN) 2.343 0.686 0.686 weight 1.000 ! spec=15N_NOESY, no=828, id=4700, vol=1.540000e+09
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   81 and name   HN) 2.396 0.717 0.717 weight 1.000 ! spec=15N_NOESY, no=830, id=4702, vol=1.570000e+09
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  105 and name   HN) 2.366 0.700 0.700 weight 1.000 ! spec=15N_NOESY, no=833, id=4705, vol=1.570000e+09
assign (segid "   A" and resid   43 and name  HA1) (segid "   A" and resid   43 and name   HN) 2.649 0.877 0.877 weight 1.000 ! spec=15N_NOESY, no=834, id=4706, vol=1.580000e+09
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name   HN) 2.379 0.708 0.708 weight 1.000 ! spec=15N_NOESY, no=835, id=4707, vol=1.600000e+09
assign (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  110 and name   HN) 2.465 0.760 0.760 weight 1.000 ! spec=15N_NOESY, no=836, id=4708, vol=1.640000e+09
assign (segid "   A" and resid   42 and name  HB2) (segid "   A" and resid   42 and name   HN) 2.362 0.697 0.697 weight 1.000 ! spec=15N_NOESY, no=839, id=4711, vol=1.670000e+09
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   33 and name   HN) 2.306 0.664 0.664 weight 1.000 ! spec=15N_NOESY, no=840, id=4712, vol=1.680000e+09
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   33 and name   HN)
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   33 and name   HN)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   11 and name   HN) 2.391 0.715 0.715 weight 1.000 ! spec=15N_NOESY, no=842, id=4714, vol=1.690000e+09
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   95 and name   HN) 2.433 0.740 0.740 weight 1.000 ! spec=15N_NOESY, no=844, id=4716, vol=1.710000e+09
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   42 and name   HN) 2.427 0.736 0.736 weight 1.000 ! spec=15N_NOESY, no=845, id=4717, vol=1.710000e+09
assign (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   29 and name   HN) 2.675 0.894 0.894 weight 1.000 ! spec=15N_NOESY, no=846, id=4718, vol=1.720000e+09
assign (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   66 and name   HN) 3.018 1.138 1.138 weight 1.000 ! spec=15N_NOESY, no=847, id=4719, vol=1.730000e+09
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name   HN) 3.097 1.199 1.199 weight 1.000 ! spec=15N_NOESY, no=848, id=4720, vol=1.730000e+09
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   68 and name   HN) 2.320 0.673 0.673 weight 1.000 ! spec=15N_NOESY, no=850, id=4722, vol=1.750000e+09
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name   HN) 2.463 0.758 0.758 weight 1.000 ! spec=15N_NOESY, no=852, id=4724, vol=1.760000e+09
assign (segid "   A" and resid   44 and name   HN) (segid "   A" and resid   45 and name   HN) 2.409 0.725 0.725 weight 1.000 ! spec=15N_NOESY, no=853, id=4725, vol=1.770000e+09
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name   HN) 2.146 0.576 0.576 weight 1.000 ! spec=15N_NOESY, no=855, id=4727, vol=1.800000e+09
assign (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid   80 and name   HN) 2.218 0.615 0.615 weight 1.000 ! spec=15N_NOESY, no=856, id=4728, vol=1.810000e+09
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name   HN) 2.352 0.691 0.691 weight 1.000 ! spec=15N_NOESY, no=858, id=4730, vol=1.830000e+09
assign (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   34 and name   HN) 2.365 0.699 0.699 weight 1.000 ! spec=15N_NOESY, no=860, id=4732, vol=1.850000e+09
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name   HN) 2.142 0.573 0.573 weight 1.000 ! spec=15N_NOESY, no=862, id=4734, vol=1.910000e+09
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   70 and name   HN) 2.377 0.706 0.706 weight 1.000 ! spec=15N_NOESY, no=863, id=4735, vol=1.920000e+09
assign (segid "   A" and resid   28 and name  HA2) (segid "   A" and resid   28 and name   HN) 2.149 0.577 0.577 weight 1.000 ! spec=15N_NOESY, no=864, id=4736, vol=1.930000e+09
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    8 and name   HN) 2.373 0.704 0.704 weight 1.000 ! spec=15N_NOESY, no=865, id=4737, vol=1.940000e+09
assign (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name   HN) 2.265 0.641 0.641 weight 1.000 ! spec=15N_NOESY, no=867, id=4739, vol=1.970000e+09
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   86 and name   HN) 2.383 0.710 0.710 weight 1.000 ! spec=15N_NOESY, no=868, id=4740, vol=1.990000e+09
    or (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   86 and name   HN)
    or (segid "   A" and resid   86 and name  HB3) (segid "   A" and resid   86 and name   HN)
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   89 and name   HN) 2.381 0.709 0.709 weight 1.000 ! spec=15N_NOESY, no=870, id=4742, vol=2.000000e+09
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   75 and name   HN) 2.320 0.673 0.673 weight 1.000 ! spec=15N_NOESY, no=871, id=4743, vol=2.020000e+09
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   75 and name   HN)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   75 and name   HN)
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name   HN) 2.350 0.690 0.690 weight 1.000 ! spec=15N_NOESY, no=872, id=4744, vol=2.040000e+09
assign (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   82 and name   HN) 2.313 0.668 0.668 weight 1.000 ! spec=15N_NOESY, no=873, id=4745, vol=2.040000e+09
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   82 and name   HN)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   82 and name   HN)
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   83 and name   HN) 2.526 0.797 0.797 weight 1.000 ! spec=15N_NOESY, no=875, id=4747, vol=2.040000e+09
assign (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   66 and name   HN) 2.240 0.627 0.627 weight 1.000 ! spec=15N_NOESY, no=877, id=4749, vol=2.050000e+09
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   71 and name   HN) 2.396 0.718 0.718 weight 1.000 ! spec=15N_NOESY, no=878, id=4750, vol=2.060000e+09
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   71 and name   HN)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   71 and name   HN)
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   16 and name   HN) 2.672 0.892 0.892 weight 1.000 ! spec=15N_NOESY, no=881, id=4753, vol=2.100000e+09
assign (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   76 and name   HN) 2.359 0.696 0.696 weight 1.000 ! spec=15N_NOESY, no=882, id=4754, vol=2.130000e+09
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   76 and name   HN)
    or (segid "   A" and resid   76 and name  HB3) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   24 and name   HN) 2.798 0.979 0.979 weight 1.000 ! spec=15N_NOESY, no=885, id=4757, vol=2.250000e+09
assign (segid "   A" and resid   78 and name   HA) (segid "   A" and resid   79 and name   HN) 2.274 0.646 0.646 weight 1.000 ! spec=15N_NOESY, no=886, id=4758, vol=2.280000e+09
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name   HN) 2.288 0.654 0.654 weight 1.000 ! spec=15N_NOESY, no=887, id=4759, vol=2.310000e+09
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   89 and name   HN) 2.326 0.676 0.676 weight 1.000 ! spec=15N_NOESY, no=889, id=4761, vol=2.360000e+09
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   73 and name   HN) 2.318 0.672 0.672 weight 1.000 ! spec=15N_NOESY, no=891, id=4763, vol=2.460000e+09
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name   HN) 2.316 0.671 0.671 weight 1.000 ! spec=15N_NOESY, no=893, id=4765, vol=2.510000e+09
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name   HN) 2.316 0.670 0.670 weight 1.000 ! spec=15N_NOESY, no=896, id=4768, vol=2.590000e+09
    or (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   35 and name   HN)
    or (segid "   A" and resid   35 and name  HB3) (segid "   A" and resid   35 and name   HN)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    9 and name   HN) 2.283 0.651 0.651 weight 1.000 ! spec=15N_NOESY, no=897, id=4769, vol=2.590000e+09
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name   HN) 2.397 0.718 0.718 weight 1.000 ! spec=15N_NOESY, no=898, id=4770, vol=2.700000e+09
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   70 and name   HN) 2.225 0.619 0.619 weight 1.000 ! spec=15N_NOESY, no=899, id=4771, vol=2.870000e+09
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   70 and name   HN)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   70 and name   HN)
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid   10 and name   HN) 2.215 0.613 0.613 weight 1.000 ! spec=15N_NOESY, no=900, id=4772, vol=2.870000e+09
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid   79 and name   HN) 2.615 0.855 0.855 weight 1.000 ! spec=15N_NOESY, no=901, id=4773, vol=2.880000e+09
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   55 and name   HN) 2.173 0.590 0.590 weight 1.000 ! spec=15N_NOESY, no=904, id=4776, vol=3.020000e+09
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name   HN) 2.208 0.609 0.609 weight 1.000 ! spec=15N_NOESY, no=905, id=4777, vol=3.100000e+09
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   16 and name   HN) 2.134 0.569 0.569 weight 1.000 ! spec=15N_NOESY, no=906, id=4778, vol=3.250000e+09
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name   HN) 1.942 0.471 0.471 weight 1.000 ! spec=15N_NOESY, no=907, id=4779, vol=3.480000e+09
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HN) 2.563 0.821 0.821 weight 1.000 ! spec=15N_NOESY, no=910, id=4781, vol=3.920000e+09
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   64 and name HD22) (segid "   A" and resid   64 and name HD21) 1.731 0.375 0.375 weight 1.000 ! spec=15N_NOESY, no=912, id=4783, vol=4.070000e+09
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   39 and name   HN) 1.957 0.479 0.479 weight 1.000 ! spec=15N_NOESY, no=913, id=4784, vol=4.110000e+09
assign (segid "   A" and resid   29 and name HE22) (segid "   A" and resid   29 and name HE21) 1.835 0.421 0.421 weight 1.000 ! spec=15N_NOESY, no=915, id=4786, vol=4.440000e+09
assign (segid "   A" and resid   52 and name HE22) (segid "   A" and resid   52 and name HE21) 1.745 0.380 0.380 weight 1.000 ! spec=15N_NOESY, no=918, id=4788, vol=5.510000e+09
assign (segid "   A" and resid   27 and name HE22) (segid "   A" and resid   27 and name HE21) 1.663 0.346 0.346 weight 1.000 ! spec=15N_NOESY, no=919, id=4789, vol=6.020000e+09
assign (segid "   A" and resid   80 and name HE22) (segid "   A" and resid   80 and name HE21) 1.517 0.288 0.288 weight 1.000 ! spec=15N_NOESY, no=926, id=4796, vol=7.660000e+09
assign (segid "   A" and resid   16 and name HE22) (segid "   A" and resid   16 and name HE21) 1.472 0.271 0.271 weight 1.000 ! spec=15N_NOESY, no=931, id=4801, vol=1.410000e+10
assign (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   35 and name   HN) 2.834 1.004 1.004 weight 1.000 ! spec=2D_NOESY, no=2, id=1, vol=1.560000e+07
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   22 and name  HE1) 3.232 1.306 1.306 weight 1.000 ! spec=2D_NOESY, no=4, id=3, vol=2.410000e+07
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name   HN) 2.619 0.858 0.858 weight 1.000 ! spec=2D_NOESY, no=6, id=5, vol=2.240000e+07
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HD1) 3.543 1.569 1.569 weight 1.000 ! spec=2D_NOESY, no=7, id=6, vol=1.450000e+07
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   31 and name   HN) 4.758 2.830 2.830 weight 1.000 ! spec=2D_NOESY, no=8, id=7, vol=1.110000e+06
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   30 and name   HN) 3.958 1.959 1.959 weight 1.000 ! spec=2D_NOESY, no=10, id=9, vol=2.400000e+06
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   67 and name   HN) 2.157 0.582 0.582 weight 1.000 ! spec=2D_NOESY, no=15, id=14, vol=5.890000e+07
assign (segid "   A" and resid   49 and name   HA) (segid "   A" and resid   50 and name   HN) 3.103 1.204 1.204 weight 1.000 ! spec=2D_NOESY, no=16, id=15, vol=9.130000e+06
assign (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name   HN) 3.005 1.129 1.129 weight 1.000 ! spec=2D_NOESY, no=25, id=24, vol=8.030000e+06
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name   HN) 2.189 0.599 0.599 weight 1.000 ! spec=2D_NOESY, no=27, id=26, vol=5.400000e+07
assign (segid "   A" and resid   15 and name   HB) (segid "   A" and resid   15 and name   HN) 3.090 1.193 1.193 weight 1.000 ! spec=2D_NOESY, no=29, id=28, vol=1.620000e+07
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   11 and name   HN) 2.195 0.602 0.602 weight 1.000 ! spec=2D_NOESY, no=30, id=29, vol=4.720000e+07
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name   HN) 3.453 1.491 1.491 weight 1.000 ! spec=2D_NOESY, no=31, id=30, vol=4.710000e+06
assign (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   50 and name   HN) 4.302 2.313 2.313 weight 1.000 ! spec=2D_NOESY, no=32, id=31, vol=5.440000e+06
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name   HN) 3.223 1.298 1.298 weight 1.000 ! spec=2D_NOESY, no=36, id=35, vol=8.630000e+06
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HD2) 3.889 1.891 1.891 weight 1.000 ! spec=2D_NOESY, no=37, id=36, vol=2.940000e+06
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   88 and name  HD2) 4.034 2.034 2.034 weight 1.000 ! spec=2D_NOESY, no=40, id=39, vol=2.800000e+06
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name  HD1) 3.033 1.150 1.150 weight 1.000 ! spec=2D_NOESY, no=44, id=43, vol=2.580000e+07
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   49 and name   HN) 2.193 0.601 0.601 weight 1.000 ! spec=2D_NOESY, no=51, id=50, vol=5.410000e+07
assign (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   81 and name  HE1) 4.131 2.133 2.133 weight 1.000 ! spec=2D_NOESY, no=53, id=52, vol=3.760000e+06
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HD1) 2.605 0.848 0.848 weight 1.000 ! spec=2D_NOESY, no=58, id=57, vol=5.470000e+07
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   51 and name   HN) 2.619 0.857 0.857 weight 1.000 ! spec=2D_NOESY, no=76, id=75, vol=2.800000e+07
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   50 and name  HD1) 3.286 1.349 1.349 weight 1.000 ! spec=2D_NOESY, no=77, id=76, vol=6.890000e+06
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   25 and name   HN) 3.578 1.600 1.600 weight 1.000 ! spec=2D_NOESY, no=81, id=80, vol=4.370000e+06
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   88 and name   HN) 3.935 1.936 1.936 weight 1.000 ! spec=2D_NOESY, no=87, id=86, vol=3.530000e+06
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   58 and name   HN) 4.604 2.650 2.650 weight 1.000 ! spec=2D_NOESY, no=92, id=90, vol=1.110000e+06
assign (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   81 and name  HD1) 2.805 0.984 0.984 weight 1.000 ! spec=2D_NOESY, no=96, id=94, vol=2.770000e+07
assign (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name   HN) 2.538 0.805 0.805 weight 1.000 ! spec=2D_NOESY, no=101, id=99, vol=2.910000e+07
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   74 and name   HN) 2.954 1.091 1.091 weight 1.000 ! spec=2D_NOESY, no=109, id=107, vol=1.100000e+07
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   27 and name HE22) 2.994 1.120 1.120 weight 1.000 ! spec=2D_NOESY, no=115, id=113, vol=9.690000e+06
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   84 and name  HD1) 4.752 2.823 2.823 weight 1.000 ! spec=2D_NOESY, no=119, id=117, vol=2.940000e+06
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   66 and name  HD1) 4.001 2.001 2.001 weight 1.000 ! spec=2D_NOESY, no=122, id=120, vol=1.940000e+06
assign (segid "   A" and resid   73 and name  HB1) (segid "   A" and resid   73 and name   HN) 3.000 1.125 1.125 weight 1.000 ! spec=2D_NOESY, no=129, id=127, vol=1.470000e+07
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   92 and name   HN) 1.584 0.313 0.313 weight 1.000 ! spec=2D_NOESY, no=133, id=131, vol=3.770000e+08
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   16 and name HE22) 3.639 1.655 1.655 weight 1.000 ! spec=2D_NOESY, no=135, id=133, vol=3.300000e+06
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   53 and name   HN) 3.625 1.643 1.643 weight 1.000 ! spec=2D_NOESY, no=137, id=135, vol=5.600000e+06
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   57 and name   HN) 4.033 2.033 2.033 weight 1.000 ! spec=2D_NOESY, no=143, id=141, vol=2.740000e+06
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name   HN) 2.474 0.765 0.765 weight 1.000 ! spec=2D_NOESY, no=146, id=144, vol=5.710000e+07
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   27 and name   HN) 3.390 1.437 1.437 weight 1.000 ! spec=2D_NOESY, no=152, id=149, vol=8.550000e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   72 and name  HD1) 5.881 4.323 4.323 weight 1.000 ! spec=2D_NOESY, no=153, id=150, vol=3.980000e+05
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   25 and name  HD1) 4.160 2.163 2.163 weight 1.000 ! spec=2D_NOESY, no=163, id=159, vol=4.710000e+06
assign (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   27 and name HE21) 4.061 2.061 2.061 weight 1.000 ! spec=2D_NOESY, no=164, id=160, vol=3.790000e+06
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name   HN) 2.798 0.979 0.979 weight 1.000 ! spec=2D_NOESY, no=170, id=165, vol=1.490000e+07
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   56 and name   HN) 3.355 1.407 1.407 weight 1.000 ! spec=2D_NOESY, no=171, id=166, vol=8.740000e+06
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   52 and name HE22) 3.343 1.397 1.397 weight 1.000 ! spec=2D_NOESY, no=173, id=168, vol=1.020000e+07
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   22 and name  HD1) 4.127 2.129 2.129 weight 1.000 ! spec=2D_NOESY, no=181, id=175, vol=4.100000e+06
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   16 and name HE22) 4.728 2.794 2.794 weight 1.000 ! spec=2D_NOESY, no=183, id=177, vol=3.200000e+06
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   26 and name   HN) 2.973 1.105 1.105 weight 1.000 ! spec=2D_NOESY, no=188, id=181, vol=1.180000e+07
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   11 and name   HN) 4.078 2.079 2.079 weight 1.000 ! spec=2D_NOESY, no=192, id=184, vol=1.190000e+07
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   53 and name   HN) 4.394 2.413 2.413 weight 1.000 ! spec=2D_NOESY, no=193, id=185, vol=3.540000e+06
assign (segid "   A" and resid   99 and name  HD1) (segid "   A" and resid   97 and name   HN) 9.961 9.961 12.403 weight 1.000 ! spec=2D_NOESY, no=196, id=188, vol=1.240000e+04
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   17 and name   HN) 3.311 1.370 1.370 weight 1.000 ! spec=2D_NOESY, no=197, id=189, vol=5.940000e+06
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   45 and name   HZ) 5.590 3.906 3.906 weight 1.000 ! spec=2D_NOESY, no=199, id=191, vol=8.680000e+05
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   50 and name  HE1) 3.417 1.460 1.460 weight 1.000 ! spec=2D_NOESY, no=203, id=194, vol=7.790000e+06
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   81 and name  HE1) 3.011 1.133 1.133 weight 1.000 ! spec=2D_NOESY, no=208, id=198, vol=3.710000e+07
assign (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   80 and name HE21) 3.015 1.136 1.136 weight 1.000 ! spec=2D_NOESY, no=213, id=203, vol=2.130000e+07
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   45 and name  HE1) 2.292 0.657 0.657 weight 1.000 ! spec=2D_NOESY, no=217, id=207, vol=1.410000e+08
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   66 and name  HE1) 3.832 1.836 1.836 weight 1.000 ! spec=2D_NOESY, no=218, id=208, vol=9.560000e+06
assign (segid "   A" and resid   28 and name  HA2) (segid "   A" and resid   29 and name   HN) 2.668 0.890 0.890 weight 1.000 ! spec=2D_NOESY, no=228, id=214, vol=4.790000e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   22 and name  HD1) 3.626 1.643 1.643 weight 1.000 ! spec=2D_NOESY, no=231, id=217, vol=1.110000e+07
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name  HD1) 2.953 1.090 1.090 weight 1.000 ! spec=2D_NOESY, no=236, id=221, vol=1.360000e+07
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   51 and name   HN) 3.162 1.249 1.249 weight 1.000 ! spec=2D_NOESY, no=237, id=222, vol=2.860000e+07
assign (segid "   A" and resid   50 and name  HB2) (segid "   A" and resid   50 and name  HE3) 4.483 2.512 2.512 weight 1.000 ! spec=2D_NOESY, no=238, id=223, vol=7.110000e+06
assign (segid "   A" and resid   71 and name  HB2) (segid "   A" and resid   72 and name   HN) 2.973 1.105 1.105 weight 1.000 ! spec=2D_NOESY, no=239, id=224, vol=1.230000e+07
assign (segid "   A" and resid   71 and name  HB2) (segid "   A" and resid   71 and name  HD1) 2.966 1.100 1.100 weight 1.000 ! spec=2D_NOESY, no=243, id=228, vol=2.450000e+07
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   12 and name   HN) 1.991 0.496 0.496 weight 1.000 ! spec=2D_NOESY, no=245, id=230, vol=1.510000e+08
assign (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   84 and name  HD1) 1.917 0.460 0.460 weight 1.000 ! spec=2D_NOESY, no=246, id=231, vol=3.350000e+08
assign (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   85 and name   HN) 1.993 0.496 0.496 weight 1.000 ! spec=2D_NOESY, no=247, id=232, vol=8.650000e+07
assign (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   13 and name   HN) 2.408 0.725 0.725 weight 1.000 ! spec=2D_NOESY, no=249, id=234, vol=3.030000e+07
assign (segid "   A" and resid   72 and name  HB2) (segid "   A" and resid   73 and name   HN) 2.865 1.026 1.026 weight 1.000 ! spec=2D_NOESY, no=250, id=235, vol=1.410000e+07
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name  HD1) 2.689 0.904 0.904 weight 1.000 ! spec=2D_NOESY, no=254, id=239, vol=3.010000e+07
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   83 and name   HN) 3.257 1.326 1.326 weight 1.000 ! spec=2D_NOESY, no=256, id=241, vol=4.890000e+06
assign (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   50 and name  HE3) 2.373 0.704 0.704 weight 1.000 ! spec=2D_NOESY, no=258, id=243, vol=3.490000e+07
assign (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   50 and name  HD1) 4.166 2.170 2.170 weight 1.000 ! spec=2D_NOESY, no=259, id=244, vol=4.700000e+06
assign (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   50 and name   HN) 2.765 0.956 0.956 weight 1.000 ! spec=2D_NOESY, no=260, id=245, vol=1.980000e+07
assign (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   17 and name   HN) 4.180 2.184 2.184 weight 1.000 ! spec=2D_NOESY, no=262, id=247, vol=5.240000e+06
assign (segid "   A" and resid   50 and name  HB1) (segid "   A" and resid   50 and name  HZ2) 3.870 1.872 1.872 weight 1.000 ! spec=2D_NOESY, no=263, id=248, vol=4.040000e+06
assign (segid "   A" and resid   71 and name  HB1) (segid "   A" and resid   71 and name  HD1) 2.837 1.006 1.006 weight 1.000 ! spec=2D_NOESY, no=266, id=251, vol=2.750000e+07
assign (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   84 and name  HE1) 4.128 2.130 2.130 weight 1.000 ! spec=2D_NOESY, no=270, id=255, vol=4.730000e+06
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   77 and name   HN) 3.566 1.590 1.590 weight 1.000 ! spec=2D_NOESY, no=274, id=258, vol=5.570000e+06
assign (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   43 and name   HN) 2.365 0.699 0.699 weight 1.000 ! spec=2D_NOESY, no=278, id=262, vol=3.480000e+07
assign (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name  HD1) 4.733 2.800 2.800 weight 1.000 ! spec=2D_NOESY, no=279, id=263, vol=1.590000e+06
assign (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name  HE1) 5.439 3.698 3.698 weight 1.000 ! spec=2D_NOESY, no=280, id=264, vol=8.020000e+05
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   71 and name   HN) 3.530 1.558 1.558 weight 1.000 ! spec=2D_NOESY, no=282, id=266, vol=6.800000e+06
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name   HN) 3.240 1.312 1.312 weight 1.000 ! spec=2D_NOESY, no=294, id=278, vol=1.280000e+07
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   45 and name  HD1) 2.950 1.088 1.088 weight 1.000 ! spec=2D_NOESY, no=295, id=279, vol=2.890000e+07
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   66 and name  HD1) 2.723 0.927 0.927 weight 1.000 ! spec=2D_NOESY, no=311, id=293, vol=3.180000e+07
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   30 and name   HN) 2.762 0.953 0.953 weight 1.000 ! spec=2D_NOESY, no=313, id=295, vol=1.430000e+07
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   89 and name  HD1) 4.042 2.042 2.042 weight 1.000 ! spec=2D_NOESY, no=315, id=297, vol=4.820000e+06
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   22 and name  HE1) 2.662 0.886 0.886 weight 1.000 ! spec=2D_NOESY, no=316, id=298, vol=4.580000e+07
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   82 and name   HN) 3.962 1.962 1.962 weight 1.000 ! spec=2D_NOESY, no=320, id=302, vol=9.330000e+06
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   81 and name  HD1) 2.992 1.119 1.119 weight 1.000 ! spec=2D_NOESY, no=323, id=305, vol=2.410000e+07
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   81 and name  HE1) 3.466 1.501 1.501 weight 1.000 ! spec=2D_NOESY, no=324, id=306, vol=9.060000e+06
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   26 and name   HN) 3.493 1.525 1.525 weight 1.000 ! spec=2D_NOESY, no=327, id=309, vol=6.720000e+06
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   22 and name  HD1) 2.335 0.681 0.681 weight 1.000 ! spec=2D_NOESY, no=330, id=312, vol=1.560000e+08
assign (segid "   A" and resid   64 and name  HB1) (segid "   A" and resid   64 and name HD22) 4.338 2.353 2.353 weight 1.000 ! spec=2D_NOESY, no=332, id=314, vol=3.540000e+06
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   81 and name  HE1) 3.709 1.720 1.720 weight 1.000 ! spec=2D_NOESY, no=336, id=318, vol=7.710000e+06
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name   HN) 2.457 0.755 0.755 weight 1.000 ! spec=2D_NOESY, no=338, id=320, vol=4.110000e+07
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name HE22) 2.582 0.834 0.834 weight 1.000 ! spec=2D_NOESY, no=340, id=322, vol=8.630000e+06
assign (segid "   A" and resid   51 and name  HG2) (segid "   A" and resid   51 and name   HN) 3.379 1.427 1.427 weight 1.000 ! spec=2D_NOESY, no=341, id=323, vol=4.920000e+06
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   39 and name   HN) 2.835 1.005 1.005 weight 1.000 ! spec=2D_NOESY, no=343, id=325, vol=1.600000e+07
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   66 and name  HD1) 4.123 2.124 2.124 weight 1.000 ! spec=2D_NOESY, no=344, id=326, vol=3.700000e+06
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   40 and name   HN) 2.571 0.826 0.826 weight 1.000 ! spec=2D_NOESY, no=349, id=331, vol=3.510000e+07
assign (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   81 and name   HN) 4.053 2.054 2.054 weight 1.000 ! spec=2D_NOESY, no=354, id=336, vol=3.670000e+06
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   34 and name   HN) 4.265 2.273 2.273 weight 1.000 ! spec=2D_NOESY, no=355, id=337, vol=4.890000e+06
assign (segid "   A" and resid   88 and name  HB2) (segid "   A" and resid   88 and name  HD2) 3.966 1.966 1.966 weight 1.000 ! spec=2D_NOESY, no=358, id=340, vol=4.240000e+06
assign (segid "   A" and resid   29 and name  HB1) (segid "   A" and resid   29 and name HE22) 3.325 1.382 1.382 weight 1.000 ! spec=2D_NOESY, no=362, id=344, vol=7.270000e+06
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   17 and name   HN) 2.273 0.646 0.646 weight 1.000 ! spec=2D_NOESY, no=367, id=349, vol=3.590000e+07
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid   16 and name HE22) 3.534 1.562 1.562 weight 1.000 ! spec=2D_NOESY, no=376, id=358, vol=4.250000e+06
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   34 and name   HN) 5.720 4.090 4.090 weight 1.000 ! spec=2D_NOESY, no=380, id=362, vol=9.620000e+05
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name   HN) 2.308 0.666 0.666 weight 1.000 ! spec=2D_NOESY, no=381, id=363, vol=3.240000e+07
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   34 and name   HN) 2.727 0.929 0.929 weight 1.000 ! spec=2D_NOESY, no=387, id=369, vol=1.890000e+07
assign (segid "   A" and resid  107 and name  HB2) (segid "   A" and resid  107 and name   HN) 3.178 1.262 1.262 weight 1.000 ! spec=2D_NOESY, no=389, id=371, vol=8.090000e+06
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name   HN) 2.335 0.681 0.681 weight 1.000 ! spec=2D_NOESY, no=390, id=372, vol=2.440000e+07
assign (segid "   A" and resid   88 and name  HB1) (segid "   A" and resid   89 and name   HN) 3.598 1.618 1.618 weight 1.000 ! spec=2D_NOESY, no=396, id=378, vol=5.080000e+06
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   20 and name   HN) 2.302 0.663 0.663 weight 1.000 ! spec=2D_NOESY, no=413, id=394, vol=3.130000e+07
assign (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   94 and name   HN) 3.188 1.270 1.270 weight 1.000 ! spec=2D_NOESY, no=417, id=398, vol=5.960000e+06
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   56 and name   HN) 2.038 0.519 0.519 weight 1.000 ! spec=2D_NOESY, no=419, id=400, vol=7.990000e+07
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   57 and name   HN) 3.373 1.422 1.422 weight 1.000 ! spec=2D_NOESY, no=421, id=402, vol=9.170000e+06
assign (segid "   A" and resid   55 and name  HG1) (segid "   A" and resid   52 and name HE22) 3.675 1.689 1.689 weight 1.000 ! spec=2D_NOESY, no=427, id=408, vol=4.520000e+06
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   22 and name   HZ) 3.494 1.526 1.526 weight 1.000 ! spec=2D_NOESY, no=429, id=410, vol=4.960000e+06
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   51 and name   HN) 2.841 1.009 1.009 weight 1.000 ! spec=2D_NOESY, no=430, id=411, vol=1.500000e+07
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   22 and name  HD1) 3.127 1.222 1.222 weight 1.000 ! spec=2D_NOESY, no=433, id=414, vol=1.710000e+07
assign (segid "   A" and resid   80 and name  HG2) (segid "   A" and resid   80 and name HE21) 6.959 6.054 6.054 weight 1.000 ! spec=2D_NOESY, no=438, id=419, vol=7.130000e+04
assign (segid "   A" and resid   80 and name  HG2) (segid "   A" and resid   80 and name HE22) 4.134 2.136 2.136 weight 1.000 ! spec=2D_NOESY, no=442, id=423, vol=4.280000e+06
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   88 and name  HD2) 4.283 2.293 2.293 weight 1.000 ! spec=2D_NOESY, no=450, id=430, vol=4.880000e+06
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name   HN) 2.686 0.902 0.902 weight 1.000 ! spec=2D_NOESY, no=452, id=432, vol=1.620000e+07
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   39 and name HE21) 3.004 1.128 1.128 weight 1.000 ! spec=2D_NOESY, no=455, id=435, vol=2.270000e+07
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   57 and name   HN) 3.227 1.301 1.301 weight 1.000 ! spec=2D_NOESY, no=456, id=436, vol=4.560000e+06
assign (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   52 and name   HN) 2.528 0.799 0.799 weight 1.000 ! spec=2D_NOESY, no=461, id=441, vol=1.930000e+07
assign (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   58 and name   HN) 2.121 0.562 0.562 weight 1.000 ! spec=2D_NOESY, no=462, id=442, vol=5.320000e+07
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   71 and name  HE1) 3.306 1.366 1.366 weight 1.000 ! spec=2D_NOESY, no=463, id=443, vol=7.900000e+06
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   58 and name   HN) 4.387 2.405 2.405 weight 1.000 ! spec=2D_NOESY, no=464, id=444, vol=4.360000e+06
assign (segid "   A" and resid   56 and name  HD2) (segid "   A" and resid   45 and name  HE1) 4.374 2.392 2.392 weight 1.000 ! spec=2D_NOESY, no=465, id=445, vol=5.090000e+06
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   80 and name   HN) 4.305 2.317 2.317 weight 1.000 ! spec=2D_NOESY, no=466, id=446, vol=4.420000e+06
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   84 and name   HN) 4.216 2.222 2.222 weight 1.000 ! spec=2D_NOESY, no=467, id=447, vol=4.380000e+06
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   81 and name  HE1) 3.945 1.945 1.945 weight 1.000 ! spec=2D_NOESY, no=475, id=454, vol=8.830000e+06
assign (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   88 and name  HD2) 3.882 1.884 1.884 weight 1.000 ! spec=2D_NOESY, no=480, id=458, vol=3.250000e+06
assign (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  106 and name   HN) 3.041 1.156 1.156 weight 1.000 ! spec=2D_NOESY, no=483, id=461, vol=7.110000e+06
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   67 and name   HN) 2.374 0.704 0.704 weight 1.000 ! spec=2D_NOESY, no=490, id=468, vol=3.320000e+07
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   67 and name   HN)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   67 and name   HN)
assign (segid "   A" and resid   48 and name  HB1) (segid "   A" and resid   49 and name   HN) 3.348 1.401 1.401 weight 1.000 ! spec=2D_NOESY, no=495, id=472, vol=8.210000e+06
assign (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid   81 and name   HN) 2.697 0.909 0.909 weight 1.000 ! spec=2D_NOESY, no=496, id=473, vol=2.680000e+07
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   24 and name   HN) 2.325 0.676 0.676 weight 1.000 ! spec=2D_NOESY, no=512, id=489, vol=2.370000e+07
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name   HN) 2.374 0.705 0.705 weight 1.000 ! spec=2D_NOESY, no=513, id=490, vol=4.060000e+07
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   21 and name   HN) 2.607 0.849 0.849 weight 1.000 ! spec=2D_NOESY, no=533, id=510, vol=1.720000e+07
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   21 and name   HN)
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   36 and name   HN) 2.686 0.902 0.902 weight 1.000 ! spec=2D_NOESY, no=536, id=513, vol=1.990000e+07
    or (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   35 and name  HB3) (segid "   A" and resid   36 and name   HN)
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   50 and name  HD1) 4.100 2.101 2.101 weight 1.000 ! spec=2D_NOESY, no=552, id=529, vol=2.800000e+06
assign (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   81 and name  HE1) 3.582 1.604 1.604 weight 1.000 ! spec=2D_NOESY, no=557, id=534, vol=8.420000e+06
assign (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   57 and name   HN) 2.629 0.864 0.864 weight 1.000 ! spec=2D_NOESY, no=561, id=538, vol=1.070000e+07
assign (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   22 and name   HZ) 4.199 2.204 2.204 weight 1.000 ! spec=2D_NOESY, no=563, id=540, vol=5.460000e+06
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   21 and name   HN) 2.346 0.688 0.688 weight 1.000 ! spec=2D_NOESY, no=570, id=546, vol=2.830000e+07
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   21 and name   HN)
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   89 and name  HD1) 4.067 2.068 2.068 weight 1.000 ! spec=2D_NOESY, no=571, id=547, vol=1.200000e+07
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   89 and name  HD1)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   89 and name  HD1)
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   25 and name  HD1) 2.840 1.008 1.008 weight 1.000 ! spec=2D_NOESY, no=573, id=549, vol=3.820000e+07
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   25 and name  HD1)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   25 and name  HD1)
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   71 and name  HD1) 4.118 2.120 2.120 weight 1.000 ! spec=2D_NOESY, no=574, id=550, vol=3.690000e+06
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   39 and name HE22) 3.670 1.684 1.684 weight 1.000 ! spec=2D_NOESY, no=575, id=551, vol=1.910000e+07
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   66 and name  HD1) 3.192 1.273 1.273 weight 1.000 ! spec=2D_NOESY, no=576, id=552, vol=1.310000e+07
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   36 and name   HN) 3.045 1.159 1.159 weight 1.000 ! spec=2D_NOESY, no=583, id=559, vol=1.940000e+07
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   36 and name   HN)
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   22 and name   HZ) 3.301 1.362 1.362 weight 1.000 ! spec=2D_NOESY, no=587, id=563, vol=1.190000e+07
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   22 and name   HZ)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   22 and name   HZ)
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   22 and name  HD1) 3.297 1.359 1.359 weight 1.000 ! spec=2D_NOESY, no=588, id=564, vol=2.310000e+07
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   22 and name  HD1)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   22 and name  HD1)
assign (segid "   A" and resid   41 and name HG22) (segid "   A" and resid   45 and name  HD1) 3.046 1.160 1.160 weight 1.000 ! spec=2D_NOESY, no=592, id=568, vol=2.010000e+07
    or (segid "   A" and resid   41 and name HG21) (segid "   A" and resid   45 and name  HD1)
    or (segid "   A" and resid   41 and name HG23) (segid "   A" and resid   45 and name  HD1)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   39 and name HE22) 2.197 0.604 0.604 weight 1.000 ! spec=2D_NOESY, no=594, id=570, vol=8.450000e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   39 and name HE22)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   39 and name HE22)
assign (segid "   A" and resid   41 and name HG22) (segid "   A" and resid   45 and name  HE1) 4.602 2.647 2.647 weight 1.000 ! spec=2D_NOESY, no=595, id=571, vol=2.270000e+06
    or (segid "   A" and resid   41 and name HG21) (segid "   A" and resid   45 and name  HE1)
    or (segid "   A" and resid   41 and name HG23) (segid "   A" and resid   45 and name  HE1)
assign (segid "   A" and resid   41 and name HG22) (segid "   A" and resid   81 and name  HE1) 3.567 1.591 1.591 weight 1.000 ! spec=2D_NOESY, no=596, id=572, vol=1.130000e+07
    or (segid "   A" and resid   41 and name HG21) (segid "   A" and resid   81 and name  HE1)
    or (segid "   A" and resid   41 and name HG23) (segid "   A" and resid   81 and name  HE1)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   22 and name   HN) 1.604 0.321 0.321 weight 1.000 ! spec=2D_NOESY, no=597, id=573, vol=4.280000e+08
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   22 and name   HN)
assign (segid "   A" and resid   82 and name HG22) (segid "   A" and resid   83 and name   HN) 2.678 0.896 0.896 weight 1.000 ! spec=2D_NOESY, no=599, id=575, vol=2.030000e+07
    or (segid "   A" and resid   82 and name HG21) (segid "   A" and resid   83 and name   HN)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid   83 and name   HN)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   71 and name  HD1) 3.832 1.836 1.836 weight 1.000 ! spec=2D_NOESY, no=604, id=580, vol=3.330000e+06
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   71 and name  HD1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   71 and name  HD1)
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   45 and name  HE1) 3.835 1.839 1.839 weight 1.000 ! spec=2D_NOESY, no=606, id=582, vol=5.430000e+06
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name  HE1)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   45 and name  HE1)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   71 and name   HZ) 2.602 0.846 0.846 weight 1.000 ! spec=2D_NOESY, no=610, id=586, vol=2.160000e+07
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   71 and name   HZ)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   71 and name   HZ)
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   45 and name  HD1) 2.789 0.973 0.973 weight 1.000 ! spec=2D_NOESY, no=615, id=591, vol=3.660000e+07
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   45 and name  HD1)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   45 and name  HD1)
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   80 and name HE22) 3.061 1.171 1.171 weight 1.000 ! spec=2D_NOESY, no=616, id=592, vol=1.900000e+07
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   80 and name HE22)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   80 and name HE22)
assign (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name   HN) 3.574 1.597 1.597 weight 1.000 ! spec=2D_NOESY, no=621, id=597, vol=1.150000e+07
assign (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   68 and name   HN) 2.625 0.861 0.861 weight 1.000 ! spec=2D_NOESY, no=622, id=598, vol=1.060000e+07
assign (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   22 and name  HD1) 3.709 1.720 1.720 weight 1.000 ! spec=2D_NOESY, no=624, id=600, vol=7.010000e+06
assign (segid "   A" and resid   74 and name   HG) (segid "   A" and resid   75 and name   HN) 3.438 1.478 1.478 weight 1.000 ! spec=2D_NOESY, no=625, id=601, vol=6.590000e+06
assign (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   72 and name  HE1) 3.329 1.385 1.385 weight 1.000 ! spec=2D_NOESY, no=626, id=602, vol=1.230000e+07
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   72 and name  HE1)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   72 and name  HE1)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   18 and name   HN) 1.953 0.477 0.477 weight 1.000 ! spec=2D_NOESY, no=629, id=605, vol=1.990000e+08
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   18 and name   HN)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   72 and name  HE1) 4.012 2.012 2.012 weight 1.000 ! spec=2D_NOESY, no=640, id=615, vol=4.110000e+06
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   72 and name  HE1)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   72 and name  HE1)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   26 and name   HN) 2.219 0.616 0.616 weight 1.000 ! spec=2D_NOESY, no=644, id=619, vol=5.630000e+07
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   26 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   26 and name   HN)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   22 and name  HD1) 3.728 1.737 1.737 weight 1.000 ! spec=2D_NOESY, no=648, id=623, vol=7.790000e+06
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   22 and name  HD1)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   22 and name  HD1)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   33 and name   HN) 1.787 0.399 0.399 weight 1.000 ! spec=2D_NOESY, no=649, id=624, vol=9.640000e+07
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   33 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   33 and name   HN)
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   50 and name  HD1) 3.176 1.261 1.261 weight 1.000 ! spec=2D_NOESY, no=654, id=629, vol=1.200000e+07
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   50 and name  HD1)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   50 and name  HD1)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   81 and name  HE1) 2.938 1.079 1.079 weight 1.000 ! spec=2D_NOESY, no=656, id=631, vol=3.120000e+07
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   81 and name  HE1)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   81 and name  HE1)
assign (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   82 and name   HN) 2.799 0.979 0.979 weight 1.000 ! spec=2D_NOESY, no=659, id=634, vol=1.560000e+07
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   82 and name   HN)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   82 and name   HN)
assign (segid "   A" and resid   48 and name HD22) (segid "   A" and resid   48 and name   HN) 3.327 1.384 1.384 weight 1.000 ! spec=2D_NOESY, no=660, id=635, vol=1.230000e+07
    or (segid "   A" and resid   48 and name HD21) (segid "   A" and resid   48 and name   HN)
    or (segid "   A" and resid   48 and name HD23) (segid "   A" and resid   48 and name   HN)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   66 and name   HN) 4.188 2.192 2.192 weight 1.000 ! spec=2D_NOESY, no=661, id=636, vol=4.180000e+06
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   66 and name   HN)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   66 and name   HN)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   26 and name   HN) 2.835 1.005 1.005 weight 1.000 ! spec=2D_NOESY, no=664, id=639, vol=1.150000e+07
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   26 and name   HN)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   26 and name   HN)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   22 and name  HE1) 2.494 0.778 0.778 weight 1.000 ! spec=2D_NOESY, no=665, id=640, vol=5.770000e+07
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   22 and name  HE1)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   22 and name  HE1)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   71 and name  HD1) 3.649 1.664 1.664 weight 1.000 ! spec=2D_NOESY, no=666, id=641, vol=1.480000e+07
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   71 and name  HD1)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   71 and name  HD1)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   22 and name  HD1) 3.055 1.167 1.167 weight 1.000 ! spec=2D_NOESY, no=667, id=642, vol=1.730000e+07
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   22 and name  HD1)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   22 and name  HD1)
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   81 and name  HD1) 2.883 1.039 1.039 weight 1.000 ! spec=2D_NOESY, no=670, id=645, vol=3.120000e+07
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   81 and name  HD1)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   81 and name  HD1)
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   71 and name  HD1) 4.034 2.034 2.034 weight 1.000 ! spec=2D_NOESY, no=671, id=646, vol=4.920000e+06
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   71 and name  HD1)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   71 and name  HD1)
assign (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   66 and name  HD1) 3.839 1.843 1.843 weight 1.000 ! spec=2D_NOESY, no=673, id=648, vol=4.840000e+06
assign (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   71 and name  HD1) 4.401 2.421 2.421 weight 1.000 ! spec=2D_NOESY, no=677, id=651, vol=5.270000e+06
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   75 and name   HN) 4.278 2.288 2.288 weight 1.000 ! spec=2D_NOESY, no=678, id=652, vol=4.650000e+06
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   75 and name   HN)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   75 and name   HN)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   22 and name  HE1) 2.967 1.100 1.100 weight 1.000 ! spec=2D_NOESY, no=681, id=655, vol=2.710000e+07
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   22 and name  HE1)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   22 and name  HE1)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   66 and name  HD1) 3.270 1.336 1.336 weight 1.000 ! spec=2D_NOESY, no=682, id=656, vol=1.410000e+07
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   66 and name  HD1)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   71 and name   HZ) 2.846 1.012 1.012 weight 1.000 ! spec=2D_NOESY, no=687, id=660, vol=1.570000e+07
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   71 and name   HZ)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   71 and name   HZ)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   39 and name HE22) 3.642 1.658 1.658 weight 1.000 ! spec=2D_NOESY, no=689, id=662, vol=6.510000e+06
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   39 and name HE22)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   39 and name HE22)
assign (segid "   A" and resid   34 and name  HB2) (segid "   A" and resid   66 and name   HN) 3.302 1.363 1.363 weight 1.000 ! spec=2D_NOESY, no=708, id=679, vol=9.500000e+06
assign (segid "   A" and resid   34 and name   HN) (segid "   A" and resid   64 and name  HB2) 3.545 1.571 1.571 weight 1.000 ! spec=2D_NOESY, no=719, id=690, vol=3.090000e+06
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   50 and name  HE1) 4.084 2.085 2.085 weight 1.000 ! spec=2D_NOESY, no=726, id=697, vol=2.220000e+07
assign (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   47 and name   HN) 3.383 1.431 1.431 weight 1.000 ! spec=2D_NOESY, no=727, id=698, vol=4.290000e+06
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   18 and name   HN) 2.684 0.900 0.900 weight 1.000 ! spec=2D_NOESY, no=731, id=702, vol=2.040000e+07
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   49 and name   HN) 3.940 1.941 1.941 weight 1.000 ! spec=2D_NOESY, no=739, id=710, vol=5.820000e+06
assign (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   27 and name  HG2) 3.215 1.292 1.292 weight 1.000 ! spec=2D_NOESY, no=743, id=714, vol=4.830000e+06
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   15 and name   HN) 2.948 1.087 1.087 weight 1.000 ! spec=2D_NOESY, no=784, id=755, vol=1.170000e+07
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name   HN) 1.460 0.266 0.266 weight 1.000 ! spec=2D_NOESY, no=802, id=773, vol=5.440000e+08
assign (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name   HN) 2.473 0.764 0.764 weight 1.000 ! spec=2D_NOESY, no=807, id=778, vol=2.430000e+07
assign (segid "   A" and resid   53 and name   HG) (segid "   A" and resid   53 and name   HN) 4.247 2.255 2.255 weight 1.000 ! spec=2D_NOESY, no=808, id=779, vol=3.600000e+06
assign (segid "   A" and resid  104 and name   HN) (segid "   A" and resid  104 and name   HG) 3.567 1.590 1.590 weight 1.000 ! spec=2D_NOESY, no=823, id=794, vol=3.900000e+06
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   37 and name   HN) 4.643 2.694 2.694 weight 1.000 ! spec=2D_NOESY, no=828, id=799, vol=1.390000e+06
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name   HN) 2.198 0.604 0.604 weight 1.000 ! spec=2D_NOESY, no=832, id=803, vol=3.080000e+07
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   37 and name HG11) 3.970 1.970 1.970 weight 1.000 ! spec=2D_NOESY, no=836, id=807, vol=5.770000e+06
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   17 and name   HN) 2.810 0.987 0.987 weight 1.000 ! spec=2D_NOESY, no=840, id=811, vol=1.420000e+07
assign (segid "   A" and resid   92 and name   HN) (segid "   A" and resid   91 and name  HB2) 3.834 1.837 1.837 weight 1.000 ! spec=2D_NOESY, no=855, id=826, vol=4.330000e+06
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   19 and name   HN) 2.540 0.807 0.807 weight 1.000 ! spec=2D_NOESY, no=858, id=829, vol=2.740000e+07
assign (segid "   A" and resid   65 and name   HN) (segid "   A" and resid   64 and name  HB2) 3.565 1.589 1.589 weight 1.000 ! spec=2D_NOESY, no=872, id=843, vol=6.420000e+06
assign (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   44 and name   HN) 2.225 0.619 0.619 weight 1.000 ! spec=2D_NOESY, no=903, id=874, vol=7.270000e+07
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   44 and name   HN)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   44 and name   HN)
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   23 and name   HN) 3.807 1.812 1.812 weight 1.000 ! spec=2D_NOESY, no=923, id=894, vol=1.000000e+07
assign (segid "   A" and resid   29 and name  HG2) (segid "   A" and resid   29 and name   HN) 1.554 0.302 0.302 weight 1.000 ! spec=2D_NOESY, no=931, id=902, vol=3.360000e+08
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   29 and name   HN) 1.285 0.206 0.206 weight 1.000 ! spec=2D_NOESY, no=939, id=910, vol=5.490000e+08
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name   HN) 1.656 0.343 0.343 weight 1.000 ! spec=2D_NOESY, no=942, id=913, vol=3.070000e+08
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   87 and name   HN) 2.743 0.940 0.940 weight 1.000 ! spec=2D_NOESY, no=946, id=917, vol=1.990000e+07
    or (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   87 and name   HN)
    or (segid "   A" and resid   86 and name  HB3) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   27 and name   HN) 1.741 0.379 0.379 weight 1.000 ! spec=2D_NOESY, no=947, id=918, vol=2.190000e+08
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   27 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   27 and name   HN)
assign (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   84 and name  HE1) 3.658 1.673 1.673 weight 1.000 ! spec=2D_NOESY, no=958, id=929, vol=8.640000e+06
assign (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   84 and name  HE1) 3.891 1.893 1.893 weight 1.000 ! spec=2D_NOESY, no=962, id=933, vol=5.250000e+06
assign (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   88 and name   HN) 2.699 0.911 0.911 weight 1.000 ! spec=2D_NOESY, no=969, id=940, vol=1.780000e+07
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   89 and name  HE1) 1.943 0.472 0.472 weight 1.000 ! spec=2D_NOESY, no=984, id=955, vol=2.580000e+08
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   89 and name  HE1)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   89 and name  HE1)
assign (segid "   A" and resid   85 and name HG12) (segid "   A" and resid   84 and name  HD1) 3.198 1.278 1.278 weight 1.000 ! spec=2D_NOESY, no=995, id=966, vol=2.310000e+07
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   72 and name  HD1) 3.888 1.890 1.890 weight 1.000 ! spec=2D_NOESY, no=999, id=970, vol=4.520000e+06
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   72 and name  HD1) 2.360 0.696 0.696 weight 1.000 ! spec=2D_NOESY, no=1003, id=974, vol=9.510000e+07
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   72 and name  HD1)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   72 and name  HD1)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   22 and name   HZ) 2.701 0.912 0.912 weight 1.000 ! spec=2D_NOESY, no=1004, id=975, vol=2.540000e+07
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   22 and name   HZ)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   22 and name   HZ)
assign (segid "   A" and resid   81 and name  HD1) (segid "   A" and resid   74 and name HD12) 2.803 0.982 0.982 weight 1.000 ! spec=2D_NOESY, no=1019, id=990, vol=2.780000e+07
    or (segid "   A" and resid   81 and name  HD1) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   81 and name  HD1) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name   HN) 2.668 0.890 0.890 weight 1.000 ! spec=2D_NOESY, no=1027, id=998, vol=9.540000e+06
assign (segid "   A" and resid   27 and name HE21) (segid "   A" and resid   31 and name  HE2) 3.962 1.962 1.962 weight 1.000 ! spec=2D_NOESY, no=1030, id=1001, vol=2.690000e+06
assign (segid "   A" and resid   71 and name  HD1) (segid "   A" and resid   68 and name   HA) 4.826 2.911 2.911 weight 1.000 ! spec=2D_NOESY, no=1043, id=1014, vol=2.600000e+06
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   71 and name  HD1) 3.705 1.716 1.716 weight 1.000 ! spec=2D_NOESY, no=1047, id=1018, vol=6.280000e+06
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   71 and name  HD1)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   71 and name  HD1)
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   27 and name HE22) 3.127 1.222 1.222 weight 1.000 ! spec=2D_NOESY, no=1048, id=1019, vol=6.960000e+06
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   27 and name HE22) 3.863 1.865 1.865 weight 1.000 ! spec=2D_NOESY, no=1049, id=1020, vol=5.620000e+06
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   27 and name HE22)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   27 and name HE22)
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   39 and name HE22) 3.554 1.579 1.579 weight 1.000 ! spec=2D_NOESY, no=1051, id=1022, vol=6.310000e+06
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   39 and name HE22)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   39 and name HE22)
assign (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   45 and name   HZ) 3.672 1.686 1.686 weight 1.000 ! spec=2D_NOESY, no=1053, id=1024, vol=4.100000e+06
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   45 and name   HZ)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   45 and name   HZ)
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   29 and name HE22) 3.091 1.194 1.194 weight 1.000 ! spec=2D_NOESY, no=1064, id=1035, vol=1.150000e+07
assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   39 and name HE22) 3.797 1.802 1.802 weight 1.000 ! spec=2D_NOESY, no=1065, id=1036, vol=7.790000e+06
assign (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid   80 and name HE22) 2.976 1.107 1.107 weight 1.000 ! spec=2D_NOESY, no=1072, id=1043, vol=7.830000e+06
assign (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   75 and name   HA) 4.119 2.121 2.121 weight 1.000 ! spec=2D_NOESY, no=1079, id=1050, vol=4.430000e+06
assign (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   74 and name HD12) 2.766 0.957 0.957 weight 1.000 ! spec=2D_NOESY, no=1088, id=1059, vol=4.150000e+07
    or (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid   71 and name  HB2) (segid "   A" and resid   22 and name  HD1) 3.460 1.497 1.497 weight 1.000 ! spec=2D_NOESY, no=1102, id=1068, vol=9.890000e+06
assign (segid "   A" and resid   71 and name  HB1) (segid "   A" and resid   22 and name  HD1) 3.518 1.547 1.547 weight 1.000 ! spec=2D_NOESY, no=1103, id=1069, vol=9.380000e+06
assign (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   25 and name  HB2) 3.570 1.593 1.593 weight 1.000 ! spec=2D_NOESY, no=1107, id=1073, vol=1.190000e+07
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   88 and name  HB1) 3.004 1.128 1.128 weight 1.000 ! spec=2D_NOESY, no=1111, id=1075, vol=9.430000e+06
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   67 and name  HB2) 2.535 0.803 0.803 weight 1.000 ! spec=2D_NOESY, no=1138, id=1076, vol=1.990000e+07
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   67 and name  HB1) 2.293 0.657 0.657 weight 1.000 ! spec=2D_NOESY, no=1139, id=1077, vol=3.250000e+07
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   31 and name  HG2) 4.564 2.604 2.604 weight 1.000 ! spec=2D_NOESY, no=1140, id=1078, vol=4.650000e+06
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   31 and name  HG1) 2.800 0.980 0.980 weight 1.000 ! spec=2D_NOESY, no=1141, id=1079, vol=5.070000e+06
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   31 and name  HD2) 3.675 1.688 1.688 weight 1.000 ! spec=2D_NOESY, no=1142, id=1080, vol=3.070000e+06
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   68 and name  HD2) 4.687 2.746 2.746 weight 1.000 ! spec=2D_NOESY, no=1144, id=1082, vol=3.060000e+06
assign (segid "   A" and resid   89 and name   HA) (segid "   A" and resid   90 and name  HG2) 5.051 3.189 3.189 weight 1.000 ! spec=2D_NOESY, no=1145, id=1083, vol=3.120000e+06
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   23 and name   HA) 3.396 1.442 1.442 weight 1.000 ! spec=2D_NOESY, no=1146, id=1084, vol=1.160000e+07
assign (segid "   A" and resid   89 and name   HA) (segid "   A" and resid   89 and name  HB2) 3.070 1.178 1.178 weight 1.000 ! spec=2D_NOESY, no=1147, id=1085, vol=8.480000e+06
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name  HB2) 2.572 0.827 0.827 weight 1.000 ! spec=2D_NOESY, no=1149, id=1087, vol=3.210000e+07
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   32 and name   HN) 3.939 1.939 1.939 weight 1.000 ! spec=2D_NOESY, no=1156, id=1091, vol=3.440000e+06
assign (segid "   A" and resid   67 and name   HA) (segid "   A" and resid   22 and name   HZ) 2.331 0.679 0.679 weight 1.000 ! spec=2D_NOESY, no=1159, id=1094, vol=3.200000e+07
assign (segid "   A" and resid   89 and name   HA) (segid "   A" and resid   89 and name  HD1) 3.235 1.309 1.309 weight 1.000 ! spec=2D_NOESY, no=1160, id=1095, vol=1.690000e+07
assign (segid "   A" and resid   89 and name   HA) (segid "   A" and resid   88 and name   HN) 4.360 2.377 2.377 weight 1.000 ! spec=2D_NOESY, no=1161, id=1096, vol=3.700000e+06
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   31 and name   HN) 3.942 1.943 1.943 weight 1.000 ! spec=2D_NOESY, no=1163, id=1098, vol=1.190000e+06
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   22 and name  HE1) 2.965 1.099 1.099 weight 1.000 ! spec=2D_NOESY, no=1164, id=1099, vol=3.900000e+07
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HN) 2.716 0.922 0.922 weight 1.000 ! spec=2D_NOESY, no=1178, id=1113, vol=1.730000e+07
assign (segid "   A" and resid   43 and name   HN) (segid "   A" and resid   42 and name   HN) 1.872 0.438 0.438 weight 1.000 ! spec=2D_NOESY, no=1194, id=1129, vol=1.670000e+08
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   28 and name   HN) 1.770 0.392 0.392 weight 1.000 ! spec=2D_NOESY, no=1197, id=1132, vol=1.170000e+08
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   25 and name   HN) 2.130 0.567 0.567 weight 1.000 ! spec=2D_NOESY, no=1209, id=1143, vol=2.870000e+08
assign (segid "   A" and resid   12 and name  HD2) (segid "   A" and resid   13 and name   HN) 4.172 2.176 2.176 weight 1.000 ! spec=2D_NOESY, no=1211, id=1145, vol=4.820000e+06
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   67 and name   HN) 4.429 2.452 2.452 weight 1.000 ! spec=2D_NOESY, no=1225, id=1159, vol=3.410000e+06
assign (segid "   A" and resid   84 and name  HD1) (segid "   A" and resid   84 and name  HE1) 2.943 1.083 1.083 weight 1.000 ! spec=2D_NOESY, no=1231, id=1165, vol=5.360000e+07
assign (segid "   A" and resid   39 and name HE22) (segid "   A" and resid   39 and name HE21) 1.683 0.354 0.354 weight 1.000 ! spec=2D_NOESY, no=1242, id=1176, vol=1.160000e+08
assign (segid "   A" and resid   84 and name  HE1) (segid "   A" and resid   39 and name HE21) 3.830 1.834 1.834 weight 1.000 ! spec=2D_NOESY, no=1249, id=1183, vol=5.020000e+06
assign (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   71 and name  HD1) 3.654 1.669 1.669 weight 1.000 ! spec=2D_NOESY, no=1253, id=1187, vol=1.550000e+07
assign (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   71 and name  HE1) 2.617 0.856 0.856 weight 1.000 ! spec=2D_NOESY, no=1254, id=1188, vol=8.380000e+07
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   84 and name  HE1) 3.641 1.657 1.657 weight 1.000 ! spec=2D_NOESY, no=1269, id=1201, vol=7.080000e+06
assign (segid "   A" and resid   88 and name  HD2) (segid "   A" and resid   84 and name  HD1) 3.748 1.756 1.756 weight 1.000 ! spec=2D_NOESY, no=1272, id=1203, vol=7.590000e+06
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name  HE1) 2.946 1.085 1.085 weight 1.000 ! spec=2D_NOESY, no=1276, id=1206, vol=5.120000e+07
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   22 and name  HD1) 3.121 1.217 1.217 weight 1.000 ! spec=2D_NOESY, no=1277, id=1207, vol=3.700000e+07
assign (segid "   A" and resid   39 and name HE22) (segid "   A" and resid   88 and name  HD2) 3.050 1.163 1.163 weight 1.000 ! spec=2D_NOESY, no=1283, id=1209, vol=1.920000e+07
assign (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   44 and name   HN) 3.306 1.367 1.367 weight 1.000 ! spec=2D_NOESY, no=1291, id=1214, vol=1.650000e+07
assign (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   45 and name  HD1) 3.724 1.734 1.734 weight 1.000 ! spec=2D_NOESY, no=1292, id=1215, vol=1.800000e+07
assign (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   81 and name  HD1) 2.729 0.931 0.931 weight 1.000 ! spec=2D_NOESY, no=1298, id=1221, vol=8.070000e+07
assign (segid "   A" and resid   81 and name  HE1) (segid "   A" and resid   45 and name  HE1) 2.867 1.027 1.027 weight 1.000 ! spec=2D_NOESY, no=1303, id=1224, vol=7.480000e+07
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   81 and name  HE1) 4.256 2.264 2.264 weight 1.000 ! spec=2D_NOESY, no=1305, id=1226, vol=4.350000e+06
assign (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   48 and name  HB1) 2.202 0.606 0.606 weight 1.000 ! spec=2D_NOESY, no=1307, id=1228, vol=4.660000e+07
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   48 and name  HB1)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   48 and name  HB1)
assign (segid "   A" and resid   22 and name   HZ) (segid "   A" and resid   32 and name   HN) 3.482 1.516 1.516 weight 1.000 ! spec=2D_NOESY, no=1313, id=1234, vol=5.990000e+06
assign (segid "   A" and resid   72 and name  HE1) (segid "   A" and resid   18 and name   HN) 4.023 2.023 2.023 weight 1.000 ! spec=2D_NOESY, no=1315, id=1236, vol=6.130000e+06
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   24 and name   HN) 3.877 1.879 1.879 weight 1.000 ! spec=2D_NOESY, no=1331, id=1252, vol=4.690000e+06
assign (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   75 and name   HN) 3.479 1.513 1.513 weight 1.000 ! spec=2D_NOESY, no=1341, id=1262, vol=8.050000e+06
assign (segid "   A" and resid   69 and name   HN) (segid "   A" and resid   68 and name   HN) 2.567 0.824 0.824 weight 1.000 ! spec=2D_NOESY, no=1348, id=1269, vol=2.500000e+07
assign (segid "   A" and resid   35 and name   HN) (segid "   A" and resid   37 and name   HN) 2.395 0.717 0.717 weight 1.000 ! spec=2D_NOESY, no=1361, id=1282, vol=5.390000e+07
assign (segid "   A" and resid   61 and name   HN) (segid "   A" and resid   62 and name   HN) 1.697 0.360 0.360 weight 1.000 ! spec=2D_NOESY, no=1363, id=1284, vol=1.600000e+08
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   97 and name   HN) 2.223 0.618 0.618 weight 1.000 ! spec=2D_NOESY, no=1364, id=1285, vol=2.800000e+07
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  101 and name   HN) 1.966 0.483 0.483 weight 1.000 ! spec=2D_NOESY, no=1365, id=1286, vol=3.970000e+07
assign (segid "   A" and resid   68 and name   HN) (segid "   A" and resid   67 and name   HN) 3.018 1.139 1.139 weight 1.000 ! spec=2D_NOESY, no=1369, id=1290, vol=2.100000e+07
assign (segid "   A" and resid  100 and name   HN) (segid "   A" and resid  101 and name   HN) 2.469 0.762 0.762 weight 1.000 ! spec=2D_NOESY, no=1371, id=1292, vol=2.050000e+07
assign (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  103 and name   HN) 1.941 0.471 0.471 weight 1.000 ! spec=2D_NOESY, no=1375, id=1296, vol=1.170000e+08
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   10 and name   HN) 1.983 0.491 0.491 weight 1.000 ! spec=2D_NOESY, no=1378, id=1299, vol=1.310000e+08
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   26 and name   HN) 2.111 0.557 0.557 weight 1.000 ! spec=2D_NOESY, no=1382, id=1303, vol=8.220000e+07
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   80 and name HE22) 3.721 1.731 1.731 weight 1.000 ! spec=2D_NOESY, no=1397, id=1317, vol=7.930000e+06
assign (segid "   A" and resid   45 and name  HE1) (segid "   A" and resid   45 and name  HD1) 2.685 0.901 0.901 weight 1.000 ! spec=2D_NOESY, no=1405, id=1325, vol=9.370000e+07
assign (segid "   A" and resid   31 and name   HN) (segid "   A" and resid   27 and name HE22) 2.279 0.649 0.649 weight 1.000 ! spec=2D_NOESY, no=1406, id=1326, vol=4.970000e+07
assign (segid "   A" and resid   71 and name  HE1) (segid "   A" and resid   71 and name  HD1) 2.313 0.669 0.669 weight 1.000 ! spec=2D_NOESY, no=1408, id=1328, vol=2.150000e+08
assign (segid "   A" and resid   27 and name HE21) (segid "   A" and resid   29 and name HE22) 2.120 0.562 0.562 weight 1.000 ! spec=2D_NOESY, no=1413, id=1333, vol=5.410000e+07
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   56 and name   HN) 2.446 0.748 0.748 weight 1.000 ! spec=2D_NOESY, no=1417, id=1337, vol=2.930000e+07
assign (segid "   A" and resid   57 and name   HN) (segid "   A" and resid   58 and name   HN) 2.001 0.501 0.501 weight 1.000 ! spec=2D_NOESY, no=1418, id=1338, vol=9.210000e+07
assign (segid "   A" and resid   50 and name  HZ3) (segid "   A" and resid   54 and name HE21) 2.321 0.674 0.674 weight 1.000 ! spec=2D_NOESY, no=1422, id=1342, vol=6.360000e+07
assign (segid "   A" and resid   50 and name  HZ3) (segid "   A" and resid   50 and name  HE3) 2.450 0.750 0.750 weight 1.000 ! spec=2D_NOESY, no=1423, id=1343, vol=4.330000e+07
assign (segid "   A" and resid   50 and name  HZ2) (segid "   A" and resid   50 and name  HZ3) 3.935 1.936 1.936 weight 1.000 ! spec=2D_NOESY, no=1424, id=1344, vol=8.300000e+06
assign (segid "   A" and resid   50 and name  HH2) (segid "   A" and resid   50 and name  HZ2) 2.446 0.748 0.748 weight 1.000 ! spec=2D_NOESY, no=1425, id=1345, vol=4.410000e+07
assign (segid "   A" and resid  112 and name  HE1) (segid "   A" and resid  112 and name  HD1) 2.657 0.882 0.882 weight 1.000 ! spec=2D_NOESY, no=1427, id=1347, vol=1.030000e+08
assign (segid "   A" and resid   54 and name HE21) (segid "   A" and resid   50 and name  HH2) 3.084 1.189 1.189 weight 1.000 ! spec=2D_NOESY, no=1430, id=1350, vol=1.480000e+07
assign (segid "   A" and resid   39 and name HE21) (segid "   A" and resid   84 and name  HD1) 2.583 0.834 0.834 weight 1.000 ! spec=2D_NOESY, no=1431, id=1351, vol=8.880000e+07
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   89 and name  HE1) 4.264 2.273 2.273 weight 1.000 ! spec=2D_NOESY, no=1433, id=1353, vol=2.370000e+06
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   89 and name  HE1) 3.859 1.861 1.861 weight 1.000 ! spec=2D_NOESY, no=1434, id=1354, vol=7.540000e+06
assign (segid "   A" and resid   39 and name   HN) (segid "   A" and resid   40 and name   HN) 2.402 0.721 0.721 weight 1.000 ! spec=2D_NOESY, no=1435, id=1355, vol=4.050000e+07
assign (segid "   A" and resid   88 and name   HN) (segid "   A" and resid   87 and name   HN) 1.981 0.490 0.490 weight 1.000 ! spec=2D_NOESY, no=1436, id=1356, vol=1.380000e+08
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   89 and name  HD1) 3.833 1.837 1.837 weight 1.000 ! spec=2D_NOESY, no=1439, id=1359, vol=7.780000e+06
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   78 and name   HN) 3.546 1.572 1.572 weight 1.000 ! spec=2D_NOESY, no=1442, id=1362, vol=8.610000e+06
assign (segid "   A" and resid   78 and name   HN) (segid "   A" and resid   77 and name   HN) 2.190 0.599 0.599 weight 1.000 ! spec=2D_NOESY, no=1444, id=1364, vol=4.960000e+07
assign (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   81 and name   HN) 2.847 1.013 1.013 weight 1.000 ! spec=2D_NOESY, no=1445, id=1365, vol=2.110000e+07
assign (segid "   A" and resid   64 and name HD21) (segid "   A" and resid   65 and name   HN) 2.416 0.730 0.730 weight 1.000 ! spec=2D_NOESY, no=1447, id=1367, vol=1.190000e+08
assign (segid "   A" and resid   60 and name   HN) (segid "   A" and resid   62 and name   HN) 3.167 1.254 1.254 weight 1.000 ! spec=2D_NOESY, no=1451, id=1371, vol=9.380000e+06
assign (segid "   A" and resid   75 and name   HN) (segid "   A" and resid   76 and name   HN) 2.330 0.679 0.679 weight 1.000 ! spec=2D_NOESY, no=1452, id=1372, vol=4.490000e+07
assign (segid "   A" and resid   64 and name   HA) (segid "   A" and resid   64 and name  HB2) 2.995 1.121 1.121 weight 1.000 ! spec=2D_NOESY, no=1456, id=1376, vol=7.350000e+06
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   46 and name  HG2) 6.423 5.156 5.156 weight 1.000 ! spec=2D_NOESY, no=1458, id=1378, vol=8.400000e+05
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   23 and name  HB2) 3.341 1.395 1.395 weight 1.000 ! spec=2D_NOESY, no=1459, id=1379, vol=1.080000e+07
assign (segid "   A" and resid  110 and name   HA) (segid "   A" and resid  111 and name  HA2) 4.048 2.049 2.049 weight 1.000 ! spec=2D_NOESY, no=1461, id=1381, vol=7.190000e+06
assign (segid "   A" and resid  110 and name   HA) (segid "   A" and resid  110 and name  HE2) 5.451 3.714 3.714 weight 1.000 ! spec=2D_NOESY, no=1465, id=1385, vol=1.950000e+06
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name  HB1) 3.137 1.230 1.230 weight 1.000 ! spec=2D_NOESY, no=1466, id=1386, vol=7.230000e+06
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   46 and name  HD2) 3.009 1.132 1.132 weight 1.000 ! spec=2D_NOESY, no=1468, id=1388, vol=1.600000e+07
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   46 and name  HD1) 2.472 0.764 0.764 weight 1.000 ! spec=2D_NOESY, no=1469, id=1389, vol=1.610000e+07
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HB2) 3.318 1.376 1.376 weight 1.000 ! spec=2D_NOESY, no=1470, id=1390, vol=9.910000e+06
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name  HB2) 2.723 0.927 0.927 weight 1.000 ! spec=2D_NOESY, no=1473, id=1393, vol=3.350000e+07
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   45 and name  HB1) 1.684 0.355 0.355 weight 1.000 ! spec=2D_NOESY, no=1478, id=1398, vol=2.430000e+08
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   67 and name  HB1) 2.847 1.013 1.013 weight 1.000 ! spec=2D_NOESY, no=1479, id=1399, vol=2.490000e+07
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   70 and name  HB2) 2.672 0.892 0.892 weight 1.000 ! spec=2D_NOESY, no=1482, id=1402, vol=2.410000e+07
    or (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   70 and name  HB3)
assign (segid "   A" and resid  110 and name   HA) (segid "   A" and resid  110 and name  HG2) 3.728 1.737 1.737 weight 1.000 ! spec=2D_NOESY, no=1487, id=1407, vol=3.560000e+06
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HG2) 4.482 2.512 2.512 weight 1.000 ! spec=2D_NOESY, no=1490, id=1410, vol=7.870000e+05
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name   HA) 3.325 1.382 1.382 weight 1.000 ! spec=2D_NOESY, no=1497, id=1417, vol=6.220000e+06
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HB2) 2.460 0.756 0.756 weight 1.000 ! spec=2D_NOESY, no=1501, id=1421, vol=4.580000e+07
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   46 and name  HB1) 1.740 0.379 0.379 weight 1.000 ! spec=2D_NOESY, no=1502, id=1422, vol=2.340000e+08
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   45 and name  HB2) 3.031 1.149 1.149 weight 1.000 ! spec=2D_NOESY, no=1508, id=1428, vol=1.910000e+07
assign (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   91 and name  HB1) 3.822 1.826 1.826 weight 1.000 ! spec=2D_NOESY, no=1510, id=1430, vol=5.060000e+06
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HG12) 3.583 1.605 1.605 weight 1.000 ! spec=2D_NOESY, no=1513, id=1433, vol=1.440000e+06
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HG22) 2.617 0.856 0.856 weight 1.000 ! spec=2D_NOESY, no=1516, id=1436, vol=1.960000e+07
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name HG23)
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   14 and name  HB2) 3.767 1.774 1.774 weight 1.000 ! spec=2D_NOESY, no=1518, id=1438, vol=2.920000e+06
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid  102 and name  HB1) 3.663 1.678 1.678 weight 1.000 ! spec=2D_NOESY, no=1519, id=1439, vol=4.600000e+06
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG21) 3.794 1.799 1.799 weight 1.000 ! spec=2D_NOESY, no=1524, id=1444, vol=5.720000e+06
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   84 and name  HB2) 2.879 1.036 1.036 weight 1.000 ! spec=2D_NOESY, no=1525, id=1445, vol=2.300000e+07
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   17 and name  HB2) 3.166 1.253 1.253 weight 1.000 ! spec=2D_NOESY, no=1531, id=1451, vol=1.310000e+07
assign (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB2) 2.442 0.745 0.745 weight 1.000 ! spec=2D_NOESY, no=1538, id=1458, vol=3.560000e+07
    or (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name  HB1) 3.055 1.167 1.167 weight 1.000 ! spec=2D_NOESY, no=1539, id=1459, vol=8.760000e+06
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    9 and name  HB2) 2.781 0.967 0.967 weight 1.000 ! spec=2D_NOESY, no=1540, id=1460, vol=2.360000e+07
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    9 and name  HG2) 3.618 1.636 1.636 weight 1.000 ! spec=2D_NOESY, no=1541, id=1461, vol=5.540000e+06
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HD12) 3.059 1.170 1.170 weight 1.000 ! spec=2D_NOESY, no=1545, id=1465, vol=2.800000e+07
    or (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name HD13)
assign (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   63 and name  HB2) 2.564 0.822 0.822 weight 1.000 ! spec=2D_NOESY, no=1547, id=1467, vol=3.020000e+07
    or (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   63 and name  HB1)
    or (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   63 and name  HB3)
assign (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name HD12) 2.201 0.605 0.605 weight 1.000 ! spec=2D_NOESY, no=1551, id=1471, vol=9.250000e+07
    or (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name HD11)
    or (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name HD13)
assign (segid "   A" and resid   25 and name   HA) (segid "   A" and resid   25 and name  HB1) 3.287 1.350 1.350 weight 1.000 ! spec=2D_NOESY, no=1553, id=1473, vol=6.560000e+06
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name  HB2) 2.227 0.620 0.620 weight 1.000 ! spec=2D_NOESY, no=1558, id=1478, vol=6.090000e+07
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name  HB3)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name  HB1) 3.014 1.135 1.135 weight 1.000 ! spec=2D_NOESY, no=1562, id=1482, vol=1.380000e+07
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name  HB1) 2.927 1.071 1.071 weight 1.000 ! spec=2D_NOESY, no=1571, id=1491, vol=7.890000e+06
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   38 and name  HB2) 2.687 0.903 0.903 weight 1.000 ! spec=2D_NOESY, no=1575, id=1495, vol=2.460000e+07
assign (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HG22) 2.452 0.752 0.752 weight 1.000 ! spec=2D_NOESY, no=1578, id=1498, vol=3.780000e+07
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HG21)
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HG23)
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name  HB2) 2.831 1.002 1.002 weight 1.000 ! spec=2D_NOESY, no=1585, id=1505, vol=3.270000e+07
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name  HG2) 2.625 0.861 0.861 weight 1.000 ! spec=2D_NOESY, no=1586, id=1506, vol=1.810000e+07
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name  HG2) 2.754 0.948 0.948 weight 1.000 ! spec=2D_NOESY, no=1588, id=1508, vol=2.460000e+07
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name  HG1) 2.889 1.043 1.043 weight 1.000 ! spec=2D_NOESY, no=1591, id=1511, vol=3.650000e+07
assign (segid "   A" and resid   57 and name   HA) (segid "   A" and resid   57 and name  HB1) 2.812 0.989 0.989 weight 1.000 ! spec=2D_NOESY, no=1595, id=1515, vol=2.800000e+07
assign (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   81 and name  HB1) 1.953 0.477 0.477 weight 1.000 ! spec=2D_NOESY, no=1596, id=1516, vol=4.040000e+07
assign (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   17 and name  HD1) 2.530 0.800 0.800 weight 1.000 ! spec=2D_NOESY, no=1604, id=1524, vol=1.510000e+07
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid  103 and name  HB2) 2.581 0.833 0.833 weight 1.000 ! spec=2D_NOESY, no=1609, id=1529, vol=2.450000e+07
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   16 and name   HA) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   26 and name  HB2) 3.874 1.876 1.876 weight 1.000 ! spec=2D_NOESY, no=1613, id=1533, vol=1.950000e+06
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG22) 2.383 0.710 0.710 weight 1.000 ! spec=2D_NOESY, no=1614, id=1534, vol=2.110000e+07
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name  HG2) 2.750 0.946 0.946 weight 1.000 ! spec=2D_NOESY, no=1615, id=1535, vol=1.910000e+07
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB2) 2.421 0.732 0.732 weight 1.000 ! spec=2D_NOESY, no=1620, id=1540, vol=4.320000e+07
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   55 and name  HG2) 2.582 0.833 0.833 weight 1.000 ! spec=2D_NOESY, no=1629, id=1549, vol=1.910000e+07
assign (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name  HB2) 2.275 0.647 0.647 weight 1.000 ! spec=2D_NOESY, no=1636, id=1556, vol=6.140000e+07
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   38 and name  HB1) 3.717 1.727 1.727 weight 1.000 ! spec=2D_NOESY, no=1637, id=1557, vol=4.160000e+06
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   79 and name  HB2) 1.830 0.418 0.418 weight 1.000 ! spec=2D_NOESY, no=1638, id=1558, vol=1.220000e+08
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid    9 and name  HB2) 2.195 0.602 0.602 weight 1.000 ! spec=2D_NOESY, no=1642, id=1562, vol=5.930000e+07
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name  HB2) 2.677 0.896 0.896 weight 1.000 ! spec=2D_NOESY, no=1643, id=1563, vol=2.740000e+07
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG12) 2.537 0.805 0.805 weight 1.000 ! spec=2D_NOESY, no=1644, id=1564, vol=4.080000e+07
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   76 and name  HB2) 2.082 0.542 0.542 weight 1.000 ! spec=2D_NOESY, no=1646, id=1566, vol=5.950000e+07
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HB2) 2.041 0.521 0.521 weight 1.000 ! spec=2D_NOESY, no=1649, id=1569, vol=6.240000e+07
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG22) 2.584 0.835 0.835 weight 1.000 ! spec=2D_NOESY, no=1650, id=1570, vol=3.330000e+07
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name  HB2) 2.046 0.523 0.523 weight 1.000 ! spec=2D_NOESY, no=1653, id=1573, vol=1.150000e+08
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   58 and name  HB2) 1.939 0.470 0.470 weight 1.000 ! spec=2D_NOESY, no=1654, id=1574, vol=7.380000e+07
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   34 and name  HG2) 2.649 0.877 0.877 weight 1.000 ! spec=2D_NOESY, no=1657, id=1577, vol=3.340000e+07
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name   HB) 2.192 0.600 0.600 weight 1.000 ! spec=2D_NOESY, no=1659, id=1579, vol=2.060000e+07
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HG11) 4.281 2.291 2.291 weight 1.000 ! spec=2D_NOESY, no=1660, id=1580, vol=2.920000e+06
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HD12) 5.342 3.568 3.568 weight 1.000 ! spec=2D_NOESY, no=1662, id=1582, vol=1.930000e+06
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   19 and name  HB2) 2.405 0.723 0.723 weight 1.000 ! spec=2D_NOESY, no=1665, id=1585, vol=5.460000e+07
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name   HB) 2.738 0.937 0.937 weight 1.000 ! spec=2D_NOESY, no=1666, id=1586, vol=1.760000e+07
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   23 and name  HB1) 4.366 2.383 2.383 weight 1.000 ! spec=2D_NOESY, no=1681, id=1601, vol=2.020000e+06
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   10 and name HG22) 2.651 0.878 0.878 weight 1.000 ! spec=2D_NOESY, no=1683, id=1603, vol=2.680000e+07
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   10 and name HG23)
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   75 and name HG22) 3.294 1.356 1.356 weight 1.000 ! spec=2D_NOESY, no=1684, id=1604, vol=6.660000e+06
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   75 and name HG23)
assign (segid "   A" and resid   93 and name  HD2) (segid "   A" and resid   92 and name  HB2) 1.671 0.349 0.349 weight 1.000 ! spec=2D_NOESY, no=1688, id=1608, vol=4.760000e+08
    or (segid "   A" and resid   93 and name  HD2) (segid "   A" and resid   92 and name  HB1)
    or (segid "   A" and resid   93 and name  HD2) (segid "   A" and resid   92 and name  HB3)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HB2) 2.796 0.977 0.977 weight 1.000 ! spec=2D_NOESY, no=1689, id=1609, vol=1.800000e+07
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name  HB1) 2.894 1.047 1.047 weight 1.000 ! spec=2D_NOESY, no=1690, id=1610, vol=1.970000e+07
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD12) 3.034 1.151 1.151 weight 1.000 ! spec=2D_NOESY, no=1691, id=1611, vol=2.650000e+07
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   48 and name HD12) 3.341 1.395 1.395 weight 1.000 ! spec=2D_NOESY, no=1692, id=1612, vol=5.420000e+06
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   48 and name HD13)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   56 and name  HB1) 3.239 1.311 1.311 weight 1.000 ! spec=2D_NOESY, no=1694, id=1614, vol=1.340000e+07
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   48 and name  HB1) 3.015 1.137 1.137 weight 1.000 ! spec=2D_NOESY, no=1696, id=1616, vol=7.640000e+06
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   41 and name HG22) 4.767 2.840 2.840 weight 1.000 ! spec=2D_NOESY, no=1698, id=1618, vol=1.160000e+06
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   56 and name  HB2) 2.269 0.644 0.644 weight 1.000 ! spec=2D_NOESY, no=1701, id=1621, vol=3.250000e+07
assign (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   57 and name  HE2) 4.605 2.651 2.651 weight 1.000 ! spec=2D_NOESY, no=1702, id=1622, vol=2.020000e+06
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   54 and name  HG2) 2.301 0.662 0.662 weight 1.000 ! spec=2D_NOESY, no=1703, id=1623, vol=4.050000e+07
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   53 and name HD22) 2.748 0.944 0.944 weight 1.000 ! spec=2D_NOESY, no=1705, id=1625, vol=1.970000e+07
    or (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   23 and name  HB2) 2.250 0.633 0.633 weight 1.000 ! spec=2D_NOESY, no=1708, id=1628, vol=5.330000e+07
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   57 and name  HD2) 2.480 0.769 0.769 weight 1.000 ! spec=2D_NOESY, no=1714, id=1634, vol=3.730000e+07
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   91 and name  HB1) 5.099 3.250 3.250 weight 1.000 ! spec=2D_NOESY, no=1716, id=1636, vol=1.200000e+06
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name  HB1) 1.970 0.485 0.485 weight 1.000 ! spec=2D_NOESY, no=1720, id=1640, vol=1.280000e+08
assign (segid "   A" and resid   93 and name  HD1) (segid "   A" and resid   92 and name  HB2) 3.185 1.268 1.268 weight 1.000 ! spec=2D_NOESY, no=1721, id=1641, vol=2.620000e+07
    or (segid "   A" and resid   93 and name  HD1) (segid "   A" and resid   92 and name  HB1)
    or (segid "   A" and resid   93 and name  HD1) (segid "   A" and resid   92 and name  HB3)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   74 and name HD22) 3.815 1.819 1.819 weight 1.000 ! spec=2D_NOESY, no=1724, id=1644, vol=3.210000e+06
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   74 and name HD21)
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   74 and name HD23)
assign (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name HD12) 2.462 0.758 0.758 weight 1.000 ! spec=2D_NOESY, no=1731, id=1651, vol=3.040000e+07
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   18 and name   HA) 2.416 0.730 0.730 weight 1.000 ! spec=2D_NOESY, no=1734, id=1654, vol=3.390000e+07
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   18 and name   HA)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   18 and name   HA)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HG11) 2.163 0.585 0.585 weight 1.000 ! spec=2D_NOESY, no=1735, id=1655, vol=5.910000e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name   HB) 2.436 0.742 0.742 weight 1.000 ! spec=2D_NOESY, no=1736, id=1656, vol=2.340000e+07
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HD12) 2.152 0.579 0.579 weight 1.000 ! spec=2D_NOESY, no=1738, id=1658, vol=3.880000e+07
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   36 and name  HB2) 3.789 1.794 1.794 weight 1.000 ! spec=2D_NOESY, no=1739, id=1659, vol=5.890000e+06
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   20 and name HG21) 3.898 1.899 1.899 weight 1.000 ! spec=2D_NOESY, no=1740, id=1660, vol=3.950000e+06
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   20 and name HG23)
assign (segid "   A" and resid   46 and name  HD2) (segid "   A" and resid   46 and name  HD1) 1.876 0.440 0.440 weight 1.000 ! spec=2D_NOESY, no=1742, id=1662, vol=7.030000e+07
assign (segid "   A" and resid   46 and name  HD2) (segid "   A" and resid   46 and name  HG2) 3.608 1.627 1.627 weight 1.000 ! spec=2D_NOESY, no=1745, id=1665, vol=7.980000e+06
assign (segid "   A" and resid   46 and name  HD2) (segid "   A" and resid   46 and name  HB1) 3.491 1.523 1.523 weight 1.000 ! spec=2D_NOESY, no=1747, id=1667, vol=9.140000e+06
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   67 and name  HB1) 1.692 0.358 0.358 weight 1.000 ! spec=2D_NOESY, no=1748, id=1668, vol=1.070000e+08
assign (segid "   A" and resid   67 and name  HB2) (segid "   A" and resid   31 and name  HG1) 3.312 1.371 1.371 weight 1.000 ! spec=2D_NOESY, no=1749, id=1669, vol=5.100000e+06
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   32 and name HG22) 3.590 1.611 1.611 weight 1.000 ! spec=2D_NOESY, no=1759, id=1679, vol=7.680000e+06
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name HG12) 2.130 0.567 0.567 weight 1.000 ! spec=2D_NOESY, no=1761, id=1681, vol=6.500000e+07
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   86 and name  HB2) 2.500 0.781 0.781 weight 1.000 ! spec=2D_NOESY, no=1766, id=1686, vol=2.140000e+07
    or (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   86 and name  HB3)
assign (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid    9 and name  HB2) 3.584 1.606 1.606 weight 1.000 ! spec=2D_NOESY, no=1767, id=1687, vol=9.620000e+06
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   74 and name   HG) 3.452 1.490 1.490 weight 1.000 ! spec=2D_NOESY, no=1775, id=1695, vol=8.100000e+06
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   82 and name HG12) 5.765 4.155 4.155 weight 1.000 ! spec=2D_NOESY, no=1776, id=1696, vol=4.170000e+05
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   40 and name HD12) 3.503 1.534 1.534 weight 1.000 ! spec=2D_NOESY, no=1782, id=1702, vol=7.020000e+06
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   68 and name  HB2) 2.976 1.107 1.107 weight 1.000 ! spec=2D_NOESY, no=1785, id=1705, vol=8.300000e+06
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   18 and name HD12) 3.419 1.461 1.461 weight 1.000 ! spec=2D_NOESY, no=1789, id=1709, vol=5.160000e+06
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid    9 and name  HE2) (segid "   A" and resid    9 and name  HD2) 2.609 0.851 0.851 weight 1.000 ! spec=2D_NOESY, no=1793, id=1713, vol=1.600000e+07
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   85 and name HD12) 2.188 0.599 0.599 weight 1.000 ! spec=2D_NOESY, no=1794, id=1714, vol=8.620000e+07
    or (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   31 and name  HE2) (segid "   A" and resid   31 and name  HD2) 1.737 0.377 0.377 weight 1.000 ! spec=2D_NOESY, no=1800, id=1720, vol=1.600000e+08
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   40 and name HD12) 1.655 0.342 0.342 weight 1.000 ! spec=2D_NOESY, no=1804, id=1724, vol=2.400000e+08
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   32 and name HG22) 3.187 1.270 1.270 weight 1.000 ! spec=2D_NOESY, no=1807, id=1727, vol=1.010000e+07
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name   HB) 4.080 2.081 2.081 weight 1.000 ! spec=2D_NOESY, no=1812, id=1732, vol=2.060000e+06
assign (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   48 and name HD12) 2.317 0.671 0.671 weight 1.000 ! spec=2D_NOESY, no=1817, id=1737, vol=6.100000e+07
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   48 and name HD13)
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   37 and name HG22) 2.151 0.579 0.579 weight 1.000 ! spec=2D_NOESY, no=1832, id=1752, vol=3.920000e+07
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   10 and name HG22) 2.066 0.534 0.534 weight 1.000 ! spec=2D_NOESY, no=1835, id=1755, vol=1.390000e+08
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   10 and name HG23)
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid    8 and name HG22) 4.067 2.068 2.068 weight 1.000 ! spec=2D_NOESY, no=1848, id=1768, vol=9.490000e+05
    or (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid    8 and name HG23)
assign (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   48 and name HD22) 2.648 0.877 0.877 weight 1.000 ! spec=2D_NOESY, no=1855, id=1775, vol=1.640000e+07
    or (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   48 and name  HB1) 2.913 1.060 1.060 weight 1.000 ! spec=2D_NOESY, no=1856, id=1776, vol=1.720000e+07
assign (segid "   A" and resid   80 and name  HG2) (segid "   A" and resid   80 and name  HB1) 2.174 0.591 0.591 weight 1.000 ! spec=2D_NOESY, no=1864, id=1784, vol=7.710000e+07
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD12) 1.394 0.243 0.243 weight 1.000 ! spec=2D_NOESY, no=1877, id=1797, vol=7.520000e+08
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG22) 2.066 0.533 0.533 weight 1.000 ! spec=2D_NOESY, no=1883, id=1803, vol=6.770000e+07
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   60 and name  HB2) (segid "   A" and resid   60 and name  HG2) 2.541 0.807 0.807 weight 1.000 ! spec=2D_NOESY, no=1886, id=1806, vol=3.600000e+07
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name  HB1) 1.718 0.369 0.369 weight 1.000 ! spec=2D_NOESY, no=1888, id=1808, vol=8.770000e+07
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD22) 2.945 1.084 1.084 weight 1.000 ! spec=2D_NOESY, no=1890, id=1810, vol=1.780000e+07
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG11) 2.869 1.029 1.029 weight 1.000 ! spec=2D_NOESY, no=1902, id=1822, vol=9.880000e+06
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HD12) 2.507 0.786 0.786 weight 1.000 ! spec=2D_NOESY, no=1905, id=1825, vol=5.330000e+07
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   53 and name   HG) 2.753 0.948 0.948 weight 1.000 ! spec=2D_NOESY, no=1919, id=1839, vol=1.430000e+07
assign (segid "   A" and resid    7 and name  HG2) (segid "   A" and resid    7 and name  HB1) 3.516 1.546 1.546 weight 1.000 ! spec=2D_NOESY, no=1925, id=1845, vol=4.190000e+06
assign (segid "   A" and resid   78 and name  HB1) (segid "   A" and resid   79 and name  HB2) 4.795 2.875 2.875 weight 1.000 ! spec=2D_NOESY, no=1930, id=1850, vol=3.520000e+06
assign (segid "   A" and resid   88 and name  HB2) (segid "   A" and resid   88 and name  HB1) 1.611 0.325 0.325 weight 1.000 ! spec=2D_NOESY, no=1935, id=1855, vol=2.220000e+08
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   34 and name  HB2) 3.833 1.837 1.837 weight 1.000 ! spec=2D_NOESY, no=1936, id=1856, vol=3.910000e+06
assign (segid "   A" and resid   29 and name  HG2) (segid "   A" and resid   27 and name  HB2) 1.227 0.188 0.188 weight 1.000 ! spec=2D_NOESY, no=1937, id=1857, vol=3.870000e+08
assign (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid   79 and name  HG2) 1.869 0.436 0.436 weight 1.000 ! spec=2D_NOESY, no=1940, id=1860, vol=6.610000e+07
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   16 and name  HB2) 2.422 0.733 0.733 weight 1.000 ! spec=2D_NOESY, no=1946, id=1866, vol=7.390000e+07
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name  HB1) 1.527 0.291 0.291 weight 1.000 ! spec=2D_NOESY, no=1952, id=1872, vol=1.750000e+08
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name  HB1) 1.696 0.360 0.360 weight 1.000 ! spec=2D_NOESY, no=1954, id=1874, vol=1.270000e+08
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   38 and name  HB1) 1.569 0.308 0.308 weight 1.000 ! spec=2D_NOESY, no=1955, id=1875, vol=1.980000e+08
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HE1) 1.425 0.254 0.254 weight 1.000 ! spec=2D_NOESY, no=1957, id=1877, vol=1.630000e+08
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HG1) 1.757 0.386 0.386 weight 1.000 ! spec=2D_NOESY, no=1958, id=1878, vol=7.610000e+07
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   78 and name  HB1) 4.233 2.240 2.240 weight 1.000 ! spec=2D_NOESY, no=1962, id=1882, vol=5.740000e+06
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   78 and name  HB1) 1.671 0.349 0.349 weight 1.000 ! spec=2D_NOESY, no=1963, id=1883, vol=9.720000e+07
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   39 and name  HG2) 3.997 1.997 1.997 weight 1.000 ! spec=2D_NOESY, no=1965, id=1885, vol=4.510000e+06
assign (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid  102 and name  HB1) 4.261 2.269 2.269 weight 1.000 ! spec=2D_NOESY, no=1967, id=1887, vol=6.030000e+06
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name   HA) 1.751 0.383 0.383 weight 1.000 ! spec=2D_NOESY, no=1969, id=1889, vol=1.700000e+08
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   66 and name  HB1) 1.764 0.389 0.389 weight 1.000 ! spec=2D_NOESY, no=1973, id=1893, vol=6.350000e+07
assign (segid "   A" and resid   46 and name  HD2) (segid "   A" and resid   45 and name  HB2) 3.533 1.560 1.560 weight 1.000 ! spec=2D_NOESY, no=1975, id=1895, vol=1.630000e+07
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   91 and name  HB2) 1.776 0.394 0.394 weight 1.000 ! spec=2D_NOESY, no=1978, id=1898, vol=1.580000e+08
assign (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   25 and name  HB1) 4.137 2.140 2.140 weight 1.000 ! spec=2D_NOESY, no=1984, id=1904, vol=2.590000e+06
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   14 and name  HB1) 1.688 0.356 0.356 weight 1.000 ! spec=2D_NOESY, no=1985, id=1905, vol=6.640000e+07
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   84 and name  HB2) 4.025 2.025 2.025 weight 1.000 ! spec=2D_NOESY, no=1999, id=1919, vol=4.630000e+06
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   36 and name  HE2) 3.607 1.626 1.626 weight 1.000 ! spec=2D_NOESY, no=2000, id=1920, vol=4.810000e+06
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   71 and name  HB1) 3.844 1.847 1.847 weight 1.000 ! spec=2D_NOESY, no=2009, id=1929, vol=6.050000e+06
assign (segid "   A" and resid   80 and name  HG2) (segid "   A" and resid   78 and name  HB1) 4.808 2.890 2.890 weight 1.000 ! spec=2D_NOESY, no=2012, id=1932, vol=3.660000e+06
assign (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   46 and name  HG2) 1.866 0.435 0.435 weight 1.000 ! spec=2D_NOESY, no=2013, id=1933, vol=1.030000e+08
assign (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name  HB2) 1.850 0.428 0.428 weight 1.000 ! spec=2D_NOESY, no=2017, id=1937, vol=2.000000e+08
assign (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   46 and name  HB1) 3.603 1.623 1.623 weight 1.000 ! spec=2D_NOESY, no=2021, id=1941, vol=6.590000e+06
assign (segid "   A" and resid   56 and name  HD2) (segid "   A" and resid   56 and name  HE2) 3.180 1.264 1.264 weight 1.000 ! spec=2D_NOESY, no=2029, id=1949, vol=7.030000e+06
assign (segid "   A" and resid   83 and name  HD2) (segid "   A" and resid   83 and name  HG2) 1.541 0.297 0.297 weight 1.000 ! spec=2D_NOESY, no=2038, id=1958, vol=2.610000e+08
assign (segid "   A" and resid   57 and name  HE2) (segid "   A" and resid   57 and name  HB1) 2.217 0.615 0.615 weight 1.000 ! spec=2D_NOESY, no=2042, id=1962, vol=3.650000e+07
assign (segid "   A" and resid   60 and name  HD2) (segid "   A" and resid   60 and name  HG2) 2.611 0.852 0.852 weight 1.000 ! spec=2D_NOESY, no=2048, id=1968, vol=1.860000e+07
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   40 and name   HG) 3.481 1.515 1.515 weight 1.000 ! spec=2D_NOESY, no=2067, id=1987, vol=5.260000e+06
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   89 and name  HB1) 3.482 1.516 1.516 weight 1.000 ! spec=2D_NOESY, no=2076, id=1996, vol=4.130000e+06
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   89 and name  HB1)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   89 and name  HB1)
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HB2) 2.283 0.652 0.652 weight 1.000 ! spec=2D_NOESY, no=2079, id=1999, vol=4.400000e+07
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   21 and name  HB3)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name HG11) 3.061 1.172 1.172 weight 1.000 ! spec=2D_NOESY, no=2099, id=2019, vol=9.460000e+06
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name HG12) 2.154 0.580 0.580 weight 1.000 ! spec=2D_NOESY, no=2114, id=2034, vol=6.470000e+07
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   32 and name HG22) 3.895 1.896 1.896 weight 1.000 ! spec=2D_NOESY, no=2120, id=2040, vol=4.170000e+06
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   32 and name HG22) 2.985 1.114 1.114 weight 1.000 ! spec=2D_NOESY, no=2121, id=2041, vol=8.980000e+06
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   22 and name  HB2) 4.287 2.298 2.298 weight 1.000 ! spec=2D_NOESY, no=2122, id=2042, vol=1.400000e+06
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   22 and name  HB2)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   22 and name  HB2)
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   78 and name  HB1) 4.201 2.206 2.206 weight 1.000 ! spec=2D_NOESY, no=2123, id=2043, vol=3.220000e+06
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   78 and name  HB1)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   78 and name  HB1)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   71 and name  HB1) 3.972 1.972 1.972 weight 1.000 ! spec=2D_NOESY, no=2125, id=2045, vol=3.870000e+06
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   71 and name  HB1)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   71 and name  HB1)
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name HG22) 2.534 0.802 0.802 weight 1.000 ! spec=2D_NOESY, no=2128, id=2048, vol=2.540000e+07
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   75 and name HG23)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   78 and name  HB1) 4.436 2.460 2.460 weight 1.000 ! spec=2D_NOESY, no=2130, id=2050, vol=4.570000e+06
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   78 and name  HB1)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   78 and name  HB1)
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   46 and name  HD2) 2.680 0.898 0.898 weight 1.000 ! spec=2D_NOESY, no=2134, id=2052, vol=1.120000e+08
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   71 and name  HB2) 2.068 0.534 0.534 weight 1.000 ! spec=2D_NOESY, no=2137, id=2054, vol=1.750000e+08
assign (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   45 and name  HB1) 3.117 1.214 1.214 weight 1.000 ! spec=2D_NOESY, no=2139, id=2056, vol=6.790000e+06
assign (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   75 and name   HA) 2.130 0.567 0.567 weight 1.000 ! spec=2D_NOESY, no=2143, id=2059, vol=7.830000e+07
assign (segid "   A" and resid   64 and name  HB2) (segid "   A" and resid   64 and name  HB1) 1.476 0.272 0.272 weight 1.000 ! spec=2D_NOESY, no=2148, id=2064, vol=2.580000e+08
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   57 and name  HE2) 3.282 1.346 1.346 weight 1.000 ! spec=2D_NOESY, no=2150, id=2065, vol=1.150000e+07
assign (segid "   A" and resid  110 and name  HE2) (segid "   A" and resid  112 and name  HB2) 2.808 0.986 0.986 weight 1.000 ! spec=2D_NOESY, no=2152, id=2067, vol=1.790000e+07
assign (segid "   A" and resid   39 and name  HG2) (segid "   A" and resid   84 and name  HB2) 3.945 1.946 1.946 weight 1.000 ! spec=2D_NOESY, no=2153, id=2068, vol=6.050000e+06
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   82 and name   HB) 2.937 1.078 1.078 weight 1.000 ! spec=2D_NOESY, no=2160, id=2075, vol=1.050000e+07
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   56 and name  HB1) 1.596 0.318 0.318 weight 1.000 ! spec=2D_NOESY, no=2161, id=2076, vol=1.240000e+08
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   57 and name  HD2) 2.455 0.754 0.754 weight 1.000 ! spec=2D_NOESY, no=2164, id=2079, vol=2.140000e+07
assign (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   82 and name   HB) 3.112 1.211 1.211 weight 1.000 ! spec=2D_NOESY, no=2165, id=2080, vol=3.930000e+06
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name HG12) 2.202 0.606 0.606 weight 1.000 ! spec=2D_NOESY, no=2167, id=2082, vol=4.250000e+07
assign (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid  103 and name  HB2) 2.064 0.532 0.532 weight 1.000 ! spec=2D_NOESY, no=2172, id=2087, vol=1.720000e+08
    or (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   57 and name  HG2) 3.550 1.575 1.575 weight 1.000 ! spec=2D_NOESY, no=2174, id=2089, vol=1.340000e+07
assign (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name   HG) 3.189 1.271 1.271 weight 1.000 ! spec=2D_NOESY, no=2182, id=2097, vol=7.180000e+06
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   36 and name  HG1) 5.247 3.441 3.441 weight 1.000 ! spec=2D_NOESY, no=2184, id=2099, vol=8.580000e+05
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   36 and name  HG1)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   36 and name  HG1)
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name HG22) 2.169 0.588 0.588 weight 1.000 ! spec=2D_NOESY, no=2191, id=2106, vol=6.020000e+07
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   18 and name HG11) 1.888 0.446 0.446 weight 1.000 ! spec=2D_NOESY, no=2196, id=2111, vol=3.660000e+07
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   18 and name HD12) 3.708 1.719 1.719 weight 1.000 ! spec=2D_NOESY, no=2198, id=2113, vol=4.730000e+06
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   18 and name HD12) 2.900 1.052 1.052 weight 1.000 ! spec=2D_NOESY, no=2199, id=2114, vol=8.620000e+06
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   48 and name HD12) 2.294 0.658 0.658 weight 1.000 ! spec=2D_NOESY, no=2201, id=2116, vol=3.520000e+07
    or (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   48 and name HD13)
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD12) 2.703 0.913 0.913 weight 1.000 ! spec=2D_NOESY, no=2202, id=2117, vol=1.830000e+07
    or (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD13)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   36 and name  HB2) 3.335 1.390 1.390 weight 1.000 ! spec=2D_NOESY, no=2206, id=2121, vol=4.000000e+06
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   36 and name  HB2)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   36 and name  HB2)
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG22) 2.179 0.594 0.594 weight 1.000 ! spec=2D_NOESY, no=2211, id=2126, vol=4.280000e+07
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG21)
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG23)
assign (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   94 and name  HB2) 2.220 0.616 0.616 weight 1.000 ! spec=2D_NOESY, no=2216, id=2131, vol=2.650000e+07
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   36 and name  HB1) 2.687 0.902 0.902 weight 1.000 ! spec=2D_NOESY, no=2218, id=2133, vol=1.220000e+07
assign (segid "   A" and resid   27 and name  HB2) (segid "   A" and resid   29 and name  HB2) 2.569 0.825 0.825 weight 1.000 ! spec=2D_NOESY, no=2223, id=2138, vol=3.300000e+07
assign (segid "   A" and resid   36 and name  HG1) (segid "   A" and resid   25 and name  HB1) 1.525 0.291 0.291 weight 1.000 ! spec=2D_NOESY, no=2226, id=2141, vol=1.860000e+08
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   54 and name  HB1) 1.378 0.237 0.237 weight 1.000 ! spec=2D_NOESY, no=2231, id=2146, vol=4.770000e+08
assign (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   48 and name  HB1) 1.914 0.458 0.458 weight 1.000 ! spec=2D_NOESY, no=2234, id=2149, vol=1.110000e+08
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name  HB1) 1.559 0.304 0.304 weight 1.000 ! spec=2D_NOESY, no=2235, id=2150, vol=2.060000e+08
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   57 and name  HB2) 2.052 0.526 0.526 weight 1.000 ! spec=2D_NOESY, no=2238, id=2153, vol=8.130000e+07
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   32 and name HG12) 2.370 0.702 0.702 weight 1.000 ! spec=2D_NOESY, no=2243, id=2158, vol=3.000000e+07
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name  HB1) 1.675 0.351 0.351 weight 1.000 ! spec=2D_NOESY, no=2246, id=2161, vol=1.410000e+08
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name  HG2) 1.855 0.430 0.430 weight 1.000 ! spec=2D_NOESY, no=2247, id=2162, vol=8.610000e+07
assign (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   57 and name  HG2) 1.442 0.260 0.260 weight 1.000 ! spec=2D_NOESY, no=2248, id=2163, vol=3.130000e+08
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG11) 1.426 0.254 0.254 weight 1.000 ! spec=2D_NOESY, no=2250, id=2165, vol=2.930000e+08
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   82 and name HG22) 1.539 0.296 0.296 weight 1.000 ! spec=2D_NOESY, no=2256, id=2171, vol=3.180000e+08
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   82 and name HG23)
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   53 and name HD12) 2.874 1.032 1.032 weight 1.000 ! spec=2D_NOESY, no=2260, id=2175, vol=1.950000e+07
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG12) 2.066 0.534 0.534 weight 1.000 ! spec=2D_NOESY, no=2263, id=2178, vol=3.120000e+07
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   18 and name HG11) 2.882 1.038 1.038 weight 1.000 ! spec=2D_NOESY, no=2264, id=2179, vol=1.030000e+07
assign (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   53 and name HD22) 2.037 0.519 0.519 weight 1.000 ! spec=2D_NOESY, no=2268, id=2183, vol=8.050000e+07
    or (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   10 and name HG11) (segid "   A" and resid   10 and name HG12) 1.638 0.335 0.335 weight 1.000 ! spec=2D_NOESY, no=2277, id=2192, vol=1.130000e+08
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name  HB1) 2.826 0.998 0.998 weight 1.000 ! spec=2D_NOESY, no=2286, id=2201, vol=1.880000e+07
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name  HB1)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name  HB1)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   37 and name HD12) 3.639 1.656 1.656 weight 1.000 ! spec=2D_NOESY, no=2287, id=2202, vol=3.560000e+06
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name HD22) 1.709 0.365 0.365 weight 1.000 ! spec=2D_NOESY, no=2288, id=2203, vol=2.660000e+08
    or (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name HD21)
    or (segid "   A" and resid   74 and name  HB2) (segid "   A" and resid   74 and name HD23)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   75 and name   HB) 2.158 0.582 0.582 weight 1.000 ! spec=2D_NOESY, no=2289, id=2204, vol=4.230000e+07
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   75 and name   HB)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   75 and name   HB)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   36 and name  HB2) 3.294 1.356 1.356 weight 1.000 ! spec=2D_NOESY, no=2291, id=2206, vol=1.920000e+07
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   40 and name   HG) 3.979 1.979 1.979 weight 1.000 ! spec=2D_NOESY, no=2292, id=2207, vol=2.650000e+06
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   40 and name   HG)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   40 and name   HG)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   32 and name HG12) 1.516 0.287 0.287 weight 1.000 ! spec=2D_NOESY, no=2297, id=2212, vol=2.590000e+08
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   40 and name   HG) 4.583 2.625 2.625 weight 1.000 ! spec=2D_NOESY, no=2300, id=2215, vol=1.250000e+06
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   40 and name   HG)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   40 and name   HG)
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   41 and name HG11) 3.077 1.183 1.183 weight 1.000 ! spec=2D_NOESY, no=2302, id=2217, vol=9.650000e+06
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   41 and name HG11)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   41 and name HG11)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   40 and name  HB1) 3.254 1.324 1.324 weight 1.000 ! spec=2D_NOESY, no=2303, id=2218, vol=7.540000e+06
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   40 and name  HB1)
assign (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   32 and name HG12) 3.917 1.918 1.918 weight 1.000 ! spec=2D_NOESY, no=2307, id=2222, vol=5.150000e+06
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   40 and name   HG) 2.288 0.654 0.654 weight 1.000 ! spec=2D_NOESY, no=2310, id=2225, vol=3.180000e+07
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   40 and name   HG)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   40 and name   HG)
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   41 and name HG11) 2.595 0.842 0.842 weight 1.000 ! spec=2D_NOESY, no=2311, id=2226, vol=1.750000e+07
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   41 and name HG11)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   41 and name HG11)
assign (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   37 and name HG22) 2.358 0.695 0.695 weight 1.000 ! spec=2D_NOESY, no=2314, id=2229, vol=1.600000e+07
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   37 and name HG11) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   37 and name HG12) 3.520 1.548 1.548 weight 1.000 ! spec=2D_NOESY, no=2318, id=2233, vol=7.380000e+06
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   37 and name HG12)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   37 and name HG12)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   41 and name HG11) 1.827 0.417 0.417 weight 1.000 ! spec=2D_NOESY, no=2322, id=2237, vol=1.320000e+08
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   41 and name HG11)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   41 and name HG11)
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   53 and name HD12) 1.961 0.481 0.481 weight 1.000 ! spec=2D_NOESY, no=2325, id=2240, vol=8.830000e+07
    or (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   10 and name HG22) 3.521 1.549 1.549 weight 1.000 ! spec=2D_NOESY, no=2326, id=2241, vol=5.620000e+06
    or (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   10 and name HG23)
assign (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   68 and name  HB2) 2.553 0.815 0.815 weight 1.000 ! spec=2D_NOESY, no=2327, id=2242, vol=2.120000e+07
assign (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   10 and name HG11) 1.852 0.429 0.429 weight 1.000 ! spec=2D_NOESY, no=2332, id=2247, vol=1.160000e+08
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   10 and name HG11)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   10 and name HG11)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG21) 2.348 0.689 0.689 weight 1.000 ! spec=2D_NOESY, no=2337, id=2252, vol=8.610000e+07
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   33 and name HG21) 3.152 1.242 1.242 weight 1.000 ! spec=2D_NOESY, no=2339, id=2254, vol=1.360000e+07
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   33 and name HG21)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   33 and name HG21)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   33 and name HG23)
assign (segid "   A" and resid  101 and name HD12) (segid "   A" and resid  101 and name HG11) 1.448 0.262 0.262 weight 1.000 ! spec=2D_NOESY, no=2341, id=2256, vol=4.030000e+08
    or (segid "   A" and resid  101 and name HD11) (segid "   A" and resid  101 and name HG11)
    or (segid "   A" and resid  101 and name HD13) (segid "   A" and resid  101 and name HG11)
assign (segid "   A" and resid   53 and name HD12) (segid "   A" and resid   53 and name   HG) 1.796 0.403 0.403 weight 1.000 ! spec=2D_NOESY, no=2342, id=2257, vol=1.550000e+08
    or (segid "   A" and resid   53 and name HD11) (segid "   A" and resid   53 and name   HG)
    or (segid "   A" and resid   53 and name HD13) (segid "   A" and resid   53 and name   HG)
assign (segid "   A" and resid  104 and name HD22) (segid "   A" and resid  103 and name  HB2) 1.953 0.477 0.477 weight 1.000 ! spec=2D_NOESY, no=2343, id=2258, vol=1.010000e+08
    or (segid "   A" and resid  104 and name HD22) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  104 and name HD22) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid  104 and name HD21) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid  104 and name HD21) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  104 and name HD21) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid  104 and name HD23) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid  104 and name HD23) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  104 and name HD23) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   15 and name HG21) 2.400 0.720 0.720 weight 1.000 ! spec=2D_NOESY, no=2346, id=2261, vol=3.460000e+07
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   68 and name  HB2) 1.772 0.392 0.392 weight 1.000 ! spec=2D_NOESY, no=2347, id=2262, vol=1.980000e+08
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   68 and name  HB2)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   68 and name  HB2)
assign (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   40 and name   HG) 1.712 0.367 0.367 weight 1.000 ! spec=2D_NOESY, no=2349, id=2264, vol=2.320000e+08
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   40 and name   HG)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   40 and name   HG)
assign (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   10 and name HG11) 1.795 0.403 0.403 weight 1.000 ! spec=2D_NOESY, no=2350, id=2265, vol=2.700000e+08
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   10 and name HG11)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   10 and name HG11)
assign (segid "   A" and resid   40 and name HD22) (segid "   A" and resid   40 and name  HB1) 2.525 0.797 0.797 weight 1.000 ! spec=2D_NOESY, no=2384, id=2299, vol=1.480000e+07
    or (segid "   A" and resid   40 and name HD21) (segid "   A" and resid   40 and name  HB1)
    or (segid "   A" and resid   40 and name HD23) (segid "   A" and resid   40 and name  HB1)
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   21 and name  HB2) 1.579 0.312 0.312 weight 1.000 ! spec=2D_NOESY, no=2386, id=2301, vol=2.060000e+08
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   21 and name  HB3)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   21 and name  HB3)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   21 and name  HB3)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   32 and name HG12) 2.055 0.528 0.528 weight 1.000 ! spec=2D_NOESY, no=2389, id=2304, vol=5.120000e+07
    or (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   40 and name HD12) 2.149 0.577 0.577 weight 1.000 ! spec=2D_NOESY, no=2394, id=2309, vol=3.070000e+07
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   75 and name HG22) 3.223 1.299 1.299 weight 1.000 ! spec=2D_NOESY, no=2403, id=2318, vol=2.850000e+06
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   75 and name HG23)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   75 and name HG22)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   75 and name HG23)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   75 and name HG22)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   75 and name HG23)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   75 and name HG12) 1.476 0.272 0.272 weight 1.000 ! spec=2D_NOESY, no=2407, id=2322, vol=3.370000e+08
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   75 and name HG13)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   75 and name HG12)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   75 and name HG13)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   75 and name HG12)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   37 and name HG11) 3.491 1.523 1.523 weight 1.000 ! spec=2D_NOESY, no=2410, id=2325, vol=1.640000e+07
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   37 and name HG11)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   37 and name HG11) 1.642 0.337 0.337 weight 1.000 ! spec=2D_NOESY, no=2413, id=2328, vol=1.940000e+08
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   37 and name HG11)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   37 and name HG11)
assign (segid "   A" and resid   31 and name  HE2) (segid "   A" and resid   65 and name  HA2) 2.280 0.650 0.650 weight 1.000 ! spec=2D_NOESY, no=2416, id=2331, vol=4.630000e+07
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name  HB2) 1.630 0.332 0.332 weight 1.000 ! spec=2D_NOESY, no=2424, id=2338, vol=2.220000e+08
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   72 and name  HB1) 1.927 0.464 0.464 weight 1.000 ! spec=2D_NOESY, no=2432, id=2346, vol=1.270000e+08
assign (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   43 and name  HA1) 1.721 0.370 0.370 weight 1.000 ! spec=2D_NOESY, no=2434, id=2348, vol=1.490000e+08
assign (segid "   A" and resid   71 and name  HB2) (segid "   A" and resid   68 and name   HA) 2.726 0.929 0.929 weight 1.000 ! spec=2D_NOESY, no=2436, id=2349, vol=4.440000e+07
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   17 and name  HD2) 3.038 1.154 1.154 weight 1.000 ! spec=2D_NOESY, no=2438, id=2351, vol=3.510000e+07
assign (segid "   A" and resid   17 and name  HD1) (segid "   A" and resid   17 and name  HD2) 1.976 0.488 0.488 weight 1.000 ! spec=2D_NOESY, no=2439, id=2352, vol=2.530000e+07
assign (segid "   A" and resid  112 and name   HA) (segid "   A" and resid  112 and name  HB1) 3.047 1.160 1.160 weight 1.000 ! spec=2D_NOESY, no=2463, id=2376, vol=1.230000e+07
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   72 and name  HE1) 4.312 2.324 2.324 weight 1.000 ! spec=2D_NOESY, no=2465, id=2378, vol=4.670000e+06
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   36 and name  HB1) 3.083 1.188 1.188 weight 1.000 ! spec=2D_NOESY, no=2466, id=2379, vol=8.120000e+06
assign (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   71 and name   HZ) 2.501 0.782 0.782 weight 1.000 ! spec=2D_NOESY, no=2471, id=2384, vol=2.360000e+07
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   71 and name   HZ)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   71 and name   HZ)
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   32 and name HG12) 2.260 0.639 0.639 weight 1.000 ! spec=2D_NOESY, no=2472, id=2385, vol=3.590000e+07
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   38 and name   HN) (segid "   A" and resid   37 and name   HB) 2.397 0.718 0.718 weight 1.000 ! spec=2D_NOESY, no=2473, id=2386, vol=5.560000e+07
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name HG12) 3.189 1.271 1.271 weight 1.000 ! spec=2D_NOESY, no=2474, id=2387, vol=1.890000e+07
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   57 and name   HN) 2.756 0.950 0.950 weight 1.000 ! spec=2D_NOESY, no=2480, id=2393, vol=2.350000e+07
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name  HB2) 3.209 1.287 1.287 weight 1.000 ! spec=2D_NOESY, no=2483, id=2396, vol=8.500000e+06
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   32 and name   HN) 2.314 0.669 0.669 weight 1.000 ! spec=2D_NOESY, no=2485, id=2398, vol=3.980000e+07
assign (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   37 and name HD12) 2.407 0.724 0.724 weight 1.000 ! spec=2D_NOESY, no=2490, id=2403, vol=4.380000e+07
    or (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   32 and name HG22) (segid "   A" and resid   37 and name HD13)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   37 and name HD12)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   32 and name HG21) (segid "   A" and resid   37 and name HD13)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   37 and name HD12)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   32 and name HG23) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   75 and name HG22) 3.603 1.623 1.623 weight 1.000 ! spec=2D_NOESY, no=2491, id=2404, vol=2.520000e+06
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   75 and name HG23)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   75 and name HG22)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   75 and name HG23)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   75 and name HG22)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   75 and name HG23)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   37 and name HG12) 2.414 0.729 0.729 weight 1.000 ! spec=2D_NOESY, no=2492, id=2405, vol=2.050000e+07
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   37 and name HG12)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   37 and name HG12)
assign (segid "   A" and resid   50 and name  HE1) (segid "   A" and resid   50 and name  HZ2) 2.884 1.039 1.039 weight 1.000 ! spec=2D_NOESY, no=2494, id=2407, vol=1.450000e+07
# Restraints file 3: ambig.tbl
assign (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   95 and name  HB2) 1.481 0.274 0.274 weight 1.000 ! spec=13C_NOESY, no=3, id=2413, vol=2.430000e+09
    or (segid "   A" and resid  100 and name  HG2) (segid "   A" and resid  100 and name  HB2)
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name  HB1) 1.391 0.242 0.242 weight 1.000 ! spec=13C_NOESY, no=9, id=2419, vol=1.870000e+09
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name  HB1)
assign (segid "   A" and resid   94 and name  HG2) (segid "   A" and resid   94 and name  HB1) 1.803 0.406 0.406 weight 1.000 ! spec=13C_NOESY, no=11, id=2421, vol=1.110000e+09
    or (segid "   A" and resid  109 and name  HB2) (segid "   A" and resid  109 and name  HG2)
assign (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   10 and name HG22) 1.766 0.390 0.390 weight 1.000 ! spec=13C_NOESY, no=24, id=2433, vol=6.910000e+08
    or (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   10 and name HG22)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid   90 and name  HB2) (segid "   A" and resid   90 and name  HG2) 1.915 0.459 0.459 weight 1.000 ! spec=13C_NOESY, no=28, id=2437, vol=6.480000e+08
    or (segid "   A" and resid   99 and name  HB2) (segid "   A" and resid   99 and name  HG2)
assign (segid "   A" and resid   47 and name  HA1) (segid "   A" and resid   47 and name  HA2) 1.898 0.450 0.450 weight 1.000 ! spec=13C_NOESY, no=46, id=2453, vol=4.200000e+08
    or (segid "   A" and resid   59 and name  HA1) (segid "   A" and resid   59 and name  HA2)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   82 and name HG22) 2.043 0.522 0.522 weight 1.000 ! spec=13C_NOESY, no=54, id=2460, vol=3.670000e+08
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   82 and name HG23)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   82 and name HG22)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   82 and name HG23)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   82 and name HG22)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   82 and name HG23)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   82 and name HG13)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   82 and name HG13)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   90 and name  HD2) (segid "   A" and resid   90 and name  HG2) 2.062 0.531 0.531 weight 1.000 ! spec=13C_NOESY, no=62, id=2468, vol=3.310000e+08
    or (segid "   A" and resid   93 and name  HD2) (segid "   A" and resid   93 and name  HG2)
assign (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   82 and name HG22) 2.130 0.567 0.567 weight 1.000 ! spec=13C_NOESY, no=135, id=2539, vol=2.050000e+08
    or (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   82 and name HG23)
    or (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HG2) 2.499 0.781 0.781 weight 1.000 ! spec=13C_NOESY, no=163, id=2566, vol=1.750000e+08
    or (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HG2)
    or (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  105 and name  HG2)
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   61 and name  HB2) 2.726 0.929 0.929 weight 1.000 ! spec=13C_NOESY, no=169, id=2571, vol=1.700000e+08
    or (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   61 and name  HB3)
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   61 and name  HB3)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   61 and name  HB3)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid  101 and name HG22) (segid "   A" and resid  100 and name  HG2) 2.888 1.042 1.042 weight 1.000 ! spec=13C_NOESY, no=177, id=2579, vol=1.640000e+08
    or (segid "   A" and resid  101 and name HG21) (segid "   A" and resid  100 and name  HG2)
    or (segid "   A" and resid  101 and name HG23) (segid "   A" and resid  100 and name  HG2)
    or (segid "   A" and resid  101 and name HD12) (segid "   A" and resid  100 and name  HG2)
    or (segid "   A" and resid  101 and name HD11) (segid "   A" and resid  100 and name  HG2)
    or (segid "   A" and resid  101 and name HD13) (segid "   A" and resid  100 and name  HG2)
assign (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   40 and name   HG) 2.869 1.029 1.029 weight 1.000 ! spec=13C_NOESY, no=202, id=2603, vol=1.470000e+08
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   40 and name   HG)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   40 and name   HG)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   53 and name  HB1)
assign (segid "   A" and resid   54 and name  HG2) (segid "   A" and resid   54 and name   HN) 2.558 0.818 0.818 weight 1.000 ! spec=13C_NOESY, no=238, id=2639, vol=1.290000e+08
    or (segid "   A" and resid   54 and name  HG2) (segid "   A" and resid   55 and name   HN)
assign (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   61 and name  HB2) 3.041 1.156 1.156 weight 1.000 ! spec=13C_NOESY, no=248, id=2649, vol=1.260000e+08
    or (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   61 and name  HB3)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name  HB3)
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   83 and name   HN) 2.528 0.799 0.799 weight 1.000 ! spec=13C_NOESY, no=275, id=2676, vol=1.120000e+08
    or (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   95 and name   HN)
assign (segid "   A" and resid  104 and name HD22) (segid "   A" and resid  104 and name   HG) 2.472 0.764 0.764 weight 1.000 ! spec=13C_NOESY, no=283, id=2683, vol=1.110000e+08
    or (segid "   A" and resid  104 and name HD21) (segid "   A" and resid  104 and name   HG)
    or (segid "   A" and resid  104 and name HD23) (segid "   A" and resid  104 and name   HG)
    or (segid "   A" and resid  106 and name HD22) (segid "   A" and resid  106 and name   HG)
    or (segid "   A" and resid  106 and name HD21) (segid "   A" and resid  106 and name   HG)
    or (segid "   A" and resid  106 and name HD23) (segid "   A" and resid  106 and name   HG)
assign (segid "   A" and resid   11 and name  HB2) (segid "   A" and resid   11 and name  HB1) 2.282 0.651 0.651 weight 1.000 ! spec=13C_NOESY, no=292, id=2691, vol=1.070000e+08
    or (segid "   A" and resid   49 and name  HB2) (segid "   A" and resid   49 and name  HB1)
assign (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   45 and name  HE1) 3.815 1.819 1.819 weight 1.000 ! spec=13C_NOESY, no=311, id=2710, vol=1.030000e+08
    or (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name HE22)
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   97 and name  HG2) 2.447 0.748 0.748 weight 1.000 ! spec=13C_NOESY, no=313, id=2712, vol=1.030000e+08
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG11)
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   21 and name   HN) 2.932 1.075 1.075 weight 1.000 ! spec=13C_NOESY, no=387, id=2785, vol=8.130000e+07
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   22 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   22 and name   HN)
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   46 and name  HG2) 3.288 1.352 1.352 weight 1.000 ! spec=13C_NOESY, no=409, id=2807, vol=7.820000e+07
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name  HG2)
assign (segid "   A" and resid  104 and name HD12) (segid "   A" and resid   15 and name HG21) 2.762 0.954 0.954 weight 1.000 ! spec=13C_NOESY, no=410, id=2808, vol=7.810000e+07
    or (segid "   A" and resid  104 and name HD12) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid  104 and name HD12) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid  104 and name HD11) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid  104 and name HD13) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   37 and name HG22) 3.268 1.335 1.335 weight 1.000 ! spec=13C_NOESY, no=424, id=2821, vol=7.620000e+07
    or (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   37 and name HG23)
    or (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   48 and name HD22)
    or (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   18 and name HG22) 3.162 1.249 1.249 weight 1.000 ! spec=13C_NOESY, no=454, id=2848, vol=7.230000e+07
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   18 and name HG23)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   26 and name  HB2)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   26 and name  HB3)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name  HB2) 2.858 1.021 1.021 weight 1.000 ! spec=13C_NOESY, no=457, id=2851, vol=7.190000e+07
    or (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HB2)
assign (segid "   A" and resid  101 and name HG11) (segid "   A" and resid  100 and name  HG2) 3.162 1.250 1.250 weight 1.000 ! spec=13C_NOESY, no=466, id=2860, vol=7.030000e+07
    or (segid "   A" and resid   56 and name  HG2) (segid "   A" and resid   55 and name  HG2)
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   57 and name  HG1) 2.985 1.114 1.114 weight 1.000 ! spec=13C_NOESY, no=503, id=2897, vol=6.570000e+07
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   57 and name  HG1)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   57 and name  HG1)
    or (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   57 and name  HG1)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   57 and name  HG1)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   57 and name  HG1)
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB1) 2.770 0.959 0.959 weight 1.000 ! spec=13C_NOESY, no=506, id=2900, vol=6.540000e+07
    or (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   58 and name  HB2)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name   HN) 2.948 1.086 1.086 weight 1.000 ! spec=13C_NOESY, no=540, id=2934, vol=6.180000e+07
    or (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name  HB2) 2.813 0.989 0.989 weight 1.000 ! spec=13C_NOESY, no=561, id=2954, vol=5.970000e+07
    or (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  105 and name  HB2)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   44 and name  HB2) 3.611 1.630 1.630 weight 1.000 ! spec=13C_NOESY, no=589, id=2981, vol=5.720000e+07
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   44 and name  HB1)
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   44 and name  HB3)
    or (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   44 and name  HB2)
    or (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   44 and name  HB1)
    or (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   44 and name  HB3)
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   37 and name HG22) 3.423 1.465 1.465 weight 1.000 ! spec=13C_NOESY, no=606, id=2997, vol=5.480000e+07
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   37 and name HG23)
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   41 and name HD12)
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   41 and name HD13)
assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   40 and name   HN) 3.284 1.348 1.348 weight 1.000 ! spec=13C_NOESY, no=620, id=3011, vol=5.310000e+07
    or (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   40 and name   HN)
    or (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   44 and name   HN)
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   32 and name HG12) 3.354 1.406 1.406 weight 1.000 ! spec=13C_NOESY, no=631, id=3021, vol=5.120000e+07
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   54 and name   HN) 3.189 1.271 1.271 weight 1.000 ! spec=13C_NOESY, no=663, id=3051, vol=4.910000e+07
    or (segid "   A" and resid   54 and name  HB2) (segid "   A" and resid   55 and name   HN)
assign (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  110 and name   HN) 2.921 1.066 1.066 weight 1.000 ! spec=13C_NOESY, no=672, id=3060, vol=4.790000e+07
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   96 and name   HN)
assign (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   93 and name  HD2) 3.537 1.564 1.564 weight 1.000 ! spec=13C_NOESY, no=673, id=3061, vol=4.780000e+07
    or (segid "   A" and resid   99 and name  HB2) (segid "   A" and resid   99 and name  HD2)
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG12) 2.973 1.105 1.105 weight 1.000 ! spec=13C_NOESY, no=737, id=3124, vol=4.230000e+07
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG13)
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid    8 and name HG22)
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid    8 and name HG23)
assign (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   10 and name   HN) 3.498 1.530 1.530 weight 1.000 ! spec=13C_NOESY, no=784, id=3170, vol=3.900000e+07
    or (segid "   A" and resid  106 and name   HG) (segid "   A" and resid  107 and name   HN)
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HB1) 3.148 1.239 1.239 weight 1.000 ! spec=13C_NOESY, no=812, id=3196, vol=3.700000e+07
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name  HB1)
    or (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name  HB1)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD22) 3.555 1.580 1.580 weight 1.000 ! spec=13C_NOESY, no=827, id=3210, vol=3.580000e+07
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD23)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   40 and name HD22)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   40 and name HD21)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   40 and name HD23)
assign (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG22) 3.497 1.529 1.529 weight 1.000 ! spec=13C_NOESY, no=859, id=3239, vol=3.390000e+07
    or (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   34 and name  HG2) (segid "   A" and resid   37 and name HG23)
    or (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   34 and name  HG2)
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   34 and name  HG2)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   34 and name  HG2)
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   85 and name HD12) 3.459 1.496 1.496 weight 1.000 ! spec=13C_NOESY, no=865, id=3244, vol=3.350000e+07
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   31 and name  HD2) (segid "   A" and resid   66 and name  HB2) 3.778 1.784 1.784 weight 1.000 ! spec=13C_NOESY, no=1021, id=3393, vol=2.590000e+07
    or (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   66 and name  HB2)
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   66 and name  HB2)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   66 and name  HB2)
assign (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG22) 3.662 1.676 1.676 weight 1.000 ! spec=13C_NOESY, no=1023, id=3395, vol=2.580000e+07
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG23)
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   75 and name HG22)
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   75 and name HG21)
    or (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   75 and name HG23)
assign (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   23 and name  HB2) 3.873 1.875 1.875 weight 1.000 ! spec=13C_NOESY, no=1104, id=3469, vol=2.220000e+07
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name  HB2)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   21 and name   HN) 3.991 1.991 1.991 weight 1.000 ! spec=13C_NOESY, no=1114, id=3478, vol=2.180000e+07
    or (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   94 and name   HN)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name HG22) 3.478 1.512 1.512 weight 1.000 ! spec=13C_NOESY, no=1127, id=3490, vol=2.120000e+07
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name HG23)
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HG22)
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HG21)
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name HG23)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   46 and name  HB1) 3.926 1.927 1.927 weight 1.000 ! spec=13C_NOESY, no=1161, id=3523, vol=1.920000e+07
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name  HB2)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   70 and name  HB2) 3.743 1.751 1.751 weight 1.000 ! spec=13C_NOESY, no=1170, id=3531, vol=1.890000e+07
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   70 and name  HB3)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   74 and name  HB2)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   37 and name HD12) 3.909 1.910 1.910 weight 1.000 ! spec=13C_NOESY, no=1183, id=3544, vol=1.830000e+07
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   37 and name HD13)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   37 and name HD12)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   37 and name HD13)
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   62 and name  HB2) 3.968 1.968 1.968 weight 1.000 ! spec=13C_NOESY, no=1199, id=3560, vol=1.720000e+07
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   62 and name  HB3)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   43 and name   HN) 4.661 2.715 2.715 weight 1.000 ! spec=13C_NOESY, no=1206, id=3566, vol=1.650000e+07
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   43 and name   HN)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   43 and name   HN)
    or (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   44 and name   HN)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   44 and name   HN)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   44 and name   HN)
    or (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   56 and name   HN)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   56 and name   HN)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   56 and name   HN)
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   35 and name  HB2) 4.366 2.383 2.383 weight 1.000 ! spec=13C_NOESY, no=1254, id=3607, vol=1.250000e+07
    or (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   35 and name  HB3)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HG2) 4.010 2.010 2.010 weight 1.000 ! spec=13C_NOESY, no=1282, id=3633, vol=1.060000e+07
    or (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  105 and name  HG2)
    or (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name  HG2)
assign (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   72 and name  HB1) 4.904 3.006 3.006 weight 1.000 ! spec=13C_NOESY, no=1326, id=3674, vol=6.290000e+06
    or (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   72 and name  HB1)
assign (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   14 and name   HN) 5.101 3.253 3.253 weight 1.000 ! spec=13C_NOESY, no=1334, id=3682, vol=5.320000e+06
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   17 and name   HN)
assign (segid "   A" and resid   10 and name HD12) (segid "   A" and resid    9 and name  HE2) 5.407 3.655 3.655 weight 1.000 ! spec=13C_NOESY, no=1354, id=3697, vol=3.270000e+06
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid    9 and name  HE2)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid    9 and name  HE2)
    or (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   31 and name  HE2)
assign (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   15 and name HG21) 6.147 4.723 4.723 weight 1.000 ! spec=13C_NOESY, no=1372, id=3713, vol=1.460000e+06
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   15 and name HG23)
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   99 and name   HA) 6.341 5.026 5.026 weight 1.000 ! spec=13C_NOESY, no=1374, id=3714, vol=1.240000e+06
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid   99 and name   HA)
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   19 and name   HN) 4.583 2.626 2.626 weight 1.000 ! spec=13C_NOESY, no=1427, id=3761, vol=7.240000e+06
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   41 and name HG22) (segid "   A" and resid   45 and name   HN)
    or (segid "   A" and resid   41 and name HG21) (segid "   A" and resid   45 and name   HN)
    or (segid "   A" and resid   41 and name HG23) (segid "   A" and resid   45 and name   HN)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid  104 and name HD22) 4.314 2.326 2.326 weight 1.000 ! spec=13C_NOESY, no=1432, id=3765, vol=8.130000e+06
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid  104 and name HD21)
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid  104 and name HD23)
    or (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   62 and name  HB2) 4.682 2.740 2.740 weight 1.000 ! spec=13C_NOESY, no=1434, id=3766, vol=8.350000e+06
    or (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   63 and name  HB3) (segid "   A" and resid   57 and name  HG2)
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid  103 and name  HB2) 4.191 2.196 2.196 weight 1.000 ! spec=13C_NOESY, no=1448, id=3778, vol=1.070000e+07
    or (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   10 and name HG22) (segid "   A" and resid  103 and name  HB2) 3.220 1.296 1.296 weight 1.000 ! spec=13C_NOESY, no=1535, id=3854, vol=6.290000e+07
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid   23 and name HD12) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   23 and name HD12) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   23 and name HD12) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name HD22) 2.761 0.953 0.953 weight 1.000 ! spec=13C_NOESY, no=1542, id=3861, vol=7.400000e+07
    or (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name HD21)
    or (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name HD23)
    or (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  106 and name HD22)
    or (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  106 and name HD21)
    or (segid "   A" and resid  106 and name  HB2) (segid "   A" and resid  106 and name HD23)
assign (segid "   A" and resid   90 and name  HD1) (segid "   A" and resid   90 and name  HB2) 2.675 0.894 0.894 weight 1.000 ! spec=13C_NOESY, no=1564, id=3878, vol=1.380000e+08
    or (segid "   A" and resid   93 and name  HD1) (segid "   A" and resid   93 and name  HB2)
assign (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   54 and name   HN) 3.650 1.665 1.665 weight 1.000 ! spec=15N_NOESY, no=29, id=3918, vol=4.420000e+08
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   54 and name   HN)
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   53 and name   HN) 3.869 1.872 1.872 weight 1.000 ! spec=15N_NOESY, no=32, id=3921, vol=3.130000e+08
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   53 and name   HN)
assign (segid "   A" and resid   28 and name  HA1) (segid "   A" and resid   27 and name   HN) 5.936 4.404 4.404 weight 1.000 ! spec=15N_NOESY, no=65, id=3953, vol=4.220000e+07
    or (segid "   A" and resid   88 and name   HA) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   64 and name HD22) 4.234 2.241 2.241 weight 1.000 ! spec=15N_NOESY, no=114, id=4000, vol=1.480000e+08
    or (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   64 and name HD22)
assign (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   96 and name   HN) 3.379 1.428 1.428 weight 1.000 ! spec=15N_NOESY, no=165, id=4049, vol=2.390000e+08
    or (segid "   A" and resid  109 and name  HB2) (segid "   A" and resid  109 and name   HN)
assign (segid "   A" and resid  101 and name HG22) (segid "   A" and resid  102 and name   HN) 3.718 1.728 1.728 weight 1.000 ! spec=15N_NOESY, no=172, id=4055, vol=2.450000e+08
    or (segid "   A" and resid  101 and name HG21) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid  101 and name HG23) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid  101 and name HD12) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid  101 and name HD11) (segid "   A" and resid  102 and name   HN)
    or (segid "   A" and resid  101 and name HD13) (segid "   A" and resid  102 and name   HN)
assign (segid "   A" and resid    8 and name HG22) (segid "   A" and resid   80 and name   HN) 4.242 2.249 2.249 weight 1.000 ! spec=15N_NOESY, no=237, id=4119, vol=3.160000e+08
    or (segid "   A" and resid    8 and name HG21) (segid "   A" and resid   80 and name   HN)
    or (segid "   A" and resid    8 and name HG23) (segid "   A" and resid   80 and name   HN)
    or (segid "   A" and resid   44 and name  HB2) (segid "   A" and resid   80 and name   HN)
    or (segid "   A" and resid   44 and name  HB1) (segid "   A" and resid   80 and name   HN)
    or (segid "   A" and resid   44 and name  HB3) (segid "   A" and resid   80 and name   HN)
assign (segid "   A" and resid   67 and name   HN) (segid "   A" and resid   69 and name   HN) 3.482 1.515 1.515 weight 1.000 ! spec=15N_NOESY, no=241, id=4123, vol=3.180000e+08
    or (segid "   A" and resid   73 and name   HN) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   23 and name HD12) (segid "   A" and resid   23 and name   HN) 3.863 1.866 1.866 weight 1.000 ! spec=15N_NOESY, no=260, id=4140, vol=3.390000e+08
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid   23 and name   HN)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid   23 and name   HN)
    or (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   36 and name   HN)
assign (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   66 and name   HN) 3.505 1.536 1.536 weight 1.000 ! spec=15N_NOESY, no=356, id=4236, vol=4.380000e+08
    or (segid "   A" and resid   22 and name   HZ) (segid "   A" and resid   71 and name   HN)
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   85 and name   HN) 3.676 1.689 1.689 weight 1.000 ! spec=15N_NOESY, no=371, id=4251, vol=4.480000e+08
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name   HN)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name   HN)
assign (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   92 and name   HN) 3.773 1.779 1.779 weight 1.000 ! spec=15N_NOESY, no=397, id=4276, vol=4.780000e+08
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   92 and name   HN)
assign (segid "   A" and resid   52 and name  HB2) (segid "   A" and resid   52 and name HE21) 3.582 1.604 1.604 weight 1.000 ! spec=15N_NOESY, no=454, id=4332, vol=5.480000e+08
    or (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   16 and name HE21)
assign (segid "   A" and resid   82 and name HG22) (segid "   A" and resid   84 and name   HN) 3.321 1.379 1.379 weight 1.000 ! spec=15N_NOESY, no=544, id=4419, vol=6.850000e+08
    or (segid "   A" and resid   82 and name HG21) (segid "   A" and resid   84 and name   HN)
    or (segid "   A" and resid   82 and name HG23) (segid "   A" and resid   84 and name   HN)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   19 and name   HN)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   41 and name   HN) 3.410 1.454 1.454 weight 1.000 ! spec=15N_NOESY, no=564, id=4439, vol=7.200000e+08
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   41 and name   HN)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   41 and name   HN)
assign (segid "   A" and resid   45 and name  HD1) (segid "   A" and resid   43 and name   HN) 3.453 1.490 1.490 weight 1.000 ! spec=15N_NOESY, no=576, id=4451, vol=7.380000e+08
    or (segid "   A" and resid   84 and name  HE1) (segid "   A" and resid   43 and name   HN)
assign (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   44 and name  HB2) 3.364 1.414 1.414 weight 1.000 ! spec=15N_NOESY, no=600, id=4475, vol=7.930000e+08
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   44 and name  HB1)
    or (segid "   A" and resid   81 and name   HN) (segid "   A" and resid   44 and name  HB3)
    or (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   81 and name   HN)
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   81 and name   HN)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   81 and name   HN)
assign (segid "   A" and resid   72 and name  HD1) (segid "   A" and resid   19 and name   HN) 3.522 1.550 1.550 weight 1.000 ! spec=15N_NOESY, no=665, id=4539, vol=9.080000e+08
    or (segid "   A" and resid   84 and name  HD1) (segid "   A" and resid   84 and name   HN)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   91 and name   HN) 2.693 0.906 0.906 weight 1.000 ! spec=15N_NOESY, no=684, id=4558, vol=9.490000e+08
    or (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   91 and name   HN)
assign (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   97 and name   HN) 3.003 1.128 1.128 weight 1.000 ! spec=15N_NOESY, no=733, id=4607, vol=1.070000e+09
    or (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  101 and name   HN)
assign (segid "   A" and resid   69 and name   HA) (segid "   A" and resid   69 and name   HN) 2.392 0.715 0.715 weight 1.000 ! spec=15N_NOESY, no=879, id=4751, vol=2.070000e+09
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   96 and name   HN) 2.345 0.687 0.687 weight 1.000 ! spec=15N_NOESY, no=884, id=4756, vol=2.250000e+09
    or (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name   HN)
assign (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   66 and name  HD1) 3.205 1.284 1.284 weight 1.000 ! spec=2D_NOESY, no=12, id=11, vol=1.750000e+07
    or (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name HE22)
assign (segid "   A" and resid   60 and name   HA) (segid "   A" and resid   60 and name   HN) 2.986 1.115 1.115 weight 1.000 ! spec=2D_NOESY, no=35, id=34, vol=1.040000e+07
    or (segid "   A" and resid   77 and name   HA) (segid "   A" and resid   77 and name   HN)
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    9 and name   HN) 2.476 0.766 0.766 weight 1.000 ! spec=2D_NOESY, no=38, id=37, vol=2.800000e+07
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid  100 and name   HN)
assign (segid "   A" and resid   84 and name   HA) (segid "   A" and resid   83 and name   HN) 4.278 2.288 2.288 weight 1.000 ! spec=2D_NOESY, no=41, id=40, vol=4.680000e+06
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid  102 and name   HN)
assign (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name   HN) 3.516 1.545 1.545 weight 1.000 ! spec=2D_NOESY, no=45, id=44, vol=4.020000e+06
    or (segid "   A" and resid    9 and name   HA) (segid "   A" and resid   10 and name   HN)
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   16 and name   HN) 4.339 2.354 2.354 weight 1.000 ! spec=2D_NOESY, no=49, id=48, vol=4.550000e+06
    or (segid "   A" and resid   63 and name   HA) (segid "   A" and resid   64 and name HD21)
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid   10 and name   HN) 2.412 0.727 0.727 weight 1.000 ! spec=2D_NOESY, no=50, id=49, vol=3.460000e+07
    or (segid "   A" and resid   61 and name   HA) (segid "   A" and resid   61 and name   HN)
    or (segid "   A" and resid  104 and name   HA) (segid "   A" and resid  104 and name   HN)
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   95 and name   HN) 2.641 0.872 0.872 weight 1.000 ! spec=2D_NOESY, no=59, id=58, vol=2.220000e+07
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name   HN)
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   96 and name   HN)
assign (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   27 and name HE22) 3.724 1.733 1.733 weight 1.000 ! spec=2D_NOESY, no=61, id=60, vol=6.920000e+06
    or (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   39 and name HE22)
assign (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name   HN) 2.729 0.931 0.931 weight 1.000 ! spec=2D_NOESY, no=62, id=61, vol=2.080000e+07
    or (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  106 and name   HN)
    or (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name   HN)
assign (segid "   A" and resid   28 and name  HA1) (segid "   A" and resid   29 and name HE22) 4.789 2.867 2.867 weight 1.000 ! spec=2D_NOESY, no=63, id=62, vol=2.520000e+06
    or (segid "   A" and resid   65 and name  HA1) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   66 and name  HD1)
assign (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  105 and name   HN) 2.385 0.711 0.711 weight 1.000 ! spec=2D_NOESY, no=65, id=64, vol=3.450000e+07
    or (segid "   A" and resid  107 and name   HA) (segid "   A" and resid  107 and name   HN)
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   70 and name   HN) 2.596 0.842 0.842 weight 1.000 ! spec=2D_NOESY, no=67, id=66, vol=3.150000e+07
    or (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name   HN)
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   95 and name   HN) 3.232 1.306 1.306 weight 1.000 ! spec=2D_NOESY, no=69, id=68, vol=6.560000e+06
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name   HN)
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   96 and name   HN)
    or (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name   HN)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   45 and name  HE1) 4.144 2.146 2.146 weight 1.000 ! spec=2D_NOESY, no=73, id=72, vol=5.680000e+06
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid   16 and name HE22)
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   38 and name   HN) 2.451 0.751 0.751 weight 1.000 ! spec=2D_NOESY, no=79, id=78, vol=4.210000e+07
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  102 and name   HN)
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   36 and name   HN) 3.606 1.626 1.626 weight 1.000 ! spec=2D_NOESY, no=80, id=79, vol=7.210000e+06
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   43 and name   HN)
assign (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   35 and name   HN) 3.111 1.210 1.210 weight 1.000 ! spec=2D_NOESY, no=84, id=83, vol=1.050000e+07
    or (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   73 and name   HN)
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   12 and name   HN) 3.186 1.269 1.269 weight 1.000 ! spec=2D_NOESY, no=89, id=88, vol=1.190000e+07
    or (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   19 and name   HN)
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name   HN) 3.081 1.187 1.187 weight 1.000 ! spec=2D_NOESY, no=90, id=89, vol=9.410000e+06
    or (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   74 and name   HN)
assign (segid "   A" and resid   16 and name   HA) (segid "   A" and resid   16 and name   HN) 3.571 1.594 1.594 weight 1.000 ! spec=2D_NOESY, no=99, id=97, vol=4.080000e+06
    or (segid "   A" and resid   59 and name  HA1) (segid "   A" and resid   60 and name   HN)
assign (segid "   A" and resid   73 and name   HA) (segid "   A" and resid   72 and name  HE1) 4.177 2.180 2.180 weight 1.000 ! spec=2D_NOESY, no=104, id=102, vol=3.230000e+06
    or (segid "   A" and resid   19 and name   HA) (segid "   A" and resid   72 and name  HE1)
    or (segid "   A" and resid   62 and name   HA) (segid "   A" and resid   50 and name  HZ2)
assign (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    9 and name   HN) 4.046 2.047 2.047 weight 1.000 ! spec=2D_NOESY, no=108, id=106, vol=1.980000e+06
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid    9 and name   HN)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name   HN) 3.688 1.700 1.700 weight 1.000 ! spec=2D_NOESY, no=111, id=109, vol=3.290000e+06
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   79 and name   HN)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   28 and name   HN) 4.417 2.439 2.439 weight 1.000 ! spec=2D_NOESY, no=112, id=110, vol=1.990000e+06
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   72 and name   HN)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   39 and name HE21) 2.457 0.755 0.755 weight 1.000 ! spec=2D_NOESY, no=113, id=111, vol=3.630000e+07
    or (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   71 and name  HD1) 3.238 1.311 1.311 weight 1.000 ! spec=2D_NOESY, no=114, id=112, vol=1.210000e+07
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name   HN)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name   HN) 3.032 1.149 1.149 weight 1.000 ! spec=2D_NOESY, no=117, id=115, vol=9.050000e+06
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name   HN)
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   88 and name   HN) 3.011 1.133 1.133 weight 1.000 ! spec=2D_NOESY, no=125, id=123, vol=1.270000e+07
    or (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name   HN)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   81 and name  HE1) 3.401 1.446 1.446 weight 1.000 ! spec=2D_NOESY, no=126, id=124, vol=1.490000e+07
    or (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   81 and name  HE1)
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid    9 and name   HN) 3.023 1.142 1.142 weight 1.000 ! spec=2D_NOESY, no=128, id=126, vol=1.690000e+07
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   83 and name   HN)
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   52 and name   HN) 2.429 0.738 0.738 weight 1.000 ! spec=2D_NOESY, no=130, id=128, vol=4.300000e+07
    or (segid "   A" and resid   74 and name   HA) (segid "   A" and resid   74 and name   HN)
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name   HN) 2.629 0.864 0.864 weight 1.000 ! spec=2D_NOESY, no=136, id=134, vol=2.170000e+07
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   91 and name   HN)
assign (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   87 and name   HN) 2.927 1.071 1.071 weight 1.000 ! spec=2D_NOESY, no=138, id=136, vol=2.280000e+07
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   89 and name  HD1)
assign (segid "   A" and resid   80 and name   HA) (segid "   A" and resid   80 and name HE21) 4.062 2.062 2.062 weight 1.000 ! spec=2D_NOESY, no=140, id=138, vol=7.510000e+06
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   84 and name  HD1)
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   52 and name HE21) 2.973 1.105 1.105 weight 1.000 ! spec=2D_NOESY, no=141, id=139, vol=2.150000e+07
    or (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   55 and name   HN)
assign (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   52 and name HE22) 3.928 1.929 1.929 weight 1.000 ! spec=2D_NOESY, no=147, id=145, vol=7.420000e+06
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   27 and name HE22)
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   27 and name   HN) 3.202 1.281 1.281 weight 1.000 ! spec=2D_NOESY, no=157, id=154, vol=1.350000e+07
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   36 and name   HN)
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   21 and name   HN) 5.858 4.290 4.290 weight 1.000 ! spec=2D_NOESY, no=159, id=155, vol=1.600000e+05
    or (segid "   A" and resid   93 and name  HD2) (segid "   A" and resid   94 and name   HN)
assign (segid "   A" and resid   24 and name  HB2) (segid "   A" and resid   25 and name   HN) 3.824 1.828 1.828 weight 1.000 ! spec=2D_NOESY, no=165, id=161, vol=2.160000e+06
    or (segid "   A" and resid   99 and name  HD2) (segid "   A" and resid  100 and name   HN)
assign (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   72 and name  HE1) 5.007 3.134 3.134 weight 1.000 ! spec=2D_NOESY, no=168, id=164, vol=1.520000e+06
    or (segid "   A" and resid   90 and name  HD2) (segid "   A" and resid   89 and name  HE1)
assign (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   50 and name  HE3) 3.673 1.687 1.687 weight 1.000 ! spec=2D_NOESY, no=182, id=176, vol=4.800000e+06
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   27 and name   HN)
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   10 and name   HN) 5.151 3.316 3.316 weight 1.000 ! spec=2D_NOESY, no=195, id=187, vol=7.310000e+05
    or (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   61 and name   HN)
    or (segid "   A" and resid   99 and name  HD1) (segid "   A" and resid  103 and name   HN)
    or (segid "   A" and resid   99 and name  HD1) (segid "   A" and resid  105 and name   HN)
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   17 and name   HN) 4.221 2.228 2.228 weight 1.000 ! spec=2D_NOESY, no=209, id=199, vol=1.190000e+06
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   43 and name  HA1) (segid "   A" and resid   43 and name   HN) 2.678 0.896 0.896 weight 1.000 ! spec=2D_NOESY, no=211, id=201, vol=2.970000e+07
    or (segid "   A" and resid   44 and name   HA) (segid "   A" and resid   44 and name   HN)
assign (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   39 and name   HN) 3.852 1.854 1.854 weight 1.000 ! spec=2D_NOESY, no=212, id=202, vol=4.310000e+06
    or (segid "   A" and resid   41 and name   HA) (segid "   A" and resid   45 and name  HD1)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   71 and name   HZ) 14.606 14.606 26.666 weight 1.000 ! spec=2D_NOESY, no=214, id=204, vol=1.810000e+03
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   22 and name  HE1)
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   72 and name  HD1) 4.045 2.046 2.046 weight 1.000 ! spec=2D_NOESY, no=264, id=249, vol=3.940000e+06
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   81 and name  HD1)
assign (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   44 and name   HN) 3.083 1.188 1.188 weight 1.000 ! spec=2D_NOESY, no=275, id=259, vol=8.300000e+06
    or (segid "   A" and resid  112 and name  HB2) (segid "   A" and resid  112 and name   HN)
assign (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name   HN) 3.428 1.469 1.469 weight 1.000 ! spec=2D_NOESY, no=305, id=287, vol=1.190000e+07
    or (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid   17 and name   HN)
assign (segid "   A" and resid   38 and name  HB2) (segid "   A" and resid   39 and name   HN) 2.965 1.099 1.099 weight 1.000 ! spec=2D_NOESY, no=306, id=288, vol=2.380000e+07
    or (segid "   A" and resid   45 and name  HB1) (segid "   A" and resid   45 and name  HD1)
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   71 and name  HD1) 3.791 1.797 1.797 weight 1.000 ! spec=2D_NOESY, no=308, id=290, vol=5.800000e+06
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name   HN)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   23 and name   HN) 3.481 1.514 1.514 weight 1.000 ! spec=2D_NOESY, no=319, id=301, vol=8.530000e+06
    or (segid "   A" and resid   91 and name  HB1) (segid "   A" and resid   16 and name HE21)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   25 and name   HN) 3.298 1.360 1.360 weight 1.000 ! spec=2D_NOESY, no=326, id=308, vol=1.460000e+07
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   68 and name   HN)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   39 and name HE22) 4.172 2.176 2.176 weight 1.000 ! spec=2D_NOESY, no=329, id=311, vol=2.830000e+06
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   45 and name   HZ)
assign (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   84 and name  HD1) 3.582 1.603 1.603 weight 1.000 ! spec=2D_NOESY, no=359, id=341, vol=8.010000e+06
    or (segid "   A" and resid   51 and name  HG1) (segid "   A" and resid   50 and name  HZ3)
assign (segid "   A" and resid   27 and name  HG2) (segid "   A" and resid   27 and name   HN) 3.148 1.239 1.239 weight 1.000 ! spec=2D_NOESY, no=360, id=342, vol=1.450000e+07
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   40 and name   HN)
assign (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   83 and name   HN) 4.144 2.147 2.147 weight 1.000 ! spec=2D_NOESY, no=363, id=345, vol=4.790000e+06
    or (segid "   A" and resid   39 and name  HB2) (segid "   A" and resid   38 and name   HN)
assign (segid "   A" and resid  100 and name  HG2) (segid "   A" and resid  102 and name   HN) 4.172 2.176 2.176 weight 1.000 ! spec=2D_NOESY, no=378, id=360, vol=3.370000e+06
    or (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   53 and name   HN)
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   84 and name   HN) 3.542 1.568 1.568 weight 1.000 ! spec=2D_NOESY, no=391, id=373, vol=1.020000e+07
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   19 and name   HN)
assign (segid "   A" and resid   85 and name   HB) (segid "   A" and resid   87 and name   HN) 3.532 1.559 1.559 weight 1.000 ! spec=2D_NOESY, no=393, id=375, vol=1.300000e+07
    or (segid "   A" and resid   88 and name  HB1) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   33 and name   HN) 3.941 1.941 1.941 weight 1.000 ! spec=2D_NOESY, no=395, id=377, vol=8.580000e+06
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   33 and name   HN)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   33 and name   HN)
    or (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   49 and name   HN)
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid    9 and name   HN) 27.143 27.143 92.095 weight 1.000 ! spec=2D_NOESY, no=401, id=382, vol=1.790000e+01
    or (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name   HN)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   39 and name HE21) 3.714 1.724 1.724 weight 1.000 ! spec=2D_NOESY, no=403, id=384, vol=1.050000e+07
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   39 and name HE21)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   39 and name HE21)
    or (segid "   A" and resid   88 and name  HB1) (segid "   A" and resid   87 and name   HN)
assign (segid "   A" and resid   48 and name   HG) (segid "   A" and resid   45 and name  HE1) 3.893 1.894 1.894 weight 1.000 ! spec=2D_NOESY, no=406, id=387, vol=4.830000e+06
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   66 and name  HD1)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   84 and name  HD1) 3.401 1.446 1.446 weight 1.000 ! spec=2D_NOESY, no=415, id=396, vol=1.350000e+07
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   84 and name  HD1)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   84 and name  HD1)
    or (segid "   A" and resid   88 and name  HB1) (segid "   A" and resid   84 and name  HD1)
assign (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name   HN) 3.651 1.666 1.666 weight 1.000 ! spec=2D_NOESY, no=422, id=403, vol=4.010000e+06
    or (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name   HN)
assign (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name   HN) 3.370 1.419 1.419 weight 1.000 ! spec=2D_NOESY, no=425, id=406, vol=5.590000e+06
    or (segid "   A" and resid  109 and name  HB2) (segid "   A" and resid  109 and name   HN)
assign (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   33 and name   HN) 3.709 1.720 1.720 weight 1.000 ! spec=2D_NOESY, no=431, id=412, vol=6.600000e+06
    or (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   49 and name   HN)
assign (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid   83 and name   HN) 3.460 1.496 1.496 weight 1.000 ! spec=2D_NOESY, no=443, id=424, vol=4.980000e+06
    or (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   95 and name   HN)
    or (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   96 and name   HN)
    or (segid "   A" and resid  109 and name  HB2) (segid "   A" and resid  109 and name   HN)
assign (segid "   A" and resid   94 and name  HB1) (segid "   A" and resid   95 and name   HN) 3.467 1.503 1.503 weight 1.000 ! spec=2D_NOESY, no=444, id=425, vol=6.200000e+06
    or (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   95 and name   HN)
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name   HN)
assign (segid "   A" and resid   18 and name   HB) (segid "   A" and resid   72 and name  HE1) 2.781 0.967 0.967 weight 1.000 ! spec=2D_NOESY, no=448, id=429, vol=5.190000e+07
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   39 and name   HN)
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name   HN) 2.538 0.805 0.805 weight 1.000 ! spec=2D_NOESY, no=459, id=439, vol=4.820000e+07
    or (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   56 and name   HN)
assign (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  103 and name   HN) 3.031 1.149 1.149 weight 1.000 ! spec=2D_NOESY, no=460, id=440, vol=9.340000e+06
    or (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  104 and name   HN)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   66 and name  HD1) 3.681 1.694 1.694 weight 1.000 ! spec=2D_NOESY, no=470, id=450, vol=5.080000e+06
    or (segid "   A" and resid   56 and name  HD2) (segid "   A" and resid   52 and name HE22)
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   60 and name   HN) 4.237 2.244 2.244 weight 1.000 ! spec=2D_NOESY, no=484, id=462, vol=4.420000e+06
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   60 and name   HN)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   60 and name   HN)
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   77 and name   HN)
assign (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   74 and name   HN) 5.141 3.304 3.304 weight 1.000 ! spec=2D_NOESY, no=491, id=469, vol=1.190000e+06
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   74 and name   HN)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   74 and name   HN)
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   77 and name   HN)
    or (segid "   A" and resid   19 and name  HD2) (segid "   A" and resid   20 and name   HN)
assign (segid "   A" and resid   31 and name  HD2) (segid "   A" and resid   27 and name HE22) 3.130 1.225 1.225 weight 1.000 ! spec=2D_NOESY, no=492, id=470, vol=2.770000e+07
    or (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   66 and name  HD1)
assign (segid "   A" and resid   31 and name  HB2) (segid "   A" and resid   27 and name HE21) 2.495 0.778 0.778 weight 1.000 ! spec=2D_NOESY, no=497, id=474, vol=1.980000e+07
    or (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   57 and name   HN)
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   60 and name   HN) 3.793 1.798 1.798 weight 1.000 ! spec=2D_NOESY, no=501, id=478, vol=6.370000e+06
    or (segid "   A" and resid   60 and name  HG2) (segid "   A" and resid   60 and name   HN)
assign (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   10 and name   HN) 3.568 1.591 1.591 weight 1.000 ! spec=2D_NOESY, no=506, id=483, vol=7.810000e+06
    or (segid "   A" and resid   31 and name  HD2) (segid "   A" and resid   67 and name   HN)
assign (segid "   A" and resid  101 and name HG12) (segid "   A" and resid  102 and name   HN) 3.807 1.812 1.812 weight 1.000 ! spec=2D_NOESY, no=521, id=498, vol=3.710000e+06
    or (segid "   A" and resid  110 and name  HG2) (segid "   A" and resid  110 and name   HN)
assign (segid "   A" and resid   35 and name  HB2) (segid "   A" and resid   35 and name   HN) 2.335 0.681 0.681 weight 1.000 ! spec=2D_NOESY, no=522, id=499, vol=4.930000e+07
    or (segid "   A" and resid   35 and name  HB1) (segid "   A" and resid   35 and name   HN)
    or (segid "   A" and resid   35 and name  HB3) (segid "   A" and resid   35 and name   HN)
    or (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid  103 and name  HB3) (segid "   A" and resid  104 and name   HN)
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name   HN) 2.523 0.796 0.796 weight 1.000 ! spec=2D_NOESY, no=528, id=505, vol=1.490000e+07
    or (segid "   A" and resid   92 and name  HB2) (segid "   A" and resid   92 and name   HN)
    or (segid "   A" and resid   92 and name  HB1) (segid "   A" and resid   92 and name   HN)
    or (segid "   A" and resid   92 and name  HB3) (segid "   A" and resid   92 and name   HN)
assign (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   61 and name   HN) 2.767 0.957 0.957 weight 1.000 ! spec=2D_NOESY, no=530, id=507, vol=9.880000e+06
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   61 and name   HN)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   61 and name   HN)
    or (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid  104 and name   HN)
    or (segid "   A" and resid  103 and name  HB3) (segid "   A" and resid  104 and name   HN)
assign (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   56 and name   HN) 4.239 2.247 2.247 weight 1.000 ! spec=2D_NOESY, no=531, id=508, vol=4.090000e+06
    or (segid "   A" and resid   92 and name  HB2) (segid "   A" and resid   16 and name HE21)
    or (segid "   A" and resid   92 and name  HB1) (segid "   A" and resid   16 and name HE21)
    or (segid "   A" and resid   92 and name  HB3) (segid "   A" and resid   16 and name HE21)
    or (segid "   A" and resid  103 and name  HB2) (segid "   A" and resid   16 and name HE21)
    or (segid "   A" and resid  103 and name  HB1) (segid "   A" and resid   16 and name HE21)
    or (segid "   A" and resid  103 and name  HB3) (segid "   A" and resid   16 and name HE21)
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   19 and name   HN) 4.829 2.914 2.914 weight 1.000 ! spec=2D_NOESY, no=535, id=512, vol=1.230000e+06
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name   HN)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name   HN)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name   HN)
assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   40 and name   HN) 4.944 3.055 3.055 weight 1.000 ! spec=2D_NOESY, no=538, id=515, vol=1.370000e+06
    or (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   44 and name   HN)
    or (segid "   A" and resid   57 and name  HG2) (segid "   A" and resid   56 and name   HN)
assign (segid "   A" and resid   20 and name HG21) (segid "   A" and resid   25 and name  HE1) 5.260 3.459 3.459 weight 1.000 ! spec=2D_NOESY, no=540, id=517, vol=4.120000e+06
    or (segid "   A" and resid   20 and name HG22) (segid "   A" and resid   25 and name  HE1)
    or (segid "   A" and resid   20 and name HG23) (segid "   A" and resid   25 and name  HE1)
    or (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name HE22)
assign (segid "   A" and resid   80 and name  HB1) (segid "   A" and resid   80 and name HE21) 4.271 2.280 2.280 weight 1.000 ! spec=2D_NOESY, no=545, id=522, vol=7.270000e+06
    or (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   72 and name  HD1)
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   72 and name  HD1)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   72 and name  HD1)
assign (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   14 and name   HN) 3.806 1.811 1.811 weight 1.000 ! spec=2D_NOESY, no=546, id=523, vol=6.220000e+06
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   14 and name   HN)
    or (segid "   A" and resid   15 and name HG21) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   15 and name HG22) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   15 and name HG23) (segid "   A" and resid   17 and name   HN)
assign (segid "   A" and resid   41 and name HG11) (segid "   A" and resid   40 and name   HN) 3.874 1.876 1.876 weight 1.000 ! spec=2D_NOESY, no=558, id=535, vol=5.480000e+06
    or (segid "   A" and resid   56 and name  HG2) (segid "   A" and resid   56 and name   HN)
    or (segid "   A" and resid   76 and name  HB2) (segid "   A" and resid   78 and name   HN)
    or (segid "   A" and resid   76 and name  HB1) (segid "   A" and resid   78 and name   HN)
    or (segid "   A" and resid   76 and name  HB3) (segid "   A" and resid   78 and name   HN)
assign (segid "   A" and resid  101 and name HG11) (segid "   A" and resid  101 and name   HN) 2.932 1.075 1.075 weight 1.000 ! spec=2D_NOESY, no=560, id=537, vol=5.080000e+06
    or (segid "   A" and resid  101 and name HG11) (segid "   A" and resid  103 and name   HN)
assign (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   62 and name   HN) 2.935 1.077 1.077 weight 1.000 ! spec=2D_NOESY, no=564, id=541, vol=1.170000e+07
    or (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   62 and name   HN)
    or (segid "   A" and resid   62 and name  HB3) (segid "   A" and resid   62 and name   HN)
    or (segid "   A" and resid   63 and name  HB2) (segid "   A" and resid   63 and name   HN)
    or (segid "   A" and resid   63 and name  HB1) (segid "   A" and resid   63 and name   HN)
    or (segid "   A" and resid   63 and name  HB3) (segid "   A" and resid   63 and name   HN)
assign (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   89 and name  HE1) 3.497 1.529 1.529 weight 1.000 ! spec=2D_NOESY, no=572, id=548, vol=1.210000e+07
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   89 and name  HE1)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   89 and name  HE1)
    or (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   39 and name   HN)
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   89 and name   HN) 3.995 1.995 1.995 weight 1.000 ! spec=2D_NOESY, no=581, id=557, vol=4.200000e+06
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   89 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   89 and name   HN)
    or (segid "   A" and resid   10 and name HG22) (segid "   A" and resid   10 and name   HN)
    or (segid "   A" and resid   10 and name HG21) (segid "   A" and resid   10 and name   HN)
    or (segid "   A" and resid   10 and name HG23) (segid "   A" and resid   10 and name   HN)
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   36 and name   HN) 3.002 1.127 1.127 weight 1.000 ! spec=2D_NOESY, no=600, id=576, vol=2.260000e+07
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   36 and name   HN)
    or (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   39 and name HE21)
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   39 and name HE21)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   39 and name HE21)
assign (segid "   A" and resid  106 and name HD12) (segid "   A" and resid  107 and name   HN) 4.027 2.027 2.027 weight 1.000 ! spec=2D_NOESY, no=602, id=578, vol=3.270000e+06
    or (segid "   A" and resid  106 and name HD11) (segid "   A" and resid  107 and name   HN)
    or (segid "   A" and resid  106 and name HD13) (segid "   A" and resid  107 and name   HN)
    or (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   89 and name   HN)
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   89 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   89 and name   HN)
assign (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   78 and name   HN) 3.888 1.889 1.889 weight 1.000 ! spec=2D_NOESY, no=603, id=579, vol=5.630000e+06
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   78 and name   HN)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   78 and name   HN)
    or (segid "   A" and resid   82 and name HG12) (segid "   A" and resid   81 and name   HN)
    or (segid "   A" and resid   82 and name HG11) (segid "   A" and resid   81 and name   HN)
    or (segid "   A" and resid   82 and name HG13) (segid "   A" and resid   81 and name   HN)
assign (segid "   A" and resid   37 and name HG12) (segid "   A" and resid   37 and name   HN) 3.084 1.189 1.189 weight 1.000 ! spec=2D_NOESY, no=620, id=596, vol=9.710000e+06
    or (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   69 and name   HN)
assign (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   48 and name   HN) 3.350 1.403 1.403 weight 1.000 ! spec=2D_NOESY, no=630, id=606, vol=1.020000e+07
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   48 and name   HN)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   48 and name   HN)
    or (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   75 and name   HN)
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   75 and name   HN)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   75 and name   HN)
assign (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   74 and name   HN) 4.054 2.054 2.054 weight 1.000 ! spec=2D_NOESY, no=634, id=610, vol=5.200000e+06
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   74 and name   HN)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   74 and name   HN)
    or (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   77 and name   HN)
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   77 and name   HN)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   77 and name   HN)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   37 and name   HN) 4.011 2.011 2.011 weight 1.000 ! spec=2D_NOESY, no=635, id=611, vol=4.880000e+06
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   17 and name   HN)
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   37 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   37 and name   HN)
assign (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   18 and name   HN) 4.033 2.033 2.033 weight 1.000 ! spec=2D_NOESY, no=638, id=613, vol=6.590000e+06
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   18 and name   HN)
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   28 and name   HN)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   28 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   28 and name   HN)
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   58 and name   HN) 3.346 1.400 1.400 weight 1.000 ! spec=2D_NOESY, no=646, id=621, vol=2.480000e+07
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   58 and name   HN)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   58 and name   HN)
    or (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   31 and name   HN)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   27 and name HE21) 3.301 1.362 1.362 weight 1.000 ! spec=2D_NOESY, no=655, id=630, vol=3.480000e+07
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   27 and name HE21)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   27 and name HE21)
    or (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   57 and name   HN)
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   57 and name   HN)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   57 and name   HN)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   38 and name  HB1) 51.578 51.578 332.542 weight 1.000 ! spec=2D_NOESY, no=662, id=637, vol=1.740000e+00
    or (segid "   A" and resid   54 and name  HB1) (segid "   A" and resid   51 and name  HG2)
assign (segid "   A" and resid   57 and name  HB1) (segid "   A" and resid   66 and name   HH) 4.300 2.311 2.311 weight 1.000 ! spec=2D_NOESY, no=702, id=673, vol=6.800000e+06
    or (segid "   A" and resid   31 and name  HD2) (segid "   A" and resid   66 and name   HN)
assign (segid "   A" and resid   85 and name HG22) (segid "   A" and resid   21 and name   HN) 3.325 1.382 1.382 weight 1.000 ! spec=2D_NOESY, no=774, id=745, vol=9.420000e+06
    or (segid "   A" and resid   85 and name HG21) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   85 and name HG23) (segid "   A" and resid   21 and name   HN)
    or (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   68 and name   HN)
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   68 and name   HN)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   68 and name   HN)
assign (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   41 and name   HN) 3.151 1.241 1.241 weight 1.000 ! spec=2D_NOESY, no=776, id=747, vol=1.360000e+07
    or (segid "   A" and resid   99 and name  HB1) (segid "   A" and resid  100 and name   HN)
assign (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD12) 4.776 2.851 2.851 weight 1.000 ! spec=2D_NOESY, no=778, id=749, vol=2.110000e+06
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   41 and name   HN) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   79 and name  HB2) (segid "   A" and resid    9 and name   HN) 4.359 2.375 2.375 weight 1.000 ! spec=2D_NOESY, no=788, id=759, vol=1.170000e+06
    or (segid "   A" and resid   95 and name  HB2) (segid "   A" and resid   95 and name   HN)
    or (segid "   A" and resid   96 and name  HB2) (segid "   A" and resid   96 and name   HN)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   83 and name   HN) 2.955 1.091 1.091 weight 1.000 ! spec=2D_NOESY, no=799, id=770, vol=1.410000e+07
    or (segid "   A" and resid  109 and name  HG2) (segid "   A" and resid  109 and name   HN)
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   26 and name   HN) 2.866 1.027 1.027 weight 1.000 ! spec=2D_NOESY, no=803, id=774, vol=3.120000e+07
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   38 and name   HN)
assign (segid "   A" and resid    8 and name   HB) (segid "   A" and resid   10 and name   HN) 3.553 1.578 1.578 weight 1.000 ! spec=2D_NOESY, no=822, id=793, vol=1.030000e+07
    or (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  105 and name   HN)
assign (segid "   A" and resid   16 and name  HB2) (segid "   A" and resid   17 and name   HN) 1.936 0.468 0.468 weight 1.000 ! spec=2D_NOESY, no=827, id=798, vol=8.680000e+07
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   14 and name   HN)
assign (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   35 and name  HB2) 3.589 1.611 1.611 weight 1.000 ! spec=2D_NOESY, no=838, id=809, vol=7.150000e+06
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   37 and name   HN) (segid "   A" and resid   35 and name  HB3)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   62 and name   HN)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   62 and name   HN)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   62 and name   HN)
assign (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   53 and name HD12) 4.406 2.427 2.427 weight 1.000 ! spec=2D_NOESY, no=859, id=830, vol=3.060000e+06
    or (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   48 and name   HN) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   84 and name   HN) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   48 and name HD22) (segid "   A" and resid   48 and name   HN) 4.779 2.854 2.854 weight 1.000 ! spec=2D_NOESY, no=864, id=835, vol=1.370000e+06
    or (segid "   A" and resid   48 and name HD21) (segid "   A" and resid   48 and name   HN)
    or (segid "   A" and resid   48 and name HD23) (segid "   A" and resid   48 and name   HN)
    or (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   75 and name   HN)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   75 and name   HN)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   75 and name   HN)
assign (segid "   A" and resid   51 and name  HG1) (segid "   A" and resid   52 and name   HN) 5.101 3.252 3.252 weight 1.000 ! spec=2D_NOESY, no=888, id=859, vol=8.720000e+05
    or (segid "   A" and resid   64 and name HD21) (segid "   A" and resid   57 and name  HE1)
assign (segid "   A" and resid   74 and name   HN) (segid "   A" and resid   74 and name   HG) 4.456 2.482 2.482 weight 1.000 ! spec=2D_NOESY, no=895, id=866, vol=3.360000e+06
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   10 and name HD12)
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   10 and name HD11)
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   10 and name HD13)
assign (segid "   A" and resid   43 and name  HA1) (segid "   A" and resid   43 and name   HN) 2.765 0.956 0.956 weight 1.000 ! spec=2D_NOESY, no=908, id=879, vol=2.240000e+07
    or (segid "   A" and resid   54 and name   HN) (segid "   A" and resid   54 and name   HA)
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   23 and name   HN) 3.695 1.707 1.707 weight 1.000 ! spec=2D_NOESY, no=929, id=900, vol=1.060000e+07
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   23 and name   HN)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   23 and name   HN)
    or (segid "   A" and resid   23 and name HD12) (segid "   A" and resid   23 and name   HN)
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid   23 and name   HN)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid   23 and name   HN)
assign (segid "   A" and resid   36 and name   HN) (segid "   A" and resid   32 and name   HB) 3.846 1.849 1.849 weight 1.000 ! spec=2D_NOESY, no=943, id=914, vol=5.040000e+06
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   32 and name   HB)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   36 and name   HN) 2.913 1.061 1.061 weight 1.000 ! spec=2D_NOESY, no=944, id=915, vol=2.410000e+07
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   39 and name HE21)
assign (segid "   A" and resid   51 and name  HB2) (segid "   A" and resid   50 and name  HE3) 3.769 1.775 1.775 weight 1.000 ! spec=2D_NOESY, no=953, id=924, vol=8.580000e+06
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   89 and name  HD1)
assign (segid "   A" and resid   86 and name  HB2) (segid "   A" and resid   88 and name   HN) 4.338 2.352 2.352 weight 1.000 ! spec=2D_NOESY, no=970, id=941, vol=3.830000e+06
    or (segid "   A" and resid   86 and name  HB1) (segid "   A" and resid   88 and name   HN)
    or (segid "   A" and resid   86 and name  HB3) (segid "   A" and resid   88 and name   HN)
    or (segid "   A" and resid   10 and name HG12) (segid "   A" and resid   72 and name  HE1)
assign (segid "   A" and resid   68 and name  HG2) (segid "   A" and resid   22 and name   HZ) 3.955 1.955 1.955 weight 1.000 ! spec=2D_NOESY, no=998, id=969, vol=7.100000e+06
    or (segid "   A" and resid   10 and name HD12) (segid "   A" and resid   72 and name  HD1)
    or (segid "   A" and resid   10 and name HD11) (segid "   A" and resid   72 and name  HD1)
    or (segid "   A" and resid   10 and name HD13) (segid "   A" and resid   72 and name  HD1)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   71 and name  HE1) 3.493 1.525 1.525 weight 1.000 ! spec=2D_NOESY, no=1007, id=978, vol=9.060000e+06
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   71 and name  HE1)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   71 and name  HE1)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   71 and name   HZ)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   71 and name   HZ)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   71 and name   HZ)
assign (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   10 and name HD12) 4.330 2.344 2.344 weight 1.000 ! spec=2D_NOESY, no=1044, id=1015, vol=3.800000e+06
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   10 and name HD11)
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   10 and name HD13)
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   18 and name HG11)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   66 and name  HD1) 4.029 2.029 2.029 weight 1.000 ! spec=2D_NOESY, no=1062, id=1033, vol=2.570000e+06
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   74 and name HD12) (segid "   A" and resid   45 and name   HZ)
    or (segid "   A" and resid   74 and name HD11) (segid "   A" and resid   45 and name   HZ)
    or (segid "   A" and resid   74 and name HD13) (segid "   A" and resid   45 and name   HZ)
assign (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   39 and name HE22) 3.874 1.876 1.876 weight 1.000 ! spec=2D_NOESY, no=1063, id=1034, vol=4.210000e+06
    or (segid "   A" and resid   45 and name   HZ) (segid "   A" and resid   45 and name  HB2)
assign (segid "   A" and resid   32 and name HG12) (segid "   A" and resid   66 and name  HD1) 4.289 2.300 2.300 weight 1.000 ! spec=2D_NOESY, no=1069, id=1040, vol=4.200000e+06
    or (segid "   A" and resid   32 and name HG11) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   32 and name HG13) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   66 and name  HD1)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   66 and name  HD1)
assign (segid "   A" and resid   45 and name  HE1) (segid "   A" and resid   41 and name HG12) 4.304 2.315 2.315 weight 1.000 ! spec=2D_NOESY, no=1077, id=1048, vol=5.350000e+06
    or (segid "   A" and resid   56 and name  HD2) (segid "   A" and resid   45 and name  HE1)
assign (segid "   A" and resid   31 and name   HA) (segid "   A" and resid   32 and name   HB) 4.495 2.525 2.525 weight 1.000 ! spec=2D_NOESY, no=1148, id=1086, vol=4.140000e+06
    or (segid "   A" and resid   89 and name   HA) (segid "   A" and resid   90 and name  HG2)
assign (segid "   A" and resid   71 and name  HD1) (segid "   A" and resid   71 and name   HN) 3.888 1.889 1.889 weight 1.000 ! spec=2D_NOESY, no=1172, id=1107, vol=8.930000e+06
    or (segid "   A" and resid   82 and name   HN) (segid "   A" and resid   79 and name   HN)
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   66 and name   HN) 3.130 1.224 1.224 weight 1.000 ! spec=2D_NOESY, no=1173, id=1108, vol=2.660000e+07
    or (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   71 and name   HN)
assign (segid "   A" and resid   29 and name   HN) (segid "   A" and resid   30 and name   HN) 4.470 2.498 2.498 weight 1.000 ! spec=2D_NOESY, no=1199, id=1134, vol=3.760000e+06
    or (segid "   A" and resid   89 and name  HD1) (segid "   A" and resid   21 and name   HN)
assign (segid "   A" and resid   84 and name  HD1) (segid "   A" and resid   84 and name  HE1) 2.835 1.005 1.005 weight 1.000 ! spec=2D_NOESY, no=1235, id=1169, vol=6.980000e+07
    or (segid "   A" and resid  112 and name  HE1) (segid "   A" and resid  112 and name  HD1)
assign (segid "   A" and resid   29 and name HE22) (segid "   A" and resid   29 and name HE21) 2.061 0.531 0.531 weight 1.000 ! spec=2D_NOESY, no=1244, id=1178, vol=4.180000e+07
    or (segid "   A" and resid   52 and name HE22) (segid "   A" and resid   52 and name HE21)
assign (segid "   A" and resid   25 and name  HD1) (segid "   A" and resid   22 and name   HN) 3.682 1.694 1.694 weight 1.000 ! spec=2D_NOESY, no=1320, id=1241, vol=9.760000e+06
    or (segid "   A" and resid   71 and name   HZ) (segid "   A" and resid   22 and name   HN)
assign (segid "   A" and resid   89 and name  HD1) (segid "   A" and resid   21 and name   HN) 4.011 2.011 2.011 weight 1.000 ! spec=2D_NOESY, no=1323, id=1244, vol=4.510000e+06
    or (segid "   A" and resid   87 and name   HN) (segid "   A" and resid   85 and name   HN)
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   12 and name   HN) 3.896 1.897 1.897 weight 1.000 ! spec=2D_NOESY, no=1353, id=1274, vol=5.820000e+06
    or (segid "   A" and resid  103 and name   HN) (segid "   A" and resid   19 and name   HN)
    or (segid "   A" and resid  104 and name   HN) (segid "   A" and resid   19 and name   HN)
assign (segid "   A" and resid   96 and name   HN) (segid "   A" and resid   97 and name   HN) 1.892 0.448 0.448 weight 1.000 ! spec=2D_NOESY, no=1373, id=1294, vol=6.480000e+07
    or (segid "   A" and resid  102 and name   HN) (segid "   A" and resid  101 and name   HN)
assign (segid "   A" and resid   86 and name   HN) (segid "   A" and resid   83 and name   HN) 3.456 1.493 1.493 weight 1.000 ! spec=2D_NOESY, no=1381, id=1302, vol=9.600000e+06
    or (segid "   A" and resid   33 and name   HN) (segid "   A" and resid   26 and name   HN)
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   15 and name   HN) 3.718 1.728 1.728 weight 1.000 ! spec=2D_NOESY, no=1384, id=1305, vol=4.770000e+06
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   25 and name   HN)
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   21 and name   HN) 2.991 1.118 1.118 weight 1.000 ! spec=2D_NOESY, no=1385, id=1306, vol=1.920000e+07
    or (segid "   A" and resid   28 and name   HN) (segid "   A" and resid   25 and name   HN)
assign (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   53 and name HD22) 4.291 2.301 2.301 weight 1.000 ! spec=2D_NOESY, no=1391, id=1312, vol=2.810000e+06
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   34 and name   HA) (segid "   A" and resid   53 and name HD23)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   75 and name HG12)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   22 and name  HE1) 2.633 0.867 0.867 weight 1.000 ! spec=2D_NOESY, no=1409, id=1329, vol=1.070000e+08
    or (segid "   A" and resid   66 and name  HD1) (segid "   A" and resid   71 and name  HE1)
assign (segid "   A" and resid   71 and name  HD1) (segid "   A" and resid   22 and name  HE1) 2.338 0.683 0.683 weight 1.000 ! spec=2D_NOESY, no=1410, id=1330, vol=1.120000e+08
    or (segid "   A" and resid   54 and name HE22) (segid "   A" and resid   50 and name  HZ3)
assign (segid "   A" and resid   54 and name HE22) (segid "   A" and resid   50 and name  HZ3) 2.161 0.584 0.584 weight 1.000 ! spec=2D_NOESY, no=1411, id=1331, vol=9.720000e+07
    or (segid "   A" and resid   39 and name HE22) (segid "   A" and resid   71 and name   HZ)
assign (segid "   A" and resid   72 and name  HD1) (segid "   A" and resid   72 and name  HE1) 2.697 0.909 0.909 weight 1.000 ! spec=2D_NOESY, no=1426, id=1346, vol=9.250000e+07
    or (segid "   A" and resid   84 and name  HD1) (segid "   A" and resid   84 and name  HE1)
assign (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   72 and name  HD1) 4.346 2.361 2.361 weight 1.000 ! spec=2D_NOESY, no=1429, id=1349, vol=5.280000e+06
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   80 and name HE21)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name HE21) 4.422 2.444 2.444 weight 1.000 ! spec=2D_NOESY, no=1440, id=1360, vol=6.640000e+06
    or (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   89 and name  HD1)
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   17 and name   HN) 2.611 0.852 0.852 weight 1.000 ! spec=2D_NOESY, no=1448, id=1368, vol=1.970000e+07
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name   HN) 2.444 0.747 0.747 weight 1.000 ! spec=2D_NOESY, no=1449, id=1369, vol=3.530000e+07
    or (segid "   A" and resid   77 and name   HN) (segid "   A" and resid   76 and name   HN)
assign (segid "   A" and resid   45 and name   HA) (segid "   A" and resid   44 and name   HA) 3.011 1.133 1.133 weight 1.000 ! spec=2D_NOESY, no=1462, id=1382, vol=1.380000e+07
    or (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   28 and name  HA2)
assign (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   67 and name  HB1) 4.165 2.169 2.169 weight 1.000 ! spec=2D_NOESY, no=1464, id=1384, vol=4.570000e+06
    or (segid "   A" and resid   33 and name   HB) (segid "   A" and resid   64 and name  HB1)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name  HB2) 6.646 5.521 5.521 weight 1.000 ! spec=2D_NOESY, no=1471, id=1391, vol=5.690000e+05
    or (segid "   A" and resid   30 and name   HA) (segid "   A" and resid   68 and name   HA)
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   12 and name  HB1) 7.221 6.518 6.518 weight 1.000 ! spec=2D_NOESY, no=1472, id=1392, vol=2.690000e+05
    or (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   71 and name  HB1)
assign (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name  HB2) 4.656 2.710 2.710 weight 1.000 ! spec=2D_NOESY, no=1476, id=1396, vol=6.020000e+05
    or (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name  HB1)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HG2) 3.830 1.833 1.833 weight 1.000 ! spec=2D_NOESY, no=1480, id=1400, vol=4.800000e+06
    or (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   67 and name  HB1)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   40 and name  HB1) 3.837 1.840 1.840 weight 1.000 ! spec=2D_NOESY, no=1481, id=1401, vol=5.550000e+06
    or (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   62 and name  HB2)
    or (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   62 and name  HB1)
    or (segid "   A" and resid   66 and name   HA) (segid "   A" and resid   62 and name  HB3)
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   21 and name  HB2)
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   21 and name  HB3)
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name  HB1) 3.883 1.885 1.885 weight 1.000 ! spec=2D_NOESY, no=1492, id=1412, vol=2.170000e+06
    or (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HB2)
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   46 and name  HB2) 2.670 0.891 0.891 weight 1.000 ! spec=2D_NOESY, no=1493, id=1413, vol=2.170000e+07
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name  HB2)
assign (segid "   A" and resid   46 and name   HA) (segid "   A" and resid   45 and name  HB2) 2.971 1.104 1.104 weight 1.000 ! spec=2D_NOESY, no=1496, id=1416, vol=2.860000e+07
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   91 and name  HB2)
assign (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG21) 2.620 0.858 0.858 weight 1.000 ! spec=2D_NOESY, no=1500, id=1420, vol=2.040000e+07
    or (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   20 and name   HB) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name  HB2)
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name  HB1)
    or (segid "   A" and resid   92 and name   HA) (segid "   A" and resid   92 and name  HB3)
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HG2) 4.206 2.211 2.211 weight 1.000 ! spec=2D_NOESY, no=1503, id=1423, vol=2.290000e+06
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name  HB1)
assign (segid "   A" and resid   36 and name   HA) (segid "   A" and resid   39 and name  HB2) 3.019 1.139 1.139 weight 1.000 ! spec=2D_NOESY, no=1504, id=1424, vol=9.200000e+06
    or (segid "   A" and resid   90 and name   HA) (segid "   A" and resid   90 and name  HB2)
assign (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HB2) 2.697 0.909 0.909 weight 1.000 ! spec=2D_NOESY, no=1505, id=1425, vol=3.050000e+07
    or (segid "   A" and resid    7 and name   HA) (segid "   A" and resid    7 and name  HB1)
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   17 and name  HB2) 4.319 2.332 2.332 weight 1.000 ! spec=2D_NOESY, no=1523, id=1443, vol=2.290000e+06
    or (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name  HG2)
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid   79 and name  HB2) 3.890 1.891 1.891 weight 1.000 ! spec=2D_NOESY, no=1530, id=1450, vol=8.280000e+06
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   18 and name HG12)
    or (segid "   A" and resid   33 and name   HA) (segid "   A" and resid   34 and name  HB2)
assign (segid "   A" and resid   93 and name   HA) (segid "   A" and resid   93 and name  HB1) 3.139 1.232 1.232 weight 1.000 ! spec=2D_NOESY, no=1534, id=1454, vol=8.380000e+06
    or (segid "   A" and resid   99 and name   HA) (segid "   A" and resid   99 and name  HB1)
assign (segid "   A" and resid    9 and name   HA) (segid "   A" and resid    9 and name  HE2) 4.396 2.416 2.416 weight 1.000 ! spec=2D_NOESY, no=1535, id=1455, vol=3.450000e+06
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   91 and name  HB2)
assign (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HB2) 5.996 4.493 4.493 weight 1.000 ! spec=2D_NOESY, no=1542, id=1462, vol=1.910000e+05
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   17 and name  HB2)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name  HB1) 3.946 1.946 1.946 weight 1.000 ! spec=2D_NOESY, no=1543, id=1463, vol=2.510000e+06
    or (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HB1)
assign (segid "   A" and resid   48 and name   HA) (segid "   A" and resid   48 and name  HB1) 3.277 1.342 1.342 weight 1.000 ! spec=2D_NOESY, no=1544, id=1464, vol=6.630000e+06
    or (segid "   A" and resid  106 and name   HA) (segid "   A" and resid  106 and name  HB2)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   38 and name  HB2) 2.707 0.916 0.916 weight 1.000 ! spec=2D_NOESY, no=1550, id=1470, vol=1.810000e+07
    or (segid "   A" and resid   81 and name   HA) (segid "   A" and resid   81 and name  HB1)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name  HB2) 2.545 0.810 0.810 weight 1.000 ! spec=2D_NOESY, no=1552, id=1472, vol=2.980000e+07
    or (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  105 and name  HB2)
assign (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HG2) 3.639 1.655 1.655 weight 1.000 ! spec=2D_NOESY, no=1554, id=1474, vol=4.710000e+06
    or (segid "   A" and resid  107 and name   HA) (segid "   A" and resid  107 and name  HB2)
    or (segid "   A" and resid  109 and name   HA) (segid "   A" and resid  109 and name  HG2)
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   94 and name  HB2) 2.948 1.086 1.086 weight 1.000 ! spec=2D_NOESY, no=1555, id=1475, vol=1.250000e+07
    or (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HB2)
    or (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name  HB2)
assign (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   60 and name  HB2) 3.571 1.594 1.594 weight 1.000 ! spec=2D_NOESY, no=1556, id=1476, vol=5.310000e+06
    or (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   97 and name  HB2)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  101 and name   HB)
    or (segid "   A" and resid  104 and name   HA) (segid "   A" and resid  101 and name   HB)
    or (segid "   A" and resid  105 and name   HA) (segid "   A" and resid  101 and name   HB)
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   20 and name HG21) 4.135 2.137 2.137 weight 1.000 ! spec=2D_NOESY, no=1557, id=1477, vol=1.530000e+06
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  103 and name   HA) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   95 and name  HB1) 3.070 1.178 1.178 weight 1.000 ! spec=2D_NOESY, no=1560, id=1480, vol=1.090000e+07
    or (segid "   A" and resid   96 and name   HA) (segid "   A" and resid   96 and name  HB1)
    or (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name  HB1)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name HG22) 4.168 2.172 2.172 weight 1.000 ! spec=2D_NOESY, no=1564, id=1484, vol=3.130000e+06
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name HG22) 3.467 1.502 1.502 weight 1.000 ! spec=2D_NOESY, no=1566, id=1486, vol=7.070000e+06
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   38 and name   HA) (segid "   A" and resid   37 and name HG23)
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name HD22)
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   46 and name  HD1) 4.654 2.708 2.708 weight 1.000 ! spec=2D_NOESY, no=1568, id=1488, vol=1.460000e+06
    or (segid "   A" and resid   69 and name  HB2) (segid "   A" and resid   72 and name  HB2)
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   23 and name   HA) 4.713 2.777 2.777 weight 1.000 ! spec=2D_NOESY, no=1569, id=1489, vol=1.360000e+06
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   41 and name   HA)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   43 and name  HA1)
    or (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   51 and name   HA)
assign (segid "   A" and resid   97 and name   HA) (segid "   A" and resid   97 and name  HB2) 3.400 1.445 1.445 weight 1.000 ! spec=2D_NOESY, no=1570, id=1490, vol=6.300000e+06
    or (segid "   A" and resid  101 and name   HA) (segid "   A" and resid  101 and name   HB)
assign (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   48 and name HD12) 3.861 1.864 1.864 weight 1.000 ! spec=2D_NOESY, no=1579, id=1499, vol=3.210000e+06
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   48 and name HD11)
    or (segid "   A" and resid   42 and name   HA) (segid "   A" and resid   48 and name HD13)
    or (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   74 and name HD12)
    or (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   27 and name  HB2) 4.567 2.607 2.607 weight 1.000 ! spec=2D_NOESY, no=1580, id=1500, vol=3.710000e+06
    or (segid "   A" and resid   35 and name   HA) (segid "   A" and resid   34 and name  HB2)
assign (segid "   A" and resid   11 and name  HB1) (segid "   A" and resid   14 and name  HB1) 4.022 2.022 2.022 weight 1.000 ! spec=2D_NOESY, no=1583, id=1503, vol=4.870000e+06
    or (segid "   A" and resid   49 and name  HB1) (segid "   A" and resid   51 and name  HG2)
assign (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   70 and name  HB2) 2.646 0.875 0.875 weight 1.000 ! spec=2D_NOESY, no=1597, id=1517, vol=3.990000e+07
    or (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   73 and name  HB2) (segid "   A" and resid   70 and name  HB3)
    or (segid "   A" and resid   81 and name  HB2) (segid "   A" and resid   75 and name   HB)
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name  HG2)
assign (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   58 and name  HB2) 2.219 0.616 0.616 weight 1.000 ! spec=2D_NOESY, no=1600, id=1520, vol=6.360000e+07
    or (segid "   A" and resid   83 and name   HA) (segid "   A" and resid   83 and name  HB2)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG12) 3.999 1.999 1.999 weight 1.000 ! spec=2D_NOESY, no=1602, id=1522, vol=2.570000e+06
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   86 and name   HA) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB2) 2.267 0.642 0.642 weight 1.000 ! spec=2D_NOESY, no=1605, id=1525, vol=6.830000e+07
    or (segid "   A" and resid    8 and name   HA) (segid "   A" and resid    8 and name   HB)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name  HB2) 2.293 0.657 0.657 weight 1.000 ! spec=2D_NOESY, no=1611, id=1531, vol=4.470000e+07
    or (segid "   A" and resid   58 and name   HA) (segid "   A" and resid   58 and name  HB2)
assign (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG12) 3.224 1.299 1.299 weight 1.000 ! spec=2D_NOESY, no=1612, id=1532, vol=6.360000e+06
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   37 and name HD12) 4.112 2.113 2.113 weight 1.000 ! spec=2D_NOESY, no=1616, id=1536, vol=3.440000e+06
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   37 and name HD13)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   74 and name HD22)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   74 and name HD21)
    or (segid "   A" and resid   71 and name   HA) (segid "   A" and resid   74 and name HD23)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HG2) 2.695 0.908 0.908 weight 1.000 ! spec=2D_NOESY, no=1618, id=1538, vol=2.870000e+07
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   79 and name  HG2)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   27 and name  HB2) 2.392 0.715 0.715 weight 1.000 ! spec=2D_NOESY, no=1619, id=1539, vol=4.260000e+07
    or (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name  HG2)
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid    9 and name  HB2) 2.598 0.844 0.844 weight 1.000 ! spec=2D_NOESY, no=1621, id=1541, vol=2.900000e+07
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB1)
assign (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB1) 2.319 0.672 0.672 weight 1.000 ! spec=2D_NOESY, no=1622, id=1542, vol=7.450000e+07
    or (segid "   A" and resid   87 and name   HA) (segid "   A" and resid   87 and name  HB2)
assign (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   33 and name HG21) 3.189 1.272 1.272 weight 1.000 ! spec=2D_NOESY, no=1623, id=1543, vol=2.440000e+07
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   27 and name   HA) (segid "   A" and resid   33 and name HG23)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG21)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   32 and name   HA) (segid "   A" and resid   33 and name HG23)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD12) 2.640 0.871 0.871 weight 1.000 ! spec=2D_NOESY, no=1628, id=1548, vol=2.840000e+07
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid    8 and name HG12)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid    8 and name HG11)
    or (segid "   A" and resid   76 and name   HA) (segid "   A" and resid    8 and name HG13)
assign (segid "   A" and resid   52 and name   HA) (segid "   A" and resid   55 and name  HG1) 2.279 0.649 0.649 weight 1.000 ! spec=2D_NOESY, no=1631, id=1551, vol=5.990000e+07
    or (segid "   A" and resid   56 and name   HA) (segid "   A" and resid   56 and name  HB2)
assign (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG12) 2.948 1.087 1.087 weight 1.000 ! spec=2D_NOESY, no=1633, id=1553, vol=1.160000e+07
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   79 and name   HA) (segid "   A" and resid   82 and name HG13)
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   39 and name   HA) (segid "   A" and resid   39 and name  HB2) 2.213 0.612 0.612 weight 1.000 ! spec=2D_NOESY, no=1634, id=1554, vol=8.620000e+07
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HB1) 2.099 0.551 0.551 weight 1.000 ! spec=2D_NOESY, no=1635, id=1555, vol=7.810000e+07
    or (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name  HB2)
assign (segid "   A" and resid   40 and name   HA) (segid "   A" and resid   40 and name  HB2) 2.039 0.520 0.520 weight 1.000 ! spec=2D_NOESY, no=1639, id=1559, vol=5.610000e+07
    or (segid "   A" and resid   55 and name   HA) (segid "   A" and resid   58 and name  HB2)
assign (segid "   A" and resid   76 and name   HA) (segid "   A" and resid   75 and name   HB) 4.192 2.197 2.197 weight 1.000 ! spec=2D_NOESY, no=1655, id=1575, vol=3.320000e+06
    or (segid "   A" and resid   85 and name   HA) (segid "   A" and resid   87 and name  HB2)
    or (segid "   A" and resid  111 and name  HA1) (segid "   A" and resid  110 and name  HB2)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   14 and name  HB1) 3.152 1.242 1.242 weight 1.000 ! spec=2D_NOESY, no=1656, id=1576, vol=1.490000e+07
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   16 and name  HB2)
assign (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   14 and name  HB1) 3.550 1.575 1.575 weight 1.000 ! spec=2D_NOESY, no=1663, id=1583, vol=5.800000e+06
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   27 and name  HG2)
assign (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name  HB2) 2.715 0.921 0.921 weight 1.000 ! spec=2D_NOESY, no=1668, id=1588, vol=1.650000e+07
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name HD12)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   15 and name   HA) (segid "   A" and resid   18 and name HD13)
assign (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG21) 4.421 2.443 2.443 weight 1.000 ! spec=2D_NOESY, no=1669, id=1589, vol=1.880000e+06
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   20 and name   HA) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   33 and name HG21)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   33 and name HG22)
    or (segid "   A" and resid   26 and name   HA) (segid "   A" and resid   33 and name HG23)
assign (segid "   A" and resid   93 and name  HD2) (segid "   A" and resid   93 and name  HB1) 3.221 1.297 1.297 weight 1.000 ! spec=2D_NOESY, no=1679, id=1599, vol=1.820000e+07
    or (segid "   A" and resid   99 and name  HD2) (segid "   A" and resid   99 and name  HB1)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   48 and name  HB1) 2.714 0.921 0.921 weight 1.000 ! spec=2D_NOESY, no=1686, id=1606, vol=1.450000e+07
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   75 and name   HB)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   56 and name  HB2) 1.955 0.478 0.478 weight 1.000 ! spec=2D_NOESY, no=1687, id=1607, vol=9.030000e+07
    or (segid "   A" and resid   93 and name  HD2) (segid "   A" and resid   93 and name  HG2)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD22) 3.402 1.447 1.447 weight 1.000 ! spec=2D_NOESY, no=1693, id=1613, vol=5.660000e+06
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   53 and name HD23)
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   18 and name HG22)
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   72 and name   HA) (segid "   A" and resid   18 and name HG23)
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   17 and name  HB2) 2.518 0.793 0.793 weight 1.000 ! spec=2D_NOESY, no=1709, id=1629, vol=2.290000e+07
    or (segid "   A" and resid   51 and name   HA) (segid "   A" and resid   51 and name  HB2)
assign (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   86 and name  HB2) 2.766 0.956 0.956 weight 1.000 ! spec=2D_NOESY, no=1715, id=1635, vol=3.550000e+07
    or (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   17 and name  HD2) (segid "   A" and resid   86 and name  HB3)
    or (segid "   A" and resid   54 and name   HA) (segid "   A" and resid   54 and name  HG2)
assign (segid "   A" and resid   90 and name  HD1) (segid "   A" and resid   90 and name  HG2) 2.170 0.588 0.588 weight 1.000 ! spec=2D_NOESY, no=1717, id=1637, vol=7.850000e+07
    or (segid "   A" and resid   99 and name  HD1) (segid "   A" and resid   99 and name  HG2)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   21 and name  HB2) 2.844 1.011 1.011 weight 1.000 ! spec=2D_NOESY, no=1727, id=1647, vol=1.400000e+07
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   21 and name  HB1)
    or (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   21 and name  HB3)
    or (segid "   A" and resid   37 and name   HA) (segid "   A" and resid   40 and name  HB1)
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   18 and name   HB) 3.373 1.423 1.423 weight 1.000 ! spec=2D_NOESY, no=1729, id=1649, vol=6.560000e+06
    or (segid "   A" and resid   93 and name  HD1) (segid "   A" and resid   93 and name  HB1)
assign (segid "   A" and resid   28 and name  HA2) (segid "   A" and resid   23 and name  HB2) 2.839 1.008 1.008 weight 1.000 ! spec=2D_NOESY, no=1733, id=1653, vol=2.050000e+07
    or (segid "   A" and resid   93 and name  HD1) (segid "   A" and resid   93 and name  HB1)
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   76 and name  HB2) 3.605 1.624 1.624 weight 1.000 ! spec=2D_NOESY, no=1772, id=1692, vol=6.820000e+06
    or (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   43 and name  HA2) (segid "   A" and resid   40 and name   HG)
assign (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   40 and name HD12) 3.781 1.787 1.787 weight 1.000 ! spec=2D_NOESY, no=1777, id=1697, vol=5.740000e+06
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   40 and name HD13)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   18 and name HG22) 3.653 1.668 1.668 weight 1.000 ! spec=2D_NOESY, no=1778, id=1698, vol=4.300000e+06
    or (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   18 and name HG21)
    or (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   18 and name HG23)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   74 and name HD12)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   76 and name  HB2) 4.210 2.216 2.216 weight 1.000 ! spec=2D_NOESY, no=1781, id=1701, vol=2.660000e+06
    or (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   72 and name  HB1) (segid "   A" and resid   76 and name  HB3)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB2)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB1)
    or (segid "   A" and resid   75 and name   HA) (segid "   A" and resid   76 and name  HB3)
assign (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   26 and name  HB2) 3.244 1.315 1.315 weight 1.000 ! spec=2D_NOESY, no=1795, id=1715, vol=1.140000e+07
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   26 and name  HB1)
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   26 and name  HB3)
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD22)
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   48 and name HD23)
assign (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD12) 3.399 1.444 1.444 weight 1.000 ! spec=2D_NOESY, no=1803, id=1723, vol=6.240000e+06
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD11)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD13)
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   41 and name HG22) 3.216 1.293 1.293 weight 1.000 ! spec=2D_NOESY, no=1806, id=1726, vol=9.310000e+06
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD22)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD21)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD23)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD12)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD11)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD13)
assign (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   41 and name HG22) 3.162 1.250 1.250 weight 1.000 ! spec=2D_NOESY, no=1813, id=1733, vol=1.340000e+07
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   56 and name  HE2) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD22)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD21)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD23)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD12)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD11)
    or (segid "   A" and resid   68 and name  HD2) (segid "   A" and resid   23 and name HD13)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   20 and name HG21) 3.842 1.845 1.845 weight 1.000 ! spec=2D_NOESY, no=1822, id=1742, vol=2.560000e+06
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   30 and name  HB2) (segid "   A" and resid   31 and name  HG2)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   37 and name HD12) 3.891 1.893 1.893 weight 1.000 ! spec=2D_NOESY, no=1825, id=1745, vol=4.280000e+06
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   37 and name HD11)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   37 and name HD13)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   74 and name HD22)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   74 and name HD21)
    or (segid "   A" and resid   78 and name  HB2) (segid "   A" and resid   74 and name HD23)
assign (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   53 and name HD12) 4.004 2.004 2.004 weight 1.000 ! spec=2D_NOESY, no=1831, id=1751, vol=3.740000e+06
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   57 and name  HE1) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   75 and name   HB) 3.278 1.343 1.343 weight 1.000 ! spec=2D_NOESY, no=1844, id=1764, vol=1.010000e+07
    or (segid "   A" and resid  105 and name  HG2) (segid "   A" and resid  106 and name  HB2)
    or (segid "   A" and resid  107 and name  HB2) (segid "   A" and resid  106 and name  HB2)
    or (segid "   A" and resid   16 and name  HG2) (segid "   A" and resid  104 and name   HG)
assign (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG22) 2.094 0.548 0.548 weight 1.000 ! spec=2D_NOESY, no=1857, id=1777, vol=6.180000e+07
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG21)
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG23)
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG12)
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG11)
    or (segid "   A" and resid    8 and name   HB) (segid "   A" and resid    8 and name HG13)
assign (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   86 and name  HB2) 2.742 0.940 0.940 weight 1.000 ! spec=2D_NOESY, no=1859, id=1779, vol=5.140000e+07
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   86 and name  HB1)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   86 and name  HB3)
    or (segid "   A" and resid   55 and name  HB2) (segid "   A" and resid   54 and name  HG2)
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name  HG2) 2.139 0.572 0.572 weight 1.000 ! spec=2D_NOESY, no=1887, id=1807, vol=5.180000e+07
    or (segid "   A" and resid   58 and name  HB2) (segid "   A" and resid   58 and name  HG2)
assign (segid "   A" and resid   97 and name  HB2) (segid "   A" and resid   97 and name  HG2) 2.079 0.540 0.540 weight 1.000 ! spec=2D_NOESY, no=1894, id=1814, vol=8.670000e+07
    or (segid "   A" and resid  101 and name   HB) (segid "   A" and resid  101 and name HG11)
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   53 and name HD12) 2.513 0.790 0.790 weight 1.000 ! spec=2D_NOESY, no=1914, id=1834, vol=2.520000e+07
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name HD22)
    or (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name HD21)
    or (segid "   A" and resid  104 and name  HB2) (segid "   A" and resid  104 and name HD23)
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   57 and name  HD2) 2.343 0.686 0.686 weight 1.000 ! spec=2D_NOESY, no=1921, id=1841, vol=6.000000e+07
    or (segid "   A" and resid   56 and name  HB1) (segid "   A" and resid   57 and name  HD2)
assign (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   56 and name  HB1) 3.047 1.161 1.161 weight 1.000 ! spec=2D_NOESY, no=1924, id=1844, vol=2.810000e+07
    or (segid "   A" and resid   83 and name  HB2) (segid "   A" and resid    9 and name  HB2)
assign (segid "   A" and resid   55 and name  HG2) (segid "   A" and resid   55 and name  HG1) 1.947 0.474 0.474 weight 1.000 ! spec=2D_NOESY, no=1929, id=1849, vol=8.580000e+07
    or (segid "   A" and resid   95 and name  HG2) (segid "   A" and resid   95 and name  HB2)
assign (segid "   A" and resid   64 and name  HB1) (segid "   A" and resid   34 and name  HG2) 4.444 2.468 2.468 weight 1.000 ! spec=2D_NOESY, no=1949, id=1869, vol=3.170000e+06
    or (segid "   A" and resid  102 and name  HB2) (segid "   A" and resid   16 and name  HG2)
    or (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   36 and name  HB2)
assign (segid "   A" and resid   45 and name  HB2) (segid "   A" and resid   45 and name  HB1) 1.373 0.236 0.236 weight 1.000 ! spec=2D_NOESY, no=1971, id=1891, vol=3.830000e+08
    or (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   91 and name  HB1)
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   90 and name  HB2) 4.726 2.792 2.792 weight 1.000 ! spec=2D_NOESY, no=1991, id=1911, vol=3.960000e+06
    or (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   16 and name  HG2)
    or (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   25 and name  HB2)
assign (segid "   A" and resid   91 and name  HB2) (segid "   A" and resid   13 and name  HB2) 2.795 0.977 0.977 weight 1.000 ! spec=2D_NOESY, no=2002, id=1922, vol=5.780000e+06
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   36 and name  HG2) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   38 and name  HB2) 3.740 1.749 1.749 weight 1.000 ! spec=2D_NOESY, no=2033, id=1953, vol=4.130000e+06
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name   HB)
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   70 and name  HB2) 3.475 1.509 1.509 weight 1.000 ! spec=2D_NOESY, no=2039, id=1959, vol=4.930000e+06
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   70 and name  HB1)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   70 and name  HB3)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   75 and name   HB)
assign (segid "   A" and resid   31 and name  HD2) (segid "   A" and resid   66 and name  HB2) 3.957 1.957 1.957 weight 1.000 ! spec=2D_NOESY, no=2040, id=1960, vol=5.600000e+06
    or (segid "   A" and resid   70 and name  HB2) (segid "   A" and resid   66 and name  HB2)
    or (segid "   A" and resid   70 and name  HB1) (segid "   A" and resid   66 and name  HB2)
    or (segid "   A" and resid   70 and name  HB3) (segid "   A" and resid   66 and name  HB2)
    or (segid "   A" and resid   87 and name  HB2) (segid "   A" and resid   84 and name  HB2)
assign (segid "   A" and resid   53 and name   HA) (segid "   A" and resid   57 and name  HG2) 4.146 2.149 2.149 weight 1.000 ! spec=2D_NOESY, no=2061, id=1981, vol=4.980000e+06
    or (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   61 and name  HB2)
    or (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   61 and name  HB1)
    or (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   61 and name  HB3)
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   20 and name HG21) 3.366 1.416 1.416 weight 1.000 ! spec=2D_NOESY, no=2063, id=1983, vol=9.690000e+06
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   31 and name  HE2) (segid "   A" and resid   31 and name  HG2)
assign (segid "   A" and resid   40 and name  HB1) (segid "   A" and resid   43 and name  HA2) 3.522 1.551 1.551 weight 1.000 ! spec=2D_NOESY, no=2077, id=1997, vol=8.770000e+06
    or (segid "   A" and resid   62 and name  HB2) (segid "   A" and resid   60 and name  HD2)
    or (segid "   A" and resid   62 and name  HB1) (segid "   A" and resid   60 and name  HD2)
    or (segid "   A" and resid   62 and name  HB3) (segid "   A" and resid   60 and name  HD2)
assign (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   10 and name HG22) 3.418 1.461 1.461 weight 1.000 ! spec=2D_NOESY, no=2081, id=2001, vol=1.240000e+07
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   14 and name  HB2) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   23 and name HD22)
    or (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   23 and name HD21)
    or (segid "   A" and resid   68 and name   HA) (segid "   A" and resid   23 and name HD23)
assign (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   32 and name HG12) 9.193 9.193 10.565 weight 1.000 ! spec=2D_NOESY, no=2083, id=2003, vol=3.590000e+04
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   66 and name  HB1) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   81 and name  HB1) (segid "   A" and resid   82 and name HG13)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   21 and name   HA) (segid "   A" and resid   85 and name HG23)
assign (segid "   A" and resid   66 and name  HB2) (segid "   A" and resid   67 and name  HB1) 3.631 1.648 1.648 weight 1.000 ! spec=2D_NOESY, no=2140, id=2057, vol=1.050000e+07
    or (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   91 and name  HB1)
assign (segid "   A" and resid   22 and name   HA) (segid "   A" and resid   71 and name  HB1) 5.016 3.145 3.145 weight 1.000 ! spec=2D_NOESY, no=2142, id=2058, vol=2.450000e+06
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   60 and name  HD2)
    or (segid "   A" and resid   67 and name  HB1) (segid "   A" and resid   71 and name  HB1)
assign (segid "   A" and resid   65 and name  HA2) (segid "   A" and resid   64 and name  HB1) 3.988 1.988 1.988 weight 1.000 ! spec=2D_NOESY, no=2144, id=2060, vol=4.660000e+06
    or (segid "   A" and resid   23 and name   HA) (segid "   A" and resid   22 and name   HA)
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   57 and name  HD2) 3.044 1.158 1.158 weight 1.000 ! spec=2D_NOESY, no=2163, id=2078, vol=2.760000e+07
    or (segid "   A" and resid  105 and name  HB2) (segid "   A" and resid  106 and name  HB2)
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name  HB1) 1.469 0.270 0.270 weight 1.000 ! spec=2D_NOESY, no=2166, id=2081, vol=2.540000e+08
    or (segid "   A" and resid   57 and name  HB2) (segid "   A" and resid   57 and name  HB1)
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   31 and name  HG2) 3.633 1.649 1.649 weight 1.000 ! spec=2D_NOESY, no=2171, id=2086, vol=7.560000e+06
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   35 and name  HB2)
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   35 and name  HB1)
    or (segid "   A" and resid   38 and name  HB1) (segid "   A" and resid   35 and name  HB3)
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   57 and name  HG2) 3.458 1.495 1.495 weight 1.000 ! spec=2D_NOESY, no=2175, id=2090, vol=8.030000e+06
    or (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   92 and name  HB2)
    or (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   92 and name  HB1)
    or (segid "   A" and resid   93 and name  HG2) (segid "   A" and resid   92 and name  HB3)
assign (segid "   A" and resid   33 and name HG21) (segid "   A" and resid   27 and name  HB2) 4.179 2.184 2.184 weight 1.000 ! spec=2D_NOESY, no=2176, id=2091, vol=5.350000e+06
    or (segid "   A" and resid   33 and name HG22) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   33 and name HG23) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   34 and name  HB2)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   34 and name  HB2)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   34 and name  HB2)
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   53 and name   HG) 4.041 2.042 2.042 weight 1.000 ! spec=2D_NOESY, no=2180, id=2095, vol=3.650000e+06
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   57 and name  HG1)
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   53 and name   HG) 4.080 2.080 2.080 weight 1.000 ! spec=2D_NOESY, no=2183, id=2098, vol=2.520000e+06
    or (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   21 and name  HB2) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   21 and name  HB1) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   36 and name  HE2)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   21 and name  HB3) (segid "   A" and resid   36 and name  HE3)
assign (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG22) 1.787 0.399 0.399 weight 1.000 ! spec=2D_NOESY, no=2187, id=2102, vol=1.450000e+08
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG21)
    or (segid "   A" and resid   10 and name   HB) (segid "   A" and resid   10 and name HG23)
    or (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD22)
    or (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD21)
    or (segid "   A" and resid   23 and name   HG) (segid "   A" and resid   23 and name HD23)
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   32 and name   HB) (segid "   A" and resid   32 and name HG13)
assign (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   32 and name HG12) 2.579 0.832 0.832 weight 1.000 ! spec=2D_NOESY, no=2188, id=2103, vol=3.030000e+07
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   32 and name HG12)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   85 and name HG22)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   85 and name HG21)
    or (segid "   A" and resid   17 and name  HB2) (segid "   A" and resid   85 and name HG23)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   36 and name  HE2) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   36 and name  HE1) (segid "   A" and resid   85 and name HD13)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   85 and name HD12)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   85 and name HD11)
    or (segid "   A" and resid   36 and name  HE3) (segid "   A" and resid   85 and name HD13)
assign (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   82 and name HG22) 3.334 1.389 1.389 weight 1.000 ! spec=2D_NOESY, no=2189, id=2104, vol=1.430000e+07
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   14 and name  HB1) (segid "   A" and resid   82 and name HG23)
    or (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   82 and name HG22)
    or (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   79 and name  HG2) (segid "   A" and resid   82 and name HG23)
assign (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG22) 1.943 0.472 0.472 weight 1.000 ! spec=2D_NOESY, no=2190, id=2105, vol=7.080000e+07
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG21)
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG23)
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG12)
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG11)
    or (segid "   A" and resid   82 and name   HB) (segid "   A" and resid   82 and name HG13)
assign (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   41 and name HD12) 2.558 0.818 0.818 weight 1.000 ! spec=2D_NOESY, no=2207, id=2122, vol=3.470000e+07
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   53 and name HD22)
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   56 and name  HB2) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD22) 2.820 0.994 0.994 weight 1.000 ! spec=2D_NOESY, no=2208, id=2123, vol=3.230000e+07
    or (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD21)
    or (segid "   A" and resid   48 and name  HB2) (segid "   A" and resid   48 and name HD23)
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name HD22)
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   53 and name  HB2) (segid "   A" and resid   53 and name HD23)
assign (segid "   A" and resid   26 and name  HB2) (segid "   A" and resid   27 and name  HB2) 3.411 1.454 1.454 weight 1.000 ! spec=2D_NOESY, no=2209, id=2124, vol=1.520000e+07
    or (segid "   A" and resid   26 and name  HB1) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   26 and name  HB3) (segid "   A" and resid   27 and name  HB2)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG12)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   18 and name HG12) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   51 and name  HG2) (segid "   A" and resid   51 and name  HB1) 2.932 1.074 1.074 weight 1.000 ! spec=2D_NOESY, no=2213, id=2128, vol=1.550000e+07
    or (segid "   A" and resid    7 and name  HG1) (segid "   A" and resid    7 and name  HB1)
assign (segid "   A" and resid   36 and name  HB2) (segid "   A" and resid   36 and name  HB1) 1.077 0.145 0.145 weight 1.000 ! spec=2D_NOESY, no=2214, id=2129, vol=2.030000e+09
    or (segid "   A" and resid   46 and name  HB2) (segid "   A" and resid   46 and name  HB1)
    or (segid "   A" and resid   93 and name  HB2) (segid "   A" and resid   93 and name  HB1)
assign (segid "   A" and resid   94 and name  HG2) (segid "   A" and resid   94 and name  HB1) 2.495 0.778 0.778 weight 1.000 ! spec=2D_NOESY, no=2215, id=2130, vol=4.070000e+07
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name  HG2)
    or (segid "   A" and resid  109 and name  HB2) (segid "   A" and resid  109 and name  HG2)
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   36 and name  HE2) 2.528 0.799 0.799 weight 1.000 ! spec=2D_NOESY, no=2220, id=2135, vol=2.950000e+07
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   36 and name  HE1)
    or (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   36 and name  HE3)
    or (segid "   A" and resid   51 and name  HG2) (segid "   A" and resid   51 and name  HB2)
assign (segid "   A" and resid    7 and name  HG2) (segid "   A" and resid    7 and name  HB2) 2.264 0.641 0.641 weight 1.000 ! spec=2D_NOESY, no=2222, id=2137, vol=5.730000e+07
    or (segid "   A" and resid   51 and name  HG2) (segid "   A" and resid   51 and name  HB2)
assign (segid "   A" and resid   29 and name  HB2) (segid "   A" and resid   29 and name  HB1) 1.511 0.285 0.285 weight 1.000 ! spec=2D_NOESY, no=2224, id=2139, vol=2.300000e+08
    or (segid "   A" and resid   51 and name  HG2) (segid "   A" and resid   51 and name  HG1)
assign (segid "   A" and resid   51 and name  HB1) (segid "   A" and resid   51 and name  HB2) 1.220 0.186 0.186 weight 1.000 ! spec=2D_NOESY, no=2228, id=2143, vol=9.750000e+08
    or (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   95 and name  HB2)
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  105 and name  HB2)
assign (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   32 and name HG12) 1.561 0.305 0.305 weight 1.000 ! spec=2D_NOESY, no=2245, id=2160, vol=2.830000e+08
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   32 and name HG11)
    or (segid "   A" and resid   36 and name  HB1) (segid "   A" and resid   32 and name HG13)
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD12)
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD11)
    or (segid "   A" and resid   40 and name  HB2) (segid "   A" and resid   40 and name HD13)
assign (segid "   A" and resid   31 and name  HG2) (segid "   A" and resid   31 and name  HB2) 1.962 0.481 0.481 weight 1.000 ! spec=2D_NOESY, no=2249, id=2164, vol=7.600000e+07
    or (segid "   A" and resid   61 and name  HB2) (segid "   A" and resid   57 and name  HB1)
    or (segid "   A" and resid   61 and name  HB1) (segid "   A" and resid   57 and name  HB1)
    or (segid "   A" and resid   61 and name  HB3) (segid "   A" and resid   57 and name  HB1)
assign (segid "   A" and resid   53 and name   HG) (segid "   A" and resid   41 and name HG12) 2.716 0.922 0.922 weight 1.000 ! spec=2D_NOESY, no=2253, id=2168, vol=1.460000e+07
    or (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   53 and name   HG)
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG22) 2.494 0.778 0.778 weight 1.000 ! spec=2D_NOESY, no=2255, id=2170, vol=2.470000e+07
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HG23)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG22)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG21)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   41 and name HG23)
assign (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   53 and name HD12) 2.053 0.527 0.527 weight 1.000 ! spec=2D_NOESY, no=2261, id=2176, vol=7.460000e+07
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   41 and name   HB) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid  104 and name HD22) (segid "   A" and resid  104 and name   HG)
    or (segid "   A" and resid  104 and name HD21) (segid "   A" and resid  104 and name   HG)
    or (segid "   A" and resid  104 and name HD23) (segid "   A" and resid  104 and name   HG)
assign (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD12) 2.156 0.581 0.581 weight 1.000 ! spec=2D_NOESY, no=2270, id=2185, vol=5.170000e+07
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   41 and name HG12) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG22)
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG21)
    or (segid "   A" and resid   37 and name   HB) (segid "   A" and resid   37 and name HG23)
assign (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   53 and name HD22) 1.803 0.406 0.406 weight 1.000 ! spec=2D_NOESY, no=2272, id=2187, vol=1.330000e+08
    or (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   53 and name HD21)
    or (segid "   A" and resid   57 and name  HD2) (segid "   A" and resid   53 and name HD23)
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   75 and name HG12)
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   75 and name HG11)
    or (segid "   A" and resid   75 and name   HB) (segid "   A" and resid   75 and name HG13)
assign (segid "   A" and resid   23 and name HD12) (segid "   A" and resid   23 and name  HB1) 2.001 0.500 0.500 weight 1.000 ! spec=2D_NOESY, no=2279, id=2194, vol=9.770000e+07
    or (segid "   A" and resid   23 and name HD11) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   23 and name HD13) (segid "   A" and resid   23 and name  HB1)
    or (segid "   A" and resid   85 and name HD12) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   85 and name HD11) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   85 and name HD13) (segid "   A" and resid   85 and name HG12)
assign (segid "   A" and resid  106 and name HD22) (segid "   A" and resid  106 and name   HG) 2.095 0.549 0.549 weight 1.000 ! spec=2D_NOESY, no=2280, id=2195, vol=7.320000e+07
    or (segid "   A" and resid  106 and name HD21) (segid "   A" and resid  106 and name   HG)
    or (segid "   A" and resid  106 and name HD23) (segid "   A" and resid  106 and name   HG)
    or (segid "   A" and resid  106 and name   HG) (segid "   A" and resid  106 and name HD12)
    or (segid "   A" and resid  106 and name   HG) (segid "   A" and resid  106 and name HD11)
    or (segid "   A" and resid  106 and name   HG) (segid "   A" and resid  106 and name HD13)
assign (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   10 and name HG12) 3.137 1.230 1.230 weight 1.000 ! spec=2D_NOESY, no=2284, id=2199, vol=1.420000e+07
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   10 and name HG12)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   10 and name HG12)
    or (segid "   A" and resid   75 and name HG12) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   75 and name HG11) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   75 and name HG13) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   18 and name HG22) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   18 and name HG21) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   18 and name HG23) (segid "   A" and resid   85 and name HG12)
assign (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   18 and name HG11) 2.806 0.985 0.985 weight 1.000 ! spec=2D_NOESY, no=2290, id=2205, vol=1.500000e+07
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   18 and name HG11)
    or (segid "   A" and resid   75 and name HG22) (segid "   A" and resid   74 and name   HG)
    or (segid "   A" and resid   75 and name HG21) (segid "   A" and resid   74 and name   HG)
    or (segid "   A" and resid   75 and name HG23) (segid "   A" and resid   74 and name   HG)
assign (segid "   A" and resid   37 and name HD12) (segid "   A" and resid   37 and name HG12) 2.386 0.712 0.712 weight 1.000 ! spec=2D_NOESY, no=2298, id=2213, vol=2.220000e+07
    or (segid "   A" and resid   37 and name HD11) (segid "   A" and resid   37 and name HG12)
    or (segid "   A" and resid   37 and name HD13) (segid "   A" and resid   37 and name HG12)
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name   HG)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name   HG)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name   HG)
assign (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   41 and name HD12) 1.984 0.492 0.492 weight 1.000 ! spec=2D_NOESY, no=2299, id=2214, vol=6.440000e+07
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   41 and name HD12)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   41 and name HD12)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   41 and name HD11)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   41 and name HD13)
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name HD12)
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   74 and name HD22) (segid "   A" and resid   74 and name HD13)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name HD12)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   74 and name HD21) (segid "   A" and resid   74 and name HD13)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name HD12)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   74 and name HD23) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   57 and name  HG2) 3.054 1.166 1.166 weight 1.000 ! spec=2D_NOESY, no=2321, id=2236, vol=1.530000e+07
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   57 and name  HG2)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG21) 2.437 0.742 0.742 weight 1.000 ! spec=2D_NOESY, no=2333, id=2248, vol=5.290000e+07
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   41 and name HG11)
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   41 and name HG11)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   41 and name HG11)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   53 and name   HG) 2.477 0.767 0.767 weight 1.000 ! spec=2D_NOESY, no=2334, id=2249, vol=3.980000e+07
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   53 and name   HG)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   53 and name   HG)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   53 and name   HG)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   53 and name   HG)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   53 and name   HG)
assign (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   53 and name HD12) 2.311 0.668 0.668 weight 1.000 ! spec=2D_NOESY, no=2336, id=2251, vol=5.290000e+07
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   37 and name HG22) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   37 and name HG21) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   37 and name HG23) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   53 and name HD13)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   53 and name HD12)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   53 and name HD11)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   53 and name HD13)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG21) 2.462 0.758 0.758 weight 1.000 ! spec=2D_NOESY, no=2338, id=2253, vol=4.790000e+07
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG21)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG22)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   15 and name HG23)
    or (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   57 and name  HG2)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   57 and name  HG2)
assign (segid "   A" and resid   31 and name  HG1) (segid "   A" and resid   31 and name  HG2) 1.160 0.168 0.168 weight 1.000 ! spec=2D_NOESY, no=2354, id=2269, vol=6.660000e+08
    or (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   57 and name  HG2)
assign (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid   44 and name  HB2) 3.189 1.271 1.271 weight 1.000 ! spec=2D_NOESY, no=2357, id=2272, vol=1.300000e+07
    or (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid   44 and name  HB1)
    or (segid "   A" and resid   80 and name  HB2) (segid "   A" and resid   44 and name  HB3)
    or (segid "   A" and resid   40 and name HD12) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   40 and name HD11) (segid "   A" and resid   85 and name HG12)
    or (segid "   A" and resid   40 and name HD13) (segid "   A" and resid   85 and name HG12)
assign (segid "   A" and resid   57 and name  HG1) (segid "   A" and resid   57 and name  HG2) 1.480 0.274 0.274 weight 1.000 ! spec=2D_NOESY, no=2365, id=2280, vol=1.900000e+08
    or (segid "   A" and resid   68 and name  HB1) (segid "   A" and resid   68 and name  HB2)
assign (segid "   A" and resid   41 and name HD12) (segid "   A" and resid   41 and name HG11) 2.080 0.541 0.541 weight 1.000 ! spec=2D_NOESY, no=2375, id=2290, vol=6.410000e+07
    or (segid "   A" and resid   41 and name HD11) (segid "   A" and resid   41 and name HG11)
    or (segid "   A" and resid   41 and name HD13) (segid "   A" and resid   41 and name HG11)
    or (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   53 and name  HB1)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   53 and name  HB1)
assign (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HD12) 1.565 0.306 0.306 weight 1.000 ! spec=2D_NOESY, no=2402, id=2317, vol=2.790000e+08
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HD11)
    or (segid "   A" and resid   18 and name HG11) (segid "   A" and resid   18 and name HD13)
    or (segid "   A" and resid   74 and name   HG) (segid "   A" and resid   74 and name HD12)
    or (segid "   A" and resid   74 and name   HG) (segid "   A" and resid   74 and name HD11)
    or (segid "   A" and resid   74 and name   HG) (segid "   A" and resid   74 and name HD13)
assign (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   20 and name HG21) 4.719 2.784 2.784 weight 1.000 ! spec=2D_NOESY, no=2411, id=2326, vol=1.940000e+06
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   20 and name HG22)
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   20 and name HG23)
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   92 and name  HB2)
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   92 and name  HB1)
    or (segid "   A" and resid   91 and name   HA) (segid "   A" and resid   92 and name  HB3)
assign (segid "   A" and resid   29 and name   HA) (segid "   A" and resid   29 and name  HB2) 4.992 3.115 3.115 weight 1.000 ! spec=2D_NOESY, no=2414, id=2329, vol=8.600000e+05
    or (segid "   A" and resid  102 and name   HA) (segid "   A" and resid  102 and name  HB1)
assign (segid "   A" and resid    9 and name  HG2) (segid "   A" and resid    9 and name  HD2) 2.085 0.543 0.543 weight 1.000 ! spec=2D_NOESY, no=2415, id=2330, vol=6.920000e+07
    or (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HD2)
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   23 and name   HA) 3.930 1.931 1.931 weight 1.000 ! spec=2D_NOESY, no=2419, id=2334, vol=3.620000e+06
    or (segid "   A" and resid   64 and name  HB2) (segid "   A" and resid   65 and name  HA2)
assign (segid "   A" and resid   89 and name  HB1) (segid "   A" and resid   90 and name  HD2) 5.308 3.522 3.522 weight 1.000 ! spec=2D_NOESY, no=2421, id=2336, vol=1.180000e+06
    or (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   23 and name   HA)
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   91 and name   HA) 4.000 2.000 2.000 weight 1.000 ! spec=2D_NOESY, no=2427, id=2341, vol=2.850000e+06
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   73 and name  HB1)
assign (segid "   A" and resid   82 and name   HA) (segid "   A" and resid   17 and name  HD2) 3.865 1.867 1.867 weight 1.000 ! spec=2D_NOESY, no=2440, id=2353, vol=4.900000e+06
    or (segid "   A" and resid   84 and name  HB2) (segid "   A" and resid   43 and name  HA1)
    or (segid "   A" and resid   46 and name  HD1) (segid "   A" and resid   43 and name  HA1)
assign (segid "   A" and resid   40 and name   HG) (segid "   A" and resid   40 and name  HB1) 2.623 0.860 0.860 weight 1.000 ! spec=2D_NOESY, no=2443, id=2356, vol=2.120000e+07
    or (segid "   A" and resid   53 and name  HB1) (segid "   A" and resid   53 and name   HG)
assign (segid "   A" and resid   90 and name  HD2) (segid "   A" and resid   90 and name  HD1) 1.504 0.283 0.283 weight 1.000 ! spec=2D_NOESY, no=2447, id=2360, vol=2.760000e+08
    or (segid "   A" and resid   99 and name  HD2) (segid "   A" and resid   99 and name  HD1)
assign (segid "   A" and resid   95 and name  HB1) (segid "   A" and resid   95 and name  HB2) 1.251 0.196 0.196 weight 1.000 ! spec=2D_NOESY, no=2450, id=2363, vol=8.490000e+08
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name  HB2)
    or (segid "   A" and resid  105 and name  HB1) (segid "   A" and resid  105 and name  HB2)
assign (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   22 and name   HZ) 2.917 1.063 1.063 weight 1.000 ! spec=2D_NOESY, no=2455, id=2368, vol=1.240000e+07
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   22 and name   HZ)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   22 and name   HZ)
    or (segid "   A" and resid   23 and name HD22) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   23 and name HD21) (segid "   A" and resid   31 and name   HN)
    or (segid "   A" and resid   23 and name HD23) (segid "   A" and resid   31 and name   HN)
assign (segid "   A" and resid   50 and name   HA) (segid "   A" and resid   54 and name   HN) 2.901 1.052 1.052 weight 1.000 ! spec=2D_NOESY, no=2457, id=2370, vol=2.100000e+07
    or (segid "   A" and resid   77 and name  HB1) (segid "   A" and resid   78 and name   HN)
assign (segid "   A" and resid  101 and name HD12) (segid "   A" and resid  101 and name HG12) 2.038 0.519 0.519 weight 1.000 ! spec=2D_NOESY, no=2458, id=2371, vol=7.330000e+07
    or (segid "   A" and resid  101 and name HD11) (segid "   A" and resid  101 and name HG12)
    or (segid "   A" and resid  101 and name HD13) (segid "   A" and resid  101 and name HG12)
    or (segid "   A" and resid  104 and name HD22) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid  104 and name HD22) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  104 and name HD22) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid  104 and name HD21) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid  104 and name HD21) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  104 and name HD21) (segid "   A" and resid  103 and name  HB3)
    or (segid "   A" and resid  104 and name HD23) (segid "   A" and resid  103 and name  HB2)
    or (segid "   A" and resid  104 and name HD23) (segid "   A" and resid  103 and name  HB1)
    or (segid "   A" and resid  104 and name HD23) (segid "   A" and resid  103 and name  HB3)
assign (segid "   A" and resid   94 and name  HG2) (segid "   A" and resid   94 and name  HB1) 2.300 0.661 0.661 weight 1.000 ! spec=2D_NOESY, no=2459, id=2372, vol=6.660000e+07
    or (segid "   A" and resid   96 and name  HB1) (segid "   A" and resid   96 and name  HG2)
    or (segid "   A" and resid  100 and name  HB1) (segid "   A" and resid  100 and name  HG2)
assign (segid "   A" and resid   18 and name HD12) (segid "   A" and resid   10 and name HG11) 3.318 1.376 1.376 weight 1.000 ! spec=2D_NOESY, no=2460, id=2373, vol=9.290000e+06
    or (segid "   A" and resid   18 and name HD11) (segid "   A" and resid   10 and name HG11)
    or (segid "   A" and resid   18 and name HD13) (segid "   A" and resid   10 and name HG11)
    or (segid "   A" and resid   48 and name HD12) (segid "   A" and resid   56 and name  HG2)
    or (segid "   A" and resid   48 and name HD11) (segid "   A" and resid   56 and name  HG2)
    or (segid "   A" and resid   48 and name HD13) (segid "   A" and resid   56 and name  HG2)
    or (segid "   A" and resid   53 and name HD22) (segid "   A" and resid   57 and name  HG1)
    or (segid "   A" and resid   53 and name HD21) (segid "   A" and resid   57 and name  HG1)
    or (segid "   A" and resid   53 and name HD23) (segid "   A" and resid   57 and name  HG1)
assign (segid "   A" and resid   94 and name   HA) (segid "   A" and resid   95 and name   HN) 2.718 0.923 0.923 weight 1.000 ! spec=2D_NOESY, no=2468, id=2381, vol=1.850000e+07
    or (segid "   A" and resid   95 and name   HA) (segid "   A" and resid   96 and name   HN)
    or (segid "   A" and resid  100 and name   HA) (segid "   A" and resid  100 and name   HN)
assign (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   20 and name   HN) 3.819 1.823 1.823 weight 1.000 ! spec=2D_NOESY, no=2478, id=2391, vol=4.310000e+06
    or (segid "   A" and resid   70 and name   HA) (segid "   A" and resid   74 and name   HN)
# Restraints file 4: torsion_angle_restraints_09102015.tbl
! 1. I 10 Phi -111.25 +/- 44.24 (-155.48 to -67.01)

assign (resid   9 and name  C) (resid  10 and name  N) 
       (resid  10 and name CA) (resid  10 and name  C) 1.0  -111.25    44.24 2

! 2. S 11 Phi -78.45 +/- 25.96 (-104.41 to -52.50)

assign (resid  10 and name  C) (resid  11 and name  N) 
       (resid  11 and name CA) (resid  11 and name  C) 1.0   -78.45    25.96 2

! 3. H 12 Phi -60.63 +/- 6.96 (-67.59 to -53.67)

assign (resid  11 and name  C) (resid  12 and name  N) 
       (resid  12 and name CA) (resid  12 and name  C) 1.0   -60.63     6.96 2

! 4. E 13 Phi -61.54 +/- 9.02 (-70.56 to -52.52)

assign (resid  12 and name  C) (resid  13 and name  N) 
       (resid  13 and name CA) (resid  13 and name  C) 1.0   -61.54     9.02 2

! 5. D 14 Phi -66.06 +/- 10.52 (-76.58 to -55.54)

assign (resid  13 and name  C) (resid  14 and name  N) 
       (resid  14 and name CA) (resid  14 and name  C) 1.0   -66.06    10.52 2

! 6. T 15 Phi -67.20 +/- 17.90 (-85.10 to -49.30)

assign (resid  14 and name  C) (resid  15 and name  N) 
       (resid  15 and name CA) (resid  15 and name  C) 1.0   -67.20    17.90 2

! 7. Q 16 Phi -62.92 +/- 8.18 (-71.10 to -54.73)

assign (resid  15 and name  C) (resid  16 and name  N) 
       (resid  16 and name CA) (resid  16 and name  C) 1.0   -62.92     8.18 2

! 8. R 17 Phi -67.25 +/- 4.29 (-71.54 to -62.96)

assign (resid  16 and name  C) (resid  17 and name  N) 
       (resid  17 and name CA) (resid  17 and name  C) 1.0   -67.25     4.29 2

! 9. I 18 Phi -62.13 +/- 7.70 (-69.83 to -54.43)

assign (resid  17 and name  C) (resid  18 and name  N) 
       (resid  18 and name CA) (resid  18 and name  C) 1.0   -62.13     7.70 2

! 10. K 19 Phi -63.60 +/- 13.28 (-76.87 to -50.32)

assign (resid  18 and name  C) (resid  19 and name  N) 
       (resid  19 and name CA) (resid  19 and name  C) 1.0   -63.60    13.28 2

! 11. T 20 Phi -67.13 +/- 16.97 (-84.10 to -50.16)

assign (resid  19 and name  C) (resid  20 and name  N) 
       (resid  20 and name CA) (resid  20 and name  C) 1.0   -67.13    16.97 2

! 12. A 21 Phi -62.58 +/- 11.33 (-73.92 to -51.25)

assign (resid  20 and name  C) (resid  21 and name  N) 
       (resid  21 and name CA) (resid  21 and name  C) 1.0   -62.58    11.33 2

! 13. F 22 Phi -61.71 +/- 14.89 (-76.59 to -46.82)

assign (resid  21 and name  C) (resid  22 and name  N) 
       (resid  22 and name CA) (resid  22 and name  C) 1.0   -61.71    14.89 2

! 14. L 23 Phi -61.23 +/- 16.62 (-77.85 to -44.61)

assign (resid  22 and name  C) (resid  23 and name  N) 
       (resid  23 and name CA) (resid  23 and name  C) 1.0   -61.23    16.62 2

! 15. S 24 Phi -64.59 +/- 12.48 (-77.07 to -52.11)

assign (resid  23 and name  C) (resid  24 and name  N) 
       (resid  24 and name CA) (resid  24 and name  C) 1.0   -64.59    12.48 2

! 16. Y 25 Phi -64.02 +/- 11.72 (-75.74 to -52.31)

assign (resid  24 and name  C) (resid  25 and name  N) 
       (resid  25 and name CA) (resid  25 and name  C) 1.0   -64.02    11.72 2

! 17. A 26 Phi -61.42 +/- 8.51 (-69.93 to -52.92)

assign (resid  25 and name  C) (resid  26 and name  N) 
       (resid  26 and name CA) (resid  26 and name  C) 1.0   -61.42     8.51 2

! 18. Q 27 Phi -86.89 +/- 15.48 (-102.37 to -71.41)

assign (resid  26 and name  C) (resid  27 and name  N) 
       (resid  27 and name CA) (resid  27 and name  C) 1.0   -86.89    15.48 2

! 19. G 28 Phi 86.41 +/- 22.59 (63.82 to 109.00)

assign (resid  27 and name  C) (resid  28 and name  N) 
       (resid  28 and name CA) (resid  28 and name  C) 1.0    86.41    22.59 2

! 20. Q 29 Phi -102.64 +/- 56.26 (-158.89 to -46.38)

assign (resid  28 and name  C) (resid  29 and name  N) 
       (resid  29 and name CA) (resid  29 and name  C) 1.0  -102.64    56.26 2

! 21. D 30 Phi -92.10 +/- 50.69 (-142.79 to -41.41)

assign (resid  29 and name  C) (resid  30 and name  N) 
       (resid  30 and name CA) (resid  30 and name  C) 1.0   -92.10    50.69 2

! 22. K 31 Phi -139.45 +/- 44.84 (-184.29 to -94.61)

assign (resid  30 and name  C) (resid  31 and name  N) 
       (resid  31 and name CA) (resid  31 and name  C) 1.0  -139.45    44.84 2

! 23. V 32 Phi -92.51 +/- 40.16 (-132.66 to -52.35)

assign (resid  31 and name  C) (resid  32 and name  N) 
       (resid  32 and name CA) (resid  32 and name  C) 1.0   -92.51    40.16 2

! 24. T 33 Phi -81.76 +/- 12.96 (-94.72 to -68.81)

assign (resid  32 and name  C) (resid  33 and name  N) 
       (resid  33 and name CA) (resid  33 and name  C) 1.0   -81.76    12.96 2

! 25. E 34 Phi -58.90 +/- 4.82 (-63.72 to -54.07)

assign (resid  33 and name  C) (resid  34 and name  N) 
       (resid  34 and name CA) (resid  34 and name  C) 1.0   -58.90     4.82 2

! 26. A 35 Phi -57.36 +/- 9.68 (-67.04 to -47.68)

assign (resid  34 and name  C) (resid  35 and name  N) 
       (resid  35 and name CA) (resid  35 and name  C) 1.0   -57.36     9.68 2

! 27. M 36 Phi -67.78 +/- 8.53 (-76.31 to -59.25)

assign (resid  35 and name  C) (resid  36 and name  N) 
       (resid  36 and name CA) (resid  36 and name  C) 1.0   -67.78     8.53 2

! 28. I 37 Phi -63.48 +/- 8.19 (-71.67 to -55.28)

assign (resid  36 and name  C) (resid  37 and name  N) 
       (resid  37 and name CA) (resid  37 and name  C) 1.0   -63.48     8.19 2

! 29. D 38 Phi -61.01 +/- 12.83 (-73.84 to -48.18)

assign (resid  37 and name  C) (resid  38 and name  N) 
       (resid  38 and name CA) (resid  38 and name  C) 1.0   -61.01    12.83 2

! 30. Q 39 Phi -65.02 +/- 9.08 (-74.10 to -55.94)

assign (resid  38 and name  C) (resid  39 and name  N) 
       (resid  39 and name CA) (resid  39 and name  C) 1.0   -65.02     9.08 2

! 31. L 40 Phi -63.72 +/- 6.52 (-70.24 to -57.20)

assign (resid  39 and name  C) (resid  40 and name  N) 
       (resid  40 and name CA) (resid  40 and name  C) 1.0   -63.72     6.52 2

! 32. I 41 Phi -60.15 +/- 8.90 (-69.05 to -51.26)

assign (resid  40 and name  C) (resid  41 and name  N) 
       (resid  41 and name CA) (resid  41 and name  C) 1.0   -60.15     8.90 2

! 33. C 42 Phi -64.73 +/- 7.94 (-72.67 to -56.79)

assign (resid  41 and name  C) (resid  42 and name  N) 
       (resid  42 and name CA) (resid  42 and name  C) 1.0   -64.73     7.94 2

! 34. G 43 Phi -67.12 +/- 14.59 (-81.71 to -52.53)

assign (resid  42 and name  C) (resid  43 and name  N) 
       (resid  43 and name CA) (resid  43 and name  C) 1.0   -67.12    14.59 2

! 35. A 44 Phi -87.64 +/- 28.62 (-116.26 to -59.02)

assign (resid  43 and name  C) (resid  44 and name  N) 
       (resid  44 and name CA) (resid  44 and name  C) 1.0   -87.64    28.62 2

! 36. F 45 Phi -126.15 +/- 43.69 (-169.84 to -82.46)

assign (resid  44 and name  C) (resid  45 and name  N) 
       (resid  45 and name CA) (resid  45 and name  C) 1.0  -126.15    43.69 2

! 37. L 48 Phi -79.65 +/- 18.80 (-98.45 to -60.85)

assign (resid  47 and name  C) (resid  48 and name  N) 
       (resid  48 and name CA) (resid  48 and name  C) 1.0   -79.65    18.80 2

! 38. S 49 Phi -85.56 +/- 51.24 (-136.80 to -34.32)

assign (resid  48 and name  C) (resid  49 and name  N) 
       (resid  49 and name CA) (resid  49 and name  C) 1.0   -85.56    51.24 2

! 39. W 50 Phi -60.00 +/- 6.22 (-66.21 to -53.78)

assign (resid  49 and name  C) (resid  50 and name  N) 
       (resid  50 and name CA) (resid  50 and name  C) 1.0   -60.00     6.22 2

! 40. E 51 Phi -62.94 +/- 9.93 (-72.87 to -53.00)

assign (resid  50 and name  C) (resid  51 and name  N) 
       (resid  51 and name CA) (resid  51 and name  C) 1.0   -62.94     9.93 2

! 41. Q 52 Phi -65.55 +/- 5.88 (-71.43 to -59.68)

assign (resid  51 and name  C) (resid  52 and name  N) 
       (resid  52 and name CA) (resid  52 and name  C) 1.0   -65.55     5.88 2

! 42. L 53 Phi -63.69 +/- 10.19 (-73.88 to -53.49)

assign (resid  52 and name  C) (resid  53 and name  N) 
       (resid  53 and name CA) (resid  53 and name  C) 1.0   -63.69    10.19 2

! 43. Q 54 Phi -64.67 +/- 7.93 (-72.61 to -56.74)

assign (resid  53 and name  C) (resid  54 and name  N) 
       (resid  54 and name CA) (resid  54 and name  C) 1.0   -64.67     7.93 2

! 44. E 55 Phi -67.58 +/- 9.01 (-76.59 to -58.57)

assign (resid  54 and name  C) (resid  55 and name  N) 
       (resid  55 and name CA) (resid  55 and name  C) 1.0   -67.58     9.01 2

! 45. K 56 Phi -66.64 +/- 20.94 (-87.58 to -45.70)

assign (resid  55 and name  C) (resid  56 and name  N) 
       (resid  56 and name CA) (resid  56 and name  C) 1.0   -66.64    20.94 2

! 46. K 57 Phi -77.28 +/- 34.65 (-111.93 to -42.63)

assign (resid  56 and name  C) (resid  57 and name  N) 
       (resid  57 and name CA) (resid  57 and name  C) 1.0   -77.28    34.65 2

! 47. D 67 Phi -90.88 +/- 58.37 (-149.25 to -32.51)

assign (resid  66 and name  C) (resid  67 and name  N) 
       (resid  67 and name CA) (resid  67 and name  C) 1.0   -90.88    58.37 2

! 48. R 68 Phi -59.17 +/- 7.40 (-66.57 to -51.77)

assign (resid  67 and name  C) (resid  68 and name  N) 
       (resid  68 and name CA) (resid  68 and name  C) 1.0   -59.17     7.40 2

! 49. S 69 Phi -64.72 +/- 6.23 (-70.95 to -58.48)

assign (resid  68 and name  C) (resid  69 and name  N) 
       (resid  69 and name CA) (resid  69 and name  C) 1.0   -64.72     6.23 2

! 50. A 70 Phi -63.97 +/- 9.65 (-73.62 to -54.31)

assign (resid  69 and name  C) (resid  70 and name  N) 
       (resid  70 and name CA) (resid  70 and name  C) 1.0   -63.97     9.65 2

! 51. F 71 Phi -63.71 +/- 9.01 (-72.72 to -54.70)

assign (resid  70 and name  C) (resid  71 and name  N) 
       (resid  71 and name CA) (resid  71 and name  C) 1.0   -63.71     9.01 2

! 52. F 72 Phi -58.51 +/- 9.23 (-67.74 to -49.27)

assign (resid  71 and name  C) (resid  72 and name  N) 
       (resid  72 and name CA) (resid  72 and name  C) 1.0   -58.51     9.23 2

! 53. S 73 Phi -61.46 +/- 7.73 (-69.19 to -53.73)

assign (resid  72 and name  C) (resid  73 and name  N) 
       (resid  73 and name CA) (resid  73 and name  C) 1.0   -61.46     7.73 2

! 54. L 74 Phi -65.49 +/- 9.80 (-75.29 to -55.69)

assign (resid  73 and name  C) (resid  74 and name  N) 
       (resid  74 and name CA) (resid  74 and name  C) 1.0   -65.49     9.80 2

! 55. V 75 Phi -64.25 +/- 10.29 (-74.54 to -53.96)

assign (resid  74 and name  C) (resid  75 and name  N) 
       (resid  75 and name CA) (resid  75 and name  C) 1.0   -64.25    10.29 2

! 56. A 76 Phi -74.76 +/- 30.21 (-104.97 to -44.54)

assign (resid  75 and name  C) (resid  76 and name  N) 
       (resid  76 and name CA) (resid  76 and name  C) 1.0   -74.76    30.21 2

! 57. S 77 Phi -94.52 +/- 21.78 (-116.30 to -72.74)

assign (resid  76 and name  C) (resid  77 and name  N) 
       (resid  77 and name CA) (resid  77 and name  C) 1.0   -94.52    21.78 2

! 58. D 78 Phi -82.53 +/- 47.68 (-130.21 to -34.85)

assign (resid  77 and name  C) (resid  78 and name  N) 
       (resid  78 and name CA) (resid  78 and name  C) 1.0   -82.53    47.68 2

! 59. E 79 Phi -53.35 +/- 9.65 (-63.00 to -43.70)

assign (resid  78 and name  C) (resid  79 and name  N) 
       (resid  79 and name CA) (resid  79 and name  C) 1.0   -53.35     9.65 2

! 60. Q 80 Phi -59.18 +/- 9.73 (-68.91 to -49.45)

assign (resid  79 and name  C) (resid  80 and name  N) 
       (resid  80 and name CA) (resid  80 and name  C) 1.0   -59.18     9.73 2

! 61. Y 81 Phi -67.44 +/- 11.48 (-78.92 to -55.95)

assign (resid  80 and name  C) (resid  81 and name  N) 
       (resid  81 and name CA) (resid  81 and name  C) 1.0   -67.44    11.48 2

! 62. V 82 Phi -63.47 +/- 9.63 (-73.09 to -53.84)

assign (resid  81 and name  C) (resid  82 and name  N) 
       (resid  82 and name CA) (resid  82 and name  C) 1.0   -63.47     9.63 2

! 63. R 83 Phi -60.51 +/- 8.29 (-68.80 to -52.22)

assign (resid  82 and name  C) (resid  83 and name  N) 
       (resid  83 and name CA) (resid  83 and name  C) 1.0   -60.51     8.29 2

! 64. F 84 Phi -65.58 +/- 6.47 (-72.05 to -59.11)

assign (resid  83 and name  C) (resid  84 and name  N) 
       (resid  84 and name CA) (resid  84 and name  C) 1.0   -65.58     6.47 2

! 65. I 85 Phi -64.54 +/- 9.10 (-73.64 to -55.44)

assign (resid  84 and name  C) (resid  85 and name  N) 
       (resid  85 and name CA) (resid  85 and name  C) 1.0   -64.54     9.10 2

! 66. A 86 Phi -61.29 +/- 11.48 (-72.76 to -49.81)

assign (resid  85 and name  C) (resid  86 and name  N) 
       (resid  86 and name CA) (resid  86 and name  C) 1.0   -61.29    11.48 2

! 67. Q 87 Phi -71.57 +/- 23.72 (-95.28 to -47.85)

assign (resid  86 and name  C) (resid  87 and name  N) 
       (resid  87 and name CA) (resid  87 and name  C) 1.0   -71.57    23.72 2

! 68. H 88 Phi -84.58 +/- 24.08 (-108.66 to -60.51)

assign (resid  87 and name  C) (resid  88 and name  N) 
       (resid  88 and name CA) (resid  88 and name  C) 1.0   -84.58    24.08 2

! 69. F 89 Phi -121.17 +/- 49.27 (-170.44 to -71.91)

assign (resid  88 and name  C) (resid  89 and name  N) 
       (resid  89 and name CA) (resid  89 and name  C) 1.0  -121.17    49.27 2

! 70. P 90 Phi -68.63 +/- 18.35 (-86.98 to -50.28)

assign (resid  89 and name  C) (resid  90 and name  N) 
       (resid  90 and name CA) (resid  90 and name  C) 1.0   -68.63    18.35 2

! 71. A 92 Phi -78.07 +/- 48.87 (-126.94 to -29.20)

assign (resid  91 and name  C) (resid  92 and name  N) 
       (resid  92 and name CA) (resid  92 and name  C) 1.0   -78.07    48.87 2

! 72. P 98 Phi -80.42 +/- 64.45 (-144.87 to -15.96)

assign (resid  97 and name  C) (resid  98 and name  N) 
       (resid  98 and name CA) (resid  98 and name  C) 1.0   -80.42    64.45 2


! 73. I 10 Psi 131.10 +/- 26.49 (104.60 to 157.59)

assign (resid  10 and name  N) (resid  10 and name CA) 
       (resid  10 and name  C) (resid  11 and name  N) 1.0   131.10    26.49 2

! 74. S 11 Psi 163.11 +/- 22.56 (140.56 to 185.67)

assign (resid  11 and name  N) (resid  11 and name CA) 
       (resid  11 and name  C) (resid  12 and name  N) 1.0   163.11    22.56 2

! 75. H 12 Psi -37.51 +/- 13.59 (-51.11 to -23.92)

assign (resid  12 and name  N) (resid  12 and name CA) 
       (resid  12 and name  C) (resid  13 and name  N) 1.0   -37.51    13.59 2

! 76. E 13 Psi -43.56 +/- 10.81 (-54.37 to -32.75)

assign (resid  13 and name  N) (resid  13 and name CA) 
       (resid  13 and name  C) (resid  14 and name  N) 1.0   -43.56    10.81 2

! 77. D 14 Psi -33.87 +/- 21.74 (-55.61 to -12.13)

assign (resid  14 and name  N) (resid  14 and name CA) 
       (resid  14 and name  C) (resid  15 and name  N) 1.0   -33.87    21.74 2

! 78. T 15 Psi -41.66 +/- 11.94 (-53.61 to -29.72)

assign (resid  15 and name  N) (resid  15 and name CA) 
       (resid  15 and name  C) (resid  16 and name  N) 1.0   -41.66    11.94 2

! 79. Q 16 Psi -39.72 +/- 7.17 (-46.89 to -32.55)

assign (resid  16 and name  N) (resid  16 and name CA) 
       (resid  16 and name  C) (resid  17 and name  N) 1.0   -39.72     7.17 2

! 80. R 17 Psi -42.67 +/- 9.31 (-51.98 to -33.36)

assign (resid  17 and name  N) (resid  17 and name CA) 
       (resid  17 and name  C) (resid  18 and name  N) 1.0   -42.67     9.31 2

! 81. I 18 Psi -41.13 +/- 8.69 (-49.81 to -32.44)

assign (resid  18 and name  N) (resid  18 and name CA) 
       (resid  18 and name  C) (resid  19 and name  N) 1.0   -41.13     8.69 2

! 82. K 19 Psi -35.60 +/- 24.91 (-60.51 to -10.69)

assign (resid  19 and name  N) (resid  19 and name CA) 
       (resid  19 and name  C) (resid  20 and name  N) 1.0   -35.60    24.91 2

! 83. T 20 Psi -38.32 +/- 11.94 (-50.26 to -26.39)

assign (resid  20 and name  N) (resid  20 and name CA) 
       (resid  20 and name  C) (resid  21 and name  N) 1.0   -38.32    11.94 2

! 84. A 21 Psi -45.39 +/- 12.57 (-57.95 to -32.82)

assign (resid  21 and name  N) (resid  21 and name CA) 
       (resid  21 and name  C) (resid  22 and name  N) 1.0   -45.39    12.57 2

! 85. F 22 Psi -47.55 +/- 11.09 (-58.63 to -36.46)

assign (resid  22 and name  N) (resid  22 and name CA) 
       (resid  22 and name  C) (resid  23 and name  N) 1.0   -47.55    11.09 2

! 86. L 23 Psi -38.02 +/- 18.37 (-56.39 to -19.65)

assign (resid  23 and name  N) (resid  23 and name CA) 
       (resid  23 and name  C) (resid  24 and name  N) 1.0   -38.02    18.37 2

! 87. S 24 Psi -41.92 +/- 11.65 (-53.56 to -30.27)

assign (resid  24 and name  N) (resid  24 and name CA) 
       (resid  24 and name  C) (resid  25 and name  N) 1.0   -41.92    11.65 2

! 88. Y 25 Psi -42.96 +/- 11.49 (-54.45 to -31.47)

assign (resid  25 and name  N) (resid  25 and name CA) 
       (resid  25 and name  C) (resid  26 and name  N) 1.0   -42.96    11.49 2

! 89. A 26 Psi -37.60 +/- 21.78 (-59.39 to -15.82)

assign (resid  26 and name  N) (resid  26 and name CA) 
       (resid  26 and name  C) (resid  27 and name  N) 1.0   -37.60    21.78 2

! 90. Q 27 Psi -3.94 +/- 24.34 (-28.29 to 20.40)

assign (resid  27 and name  N) (resid  27 and name CA) 
       (resid  27 and name  C) (resid  28 and name  N) 1.0    -3.94    24.34 2

! 91. G 28 Psi 12.68 +/- 28.22 (-15.54 to 40.90)

assign (resid  28 and name  N) (resid  28 and name CA) 
       (resid  28 and name  C) (resid  29 and name  N) 1.0    12.68    28.22 2

! 92. Q 29 Psi 157.28 +/- 36.49 (120.79 to 193.77)

assign (resid  29 and name  N) (resid  29 and name CA) 
       (resid  29 and name  C) (resid  30 and name  N) 1.0   157.28    36.49 2

! 93. D 30 Psi -17.14 +/- 43.97 (-61.10 to 26.83)

assign (resid  30 and name  N) (resid  30 and name CA) 
       (resid  30 and name  C) (resid  31 and name  N) 1.0   -17.14    43.97 2

! 94. K 31 Psi 150.08 +/- 34.68 (115.40 to 184.76)

assign (resid  31 and name  N) (resid  31 and name CA) 
       (resid  31 and name  C) (resid  32 and name  N) 1.0   150.08    34.68 2

! 95. V 32 Psi 140.48 +/- 31.67 (108.81 to 172.16)

assign (resid  32 and name  N) (resid  32 and name CA) 
       (resid  32 and name  C) (resid  33 and name  N) 1.0   140.48    31.67 2

! 96. T 33 Psi 168.05 +/- 5.83 (162.22 to 173.88)

assign (resid  33 and name  N) (resid  33 and name CA) 
       (resid  33 and name  C) (resid  34 and name  N) 1.0   168.05     5.83 2

! 97. E 34 Psi -41.84 +/- 5.94 (-47.79 to -35.90)

assign (resid  34 and name  N) (resid  34 and name CA) 
       (resid  34 and name  C) (resid  35 and name  N) 1.0   -41.84     5.94 2

! 98. A 35 Psi -44.34 +/- 11.62 (-55.96 to -32.72)

assign (resid  35 and name  N) (resid  35 and name CA) 
       (resid  35 and name  C) (resid  36 and name  N) 1.0   -44.34    11.62 2

! 99. M 36 Psi -40.45 +/- 11.53 (-51.99 to -28.92)

assign (resid  36 and name  N) (resid  36 and name CA) 
       (resid  36 and name  C) (resid  37 and name  N) 1.0   -40.45    11.53 2

! 100. I 37 Psi -40.51 +/- 15.88 (-56.38 to -24.63)

assign (resid  37 and name  N) (resid  37 and name CA) 
       (resid  37 and name  C) (resid  38 and name  N) 1.0   -40.51    15.88 2

! 101. D 38 Psi -43.48 +/- 10.98 (-54.46 to -32.50)

assign (resid  38 and name  N) (resid  38 and name CA) 
       (resid  38 and name  C) (resid  39 and name  N) 1.0   -43.48    10.98 2

! 102. Q 39 Psi -37.47 +/- 11.68 (-49.15 to -25.79)

assign (resid  39 and name  N) (resid  39 and name CA) 
       (resid  39 and name  C) (resid  40 and name  N) 1.0   -37.47    11.68 2

! 103. L 40 Psi -46.14 +/- 10.38 (-56.52 to -35.77)

assign (resid  40 and name  N) (resid  40 and name CA) 
       (resid  40 and name  C) (resid  41 and name  N) 1.0   -46.14    10.38 2

! 104. I 41 Psi -44.54 +/- 14.08 (-58.62 to -30.47)

assign (resid  41 and name  N) (resid  41 and name CA) 
       (resid  41 and name  C) (resid  42 and name  N) 1.0   -44.54    14.08 2

! 105. C 42 Psi -36.06 +/- 33.99 (-70.06 to -2.07)

assign (resid  42 and name  N) (resid  42 and name CA) 
       (resid  42 and name  C) (resid  43 and name  N) 1.0   -36.06    33.99 2

! 106. G 43 Psi -24.95 +/- 36.11 (-61.06 to 11.16)

assign (resid  43 and name  N) (resid  43 and name CA) 
       (resid  43 and name  C) (resid  44 and name  N) 1.0   -24.95    36.11 2

! 107. A 44 Psi -20.07 +/- 52.48 (-72.56 to 32.41)

assign (resid  44 and name  N) (resid  44 and name CA) 
       (resid  44 and name  C) (resid  45 and name  N) 1.0   -20.07    52.48 2

! 108. F 45 Psi 98.19 +/- 65.03 (33.16 to 163.22)

assign (resid  45 and name  N) (resid  45 and name CA) 
       (resid  45 and name  C) (resid  46 and name  N) 1.0    98.19    65.03 2

! 109. L 48 Psi 146.63 +/- 21.52 (125.11 to 168.15)

assign (resid  48 and name  N) (resid  48 and name CA) 
       (resid  48 and name  C) (resid  49 and name  N) 1.0   146.63    21.52 2

! 110. S 49 Psi 161.24 +/- 13.72 (147.53 to 174.96)

assign (resid  49 and name  N) (resid  49 and name CA) 
       (resid  49 and name  C) (resid  50 and name  N) 1.0   161.24    13.72 2

! 111. W 50 Psi -41.14 +/- 9.95 (-51.09 to -31.20)

assign (resid  50 and name  N) (resid  50 and name CA) 
       (resid  50 and name  C) (resid  51 and name  N) 1.0   -41.14     9.95 2

! 112. E 51 Psi -40.54 +/- 15.88 (-56.42 to -24.66)

assign (resid  51 and name  N) (resid  51 and name CA) 
       (resid  51 and name  C) (resid  52 and name  N) 1.0   -40.54    15.88 2

! 113. Q 52 Psi -41.21 +/- 10.52 (-51.73 to -30.69)

assign (resid  52 and name  N) (resid  52 and name CA) 
       (resid  52 and name  C) (resid  53 and name  N) 1.0   -41.21    10.52 2

! 114. L 53 Psi -42.81 +/- 13.45 (-56.26 to -29.37)

assign (resid  53 and name  N) (resid  53 and name CA) 
       (resid  53 and name  C) (resid  54 and name  N) 1.0   -42.81    13.45 2

! 115. Q 54 Psi -39.10 +/- 9.67 (-48.78 to -29.43)

assign (resid  54 and name  N) (resid  54 and name CA) 
       (resid  54 and name  C) (resid  55 and name  N) 1.0   -39.10     9.67 2

! 116. E 55 Psi -40.75 +/- 9.06 (-49.81 to -31.69)

assign (resid  55 and name  N) (resid  55 and name CA) 
       (resid  55 and name  C) (resid  56 and name  N) 1.0   -40.75     9.06 2

! 117. K 56 Psi -30.40 +/- 24.45 (-54.85 to -5.95)

assign (resid  56 and name  N) (resid  56 and name CA) 
       (resid  56 and name  C) (resid  57 and name  N) 1.0   -30.40    24.45 2

! 118. K 57 Psi -20.73 +/- 30.90 (-51.63 to 10.16)

assign (resid  57 and name  N) (resid  57 and name CA) 
       (resid  57 and name  C) (resid  58 and name  N) 1.0   -20.73    30.90 2

! 119. D 67 Psi 162.55 +/- 24.13 (138.42 to 186.68)

assign (resid  67 and name  N) (resid  67 and name CA) 
       (resid  67 and name  C) (resid  68 and name  N) 1.0   162.55    24.13 2

! 120. R 68 Psi -37.04 +/- 12.42 (-49.47 to -24.62)

assign (resid  68 and name  N) (resid  68 and name CA) 
       (resid  68 and name  C) (resid  69 and name  N) 1.0   -37.04    12.42 2

! 121. S 69 Psi -41.98 +/- 7.08 (-49.05 to -34.90)

assign (resid  69 and name  N) (resid  69 and name CA) 
       (resid  69 and name  C) (resid  70 and name  N) 1.0   -41.98     7.08 2

! 122. A 70 Psi -41.86 +/- 11.26 (-53.12 to -30.60)

assign (resid  70 and name  N) (resid  70 and name CA) 
       (resid  70 and name  C) (resid  71 and name  N) 1.0   -41.86    11.26 2

! 123. F 71 Psi -44.50 +/- 8.50 (-53.00 to -36.00)

assign (resid  71 and name  N) (resid  71 and name CA) 
       (resid  71 and name  C) (resid  72 and name  N) 1.0   -44.50     8.50 2

! 124. F 72 Psi -43.75 +/- 11.56 (-55.31 to -32.19)

assign (resid  72 and name  N) (resid  72 and name CA) 
       (resid  72 and name  C) (resid  73 and name  N) 1.0   -43.75    11.56 2

! 125. S 73 Psi -42.97 +/- 8.53 (-51.49 to -34.44)

assign (resid  73 and name  N) (resid  73 and name CA) 
       (resid  73 and name  C) (resid  74 and name  N) 1.0   -42.97     8.53 2

! 126. L 74 Psi -40.80 +/- 18.17 (-58.97 to -22.64)

assign (resid  74 and name  N) (resid  74 and name CA) 
       (resid  74 and name  C) (resid  75 and name  N) 1.0   -40.80    18.17 2

! 127. V 75 Psi -39.55 +/- 11.33 (-50.88 to -28.23)

assign (resid  75 and name  N) (resid  75 and name CA) 
       (resid  75 and name  C) (resid  76 and name  N) 1.0   -39.55    11.33 2

! 128. A 76 Psi -24.28 +/- 32.45 (-56.73 to 8.16)

assign (resid  76 and name  N) (resid  76 and name CA) 
       (resid  76 and name  C) (resid  77 and name  N) 1.0   -24.28    32.45 2

! 129. S 77 Psi -10.18 +/- 35.63 (-45.81 to 25.45)

assign (resid  77 and name  N) (resid  77 and name CA) 
       (resid  77 and name  C) (resid  78 and name  N) 1.0   -10.18    35.63 2

! 130. D 78 Psi 113.92 +/- 41.32 (72.60 to 155.24)

assign (resid  78 and name  N) (resid  78 and name CA) 
       (resid  78 and name  C) (resid  79 and name  N) 1.0   113.92    41.32 2

! 131. E 79 Psi -40.78 +/- 14.48 (-55.26 to -26.31)

assign (resid  79 and name  N) (resid  79 and name CA) 
       (resid  79 and name  C) (resid  80 and name  N) 1.0   -40.78    14.48 2

! 132. Q 80 Psi -39.24 +/- 14.89 (-54.13 to -24.35)

assign (resid  80 and name  N) (resid  80 and name CA) 
       (resid  80 and name  C) (resid  81 and name  N) 1.0   -39.24    14.89 2

! 133. Y 81 Psi -42.30 +/- 8.87 (-51.17 to -33.44)

assign (resid  81 and name  N) (resid  81 and name CA) 
       (resid  81 and name  C) (resid  82 and name  N) 1.0   -42.30     8.87 2

! 134. V 82 Psi -42.40 +/- 7.02 (-49.43 to -35.38)

assign (resid  82 and name  N) (resid  82 and name CA) 
       (resid  82 and name  C) (resid  83 and name  N) 1.0   -42.40     7.02 2

! 135. R 83 Psi -42.13 +/- 12.11 (-54.24 to -30.02)

assign (resid  83 and name  N) (resid  83 and name CA) 
       (resid  83 and name  C) (resid  84 and name  N) 1.0   -42.13    12.11 2

! 136. F 84 Psi -44.26 +/- 11.81 (-56.07 to -32.45)

assign (resid  84 and name  N) (resid  84 and name CA) 
       (resid  84 and name  C) (resid  85 and name  N) 1.0   -44.26    11.81 2

! 137. I 85 Psi -39.93 +/- 10.57 (-50.50 to -29.36)

assign (resid  85 and name  N) (resid  85 and name CA) 
       (resid  85 and name  C) (resid  86 and name  N) 1.0   -39.93    10.57 2

! 138. A 86 Psi -39.10 +/- 19.22 (-58.32 to -19.87)

assign (resid  86 and name  N) (resid  86 and name CA) 
       (resid  86 and name  C) (resid  87 and name  N) 1.0   -39.10    19.22 2

! 139. Q 87 Psi -34.84 +/- 19.52 (-54.36 to -15.33)

assign (resid  87 and name  N) (resid  87 and name CA) 
       (resid  87 and name  C) (resid  88 and name  N) 1.0   -34.84    19.52 2

! 140. H 88 Psi -13.19 +/- 37.21 (-50.40 to 24.03)

assign (resid  88 and name  N) (resid  88 and name CA) 
       (resid  88 and name  C) (resid  89 and name  N) 1.0   -13.19    37.21 2

! 141. F 89 Psi 84.07 +/- 60.55 (23.52 to 144.63)

assign (resid  89 and name  N) (resid  89 and name CA) 
       (resid  89 and name  C) (resid  90 and name  N) 1.0    84.07    60.55 2

! 142. P 90 Psi 154.96 +/- 18.95 (136.01 to 173.92)

assign (resid  90 and name  N) (resid  90 and name CA) 
       (resid  90 and name  C) (resid  91 and name  N) 1.0   154.96    18.95 2

! 143. A 92 Psi 129.85 +/- 54.96 (74.89 to 184.81)

assign (resid  92 and name  N) (resid  92 and name CA) 
       (resid  92 and name  C) (resid  93 and name  N) 1.0   129.85    54.96 2

! 144. P 98 Psi 132.79 +/- 53.65 (79.14 to 186.45)

assign (resid  98 and name  N) (resid  98 and name CA) 
       (resid  98 and name  C) (resid  99 and name  N) 1.0   132.79    53.65 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1          1HT       GLY   1 -11.102  18.148  -6.126
    2    H2   GLY   1          2HT       GLY   1  -9.957  18.871  -5.112
    3    H    GLY   1           H        GLY   1 -10.506  18.844  -5.873
    4    H3   GLY   1          3HT       GLY   1 -10.889  17.581  -4.547
    5    HA2  GLY   1          1HA       GLY   1  -8.670  16.833  -5.060
    6    HA3  GLY   1          2HA       GLY   1  -9.853  16.089  -6.125
    7    H    SER   2           H        SER   2  -6.928  16.743  -6.385
    8    HA   SER   2           HA       SER   2  -7.067  18.398  -8.816
    9    HB2  SER   2          2HB       SER   2  -4.661  17.754  -7.087
   10    HB3  SER   2          1HB       SER   2  -4.692  18.858  -8.462
   11    HG   SER   2           HG       SER   2  -6.587  19.391  -6.537
   12    H    ALA   3           H        ALA   3  -5.447  17.732 -10.516
   13    HA   ALA   3           HA       ALA   3  -5.624  14.875 -10.960
   14    HB1  ALA   3          1HB       ALA   3  -4.455  17.054 -12.690
   15    HB2  ALA   3          2HB       ALA   3  -6.094  16.411 -12.799
   16    HB3  ALA   3          3HB       ALA   3  -4.715  15.378 -13.175
   17    H    MET   4           H        MET   4  -4.201  14.686  -8.937
   18    HA   MET   4           HA       MET   4  -1.422  15.392  -9.271
   19    HB2  MET   4          2HB       MET   4  -1.110  14.660  -7.029
   20    HB3  MET   4          1HB       MET   4  -2.647  15.509  -7.074
   21    HG2  MET   4          2HG       MET   4  -2.310  12.517  -7.120
   22    HG3  MET   4          1HG       MET   4  -2.715  13.477  -5.700
   23    HE1  MET   4          1HE       MET   4  -4.411  10.957  -6.723
   24    HE2  MET   4          2HE       MET   4  -6.051  11.566  -6.498
   25    HE3  MET   4          3HE       MET   4  -4.814  11.891  -5.283
   26    H    GLY   5           H        GLY   5  -3.396  12.665  -9.896
   27    HA2  GLY   5          2HA       GLY   5  -2.881  10.671 -10.920
   28    HA3  GLY   5          1HA       GLY   5  -1.228  11.245 -11.087
   29    H    HIS   6           H        HIS   6   0.243  10.129 -10.020
   30    HA   HIS   6           HA       HIS   6  -0.625   8.554  -7.689
   31    HB2  HIS   6          2HB       HIS   6   1.255   7.058  -8.128
   32    HB3  HIS   6          1HB       HIS   6   0.256   7.209  -9.565
   33    HD1  HIS   6          1HD       HIS   6   1.367   8.069 -11.673
   34    HD2  HIS   6          2HD       HIS   6   3.802   8.381  -8.316
   35    HE1  HIS   6          1HE       HIS   6   3.645   8.674 -12.543
   36    HE2  HIS   6          2HE       HIS   6   5.035   9.075 -10.481
   37    H    MET   7           H        MET   7   0.611  11.416  -8.222
   38    HA   MET   7           HA       MET   7   2.769  11.202  -6.232
   39    HB2  MET   7          2HB       MET   7   3.372  12.119  -8.479
   40    HB3  MET   7          1HB       MET   7   2.255  13.446  -8.191
   41    HG2  MET   7          2HG       MET   7   4.517  14.140  -7.730
   42    HG3  MET   7          1HG       MET   7   3.569  14.125  -6.245
   43    HE1  MET   7          1HE       MET   7   6.779  14.233  -6.354
   44    HE2  MET   7          2HE       MET   7   7.181  13.112  -5.054
   45    HE3  MET   7          3HE       MET   7   5.855  14.256  -4.853
   46    H    VAL   8           H        VAL   8   2.205  11.807  -4.253
   47    HA   VAL   8           HA       VAL   8   0.554  14.156  -3.866
   48    HB   VAL   8           HB       VAL   8  -1.071  12.322  -3.997
   49   HG11  VAL   8          1HG1      VAL   8   0.393  11.111  -1.666
   50   HG12  VAL   8          2HG1      VAL   8   0.251  10.450  -3.293
   51   HG13  VAL   8          3HG1      VAL   8  -1.178  10.585  -2.270
   52   HG21  VAL   8          1HG2      VAL   8  -0.780  13.542  -1.253
   53   HG22  VAL   8          2HG2      VAL   8  -2.218  12.701  -1.830
   54   HG23  VAL   8          3HG2      VAL   8  -1.685  14.177  -2.629
   55    H    LYS   9           H        LYS   9   0.496  12.675  -1.011
   56    HA   LYS   9           HA       LYS   9   2.930  13.869  -0.079
   57    HB2  LYS   9          2HB       LYS   9   0.910  12.115   1.363
   58    HB3  LYS   9          1HB       LYS   9   2.256  12.967   2.121
   59    HG2  LYS   9          2HG       LYS   9  -0.012  14.267   0.637
   60    HG3  LYS   9          1HG       LYS   9   0.163  14.166   2.382
   61    HD2  LYS   9          2HD       LYS   9   2.039  15.577   0.491
   62    HD3  LYS   9          1HD       LYS   9   0.860  16.355   1.546
   63    HE2  LYS   9          2HE       LYS   9   2.020  15.483   3.500
   64    HE3  LYS   9          1HE       LYS   9   3.188  14.674   2.458
   65    HZ1  LYS   9          1HZ       LYS   9   3.882  16.830   1.616
   66    HZ2  LYS   9          2HZ       LYS   9   4.070  16.752   3.296
   67    HZ3  LYS   9          3HZ       LYS   9   2.772  17.607   2.629
   68    H    ILE  10           H        ILE  10   3.651  12.189  -2.008
   69    HA   ILE  10           HA       ILE  10   4.810   9.919  -0.584
   70    HB   ILE  10           HB       ILE  10   4.016  10.076  -3.495
   71   HG12  ILE  10          2HG1      ILE  10   2.983   8.345  -1.238
   72   HG13  ILE  10          1HG1      ILE  10   2.124   9.693  -1.978
   73   HG21  ILE  10          1HG2      ILE  10   5.293   7.792  -1.999
   74   HG22  ILE  10          2HG2      ILE  10   6.128   8.854  -3.133
   75   HG23  ILE  10          3HG2      ILE  10   4.826   7.810  -3.699
   76   HD11  ILE  10          1HD1      ILE  10   1.975   8.506  -4.065
   77   HD12  ILE  10          2HD1      ILE  10   1.359   7.489  -2.761
   78   HD13  ILE  10          3HD1      ILE  10   2.964   7.194  -3.426
   79    H    SER  11           H        SER  11   6.756  10.832  -0.085
   80    HA   SER  11           HA       SER  11   8.419  11.750  -2.307
   81    HB2  SER  11          2HB       SER  11   8.499  12.970  -0.122
   82    HB3  SER  11          1HB       SER  11   9.080  11.495   0.649
   83    HG   SER  11           HG       SER  11  10.945  12.395   0.170
   84    H    HIS  12           H        HIS  12  10.846  10.677  -1.765
   85    HA   HIS  12           HA       HIS  12  10.770   8.077  -2.749
   86    HB2  HIS  12          2HB       HIS  12  12.858   9.257  -0.910
   87    HB3  HIS  12          1HB       HIS  12  13.076   7.840  -1.929
   88    HD1  HIS  12          1HD       HIS  12  13.320   8.250  -4.508
   89    HD2  HIS  12          2HD       HIS  12  13.184  11.700  -2.192
   90    HE1  HIS  12          1HE       HIS  12  14.104  10.105  -6.011
   91    HE2  HIS  12          2HE       HIS  12  13.839  12.202  -4.642
   92    H    GLU  13           H        GLU  13  11.119   9.251   0.525
   93    HA   GLU  13           HA       GLU  13  11.285   6.824   1.861
   94    HB2  GLU  13          2HB       GLU  13  10.650   8.153   3.863
   95    HB3  GLU  13          1HB       GLU  13  11.908   8.920   2.883
   96    HG2  GLU  13          2HG       GLU  13  10.111  10.298   1.813
   97    HG3  GLU  13          1HG       GLU  13   8.996   9.659   3.015
   98    H    ASP  14           H        ASP  14   8.426   8.686   0.838
   99    HA   ASP  14           HA       ASP  14   6.708   7.315   2.647
  100    HB2  ASP  14          2HB       ASP  14   6.090   9.067   0.287
  101    HB3  ASP  14          1HB       ASP  14   4.890   8.454   1.421
  102    H    THR  15           H        THR  15   7.291   7.042  -0.868
  103    HA   THR  15           HA       THR  15   5.365   5.029  -1.299
  104    HB   THR  15           HB       THR  15   7.535   4.493  -3.001
  105    HG1  THR  15          1HG       THR  15   7.085   7.187  -3.372
  106   HG21  THR  15          1HG2      THR  15   5.994   5.671  -4.660
  107   HG22  THR  15          2HG2      THR  15   4.907   5.901  -3.293
  108   HG23  THR  15          3HG2      THR  15   5.353   4.273  -3.801
  109    H    GLN  16           H        GLN  16   8.799   4.878  -0.449
  110    HA   GLN  16           HA       GLN  16   9.088   2.105  -0.394
  111    HB2  GLN  16          2HB       GLN  16  10.392   4.209   1.345
  112    HB3  GLN  16          1HB       GLN  16  10.897   2.521   1.290
  113    HG2  GLN  16          2HG       GLN  16  11.414   2.783  -1.075
  114    HG3  GLN  16          1HG       GLN  16  10.896   4.468  -0.992
  115   HE21  GLN  16          1HE2      GLN  16  12.648   5.546  -1.264
  116   HE22  GLN  16          2HE2      GLN  16  14.124   5.400  -0.369
  117    H    ARG  17           H        ARG  17   7.867   4.352   2.014
  118    HA   ARG  17           HA       ARG  17   7.527   2.562   4.140
  119    HB2  ARG  17          2HB       ARG  17   6.237   5.149   3.361
  120    HB3  ARG  17          1HB       ARG  17   5.595   4.231   4.714
  121    HG2  ARG  17          2HG       ARG  17   7.314   4.752   6.053
  122    HG3  ARG  17          1HG       ARG  17   8.495   4.658   4.747
  123    HD2  ARG  17          2HD       ARG  17   7.968   6.819   3.977
  124    HD3  ARG  17          1HD       ARG  17   6.520   6.908   4.988
  125    HE   ARG  17           HE       ARG  17   8.734   6.567   6.657
  126   HH11  ARG  17          1HH1      ARG  17   7.316   8.977   4.553
  127   HH12  ARG  17          2HH1      ARG  17   8.139  10.301   5.319
  128   HH21  ARG  17          1HH2      ARG  17   9.774   8.322   7.692
  129   HH22  ARG  17          2HH2      ARG  17   9.502   9.935   7.119
  130    H    ILE  18           H        ILE  18   5.193   3.619   1.635
  131    HA   ILE  18           HA       ILE  18   3.052   2.157   2.681
  132    HB   ILE  18           HB       ILE  18   3.451   2.986  -0.189
  133   HG12  ILE  18          2HG1      ILE  18   1.598   4.506   1.474
  134   HG13  ILE  18          1HG1      ILE  18   3.251   4.579   2.078
  135   HG21  ILE  18          1HG2      ILE  18   1.010   2.833  -0.312
  136   HG22  ILE  18          2HG2      ILE  18   0.961   2.266   1.361
  137   HG23  ILE  18          3HG2      ILE  18   1.727   1.276   0.114
  138   HD11  ILE  18          1HD1      ILE  18   4.036   5.430   0.010
  139   HD12  ILE  18          2HD1      ILE  18   2.656   6.402   0.522
  140   HD13  ILE  18          3HD1      ILE  18   2.462   5.196  -0.752
  141    H    LYS  19           H        LYS  19   5.327   1.236   0.040
  142    HA   LYS  19           HA       LYS  19   4.063  -1.248  -0.467
  143    HB2  LYS  19          2HB       LYS  19   7.033  -0.967  -0.677
  144    HB3  LYS  19          1HB       LYS  19   5.924  -1.845  -1.724
  145    HG2  LYS  19          2HG       LYS  19   5.034   0.347  -2.521
  146    HG3  LYS  19          1HG       LYS  19   6.334   1.130  -1.619
  147    HD2  LYS  19          2HD       LYS  19   7.225   0.941  -3.754
  148    HD3  LYS  19          1HD       LYS  19   7.881  -0.469  -2.925
  149    HE2  LYS  19          2HE       LYS  19   7.125  -1.154  -5.083
  150    HE3  LYS  19          1HE       LYS  19   6.039  -1.813  -3.863
  151    HZ1  LYS  19          1HZ       LYS  19   5.508   0.648  -5.431
  152    HZ2  LYS  19          2HZ       LYS  19   4.446  -0.111  -4.355
  153    HZ3  LYS  19          3HZ       LYS  19   4.874  -0.875  -5.797
  154    H    THR  20           H        THR  20   6.835  -0.355   1.541
  155    HA   THR  20           HA       THR  20   7.587  -2.952   2.106
  156    HB   THR  20           HB       THR  20   9.041  -0.920   2.406
  157    HG1  THR  20          1HG       THR  20   9.879  -2.764   3.240
  158   HG21  THR  20          1HG2      THR  20   7.478   0.458   3.696
  159   HG22  THR  20          2HG2      THR  20   8.990   0.219   4.578
  160   HG23  THR  20          3HG2      THR  20   7.551  -0.701   5.021
  161    H    ALA  21           H        ALA  21   5.423  -0.772   3.853
  162    HA   ALA  21           HA       ALA  21   5.242  -2.501   6.101
  163    HB1  ALA  21          1HB       ALA  21   4.835  -0.100   6.300
  164    HB2  ALA  21          2HB       ALA  21   3.430  -1.026   6.831
  165    HB3  ALA  21          3HB       ALA  21   3.428  -0.250   5.244
  166    H    PHE  22           H        PHE  22   2.898  -1.587   3.611
  167    HA   PHE  22           HA       PHE  22   0.811  -3.209   4.179
  168    HB2  PHE  22          2HB       PHE  22   0.325  -1.892   2.449
  169    HB3  PHE  22          1HB       PHE  22   1.966  -1.904   1.838
  170    HD1  PHE  22          1HD       PHE  22  -1.113  -3.960   1.943
  171    HD2  PHE  22          2HD       PHE  22   2.418  -2.924  -0.155
  172    HE1  PHE  22          1HE       PHE  22  -1.926  -5.231  -0.034
  173    HE2  PHE  22          2HE       PHE  22   1.656  -4.206  -2.100
  174    HZ   PHE  22           HZ       PHE  22  -0.518  -5.356  -2.047
  175    H    LEU  23           H        LEU  23   3.493  -4.248   2.030
  176    HA   LEU  23           HA       LEU  23   2.507  -6.863   1.634
  177    HB2  LEU  23          2HB       LEU  23   5.386  -5.958   1.563
  178    HB3  LEU  23          1HB       LEU  23   4.702  -7.351   0.747
  179    HG   LEU  23           HG       LEU  23   3.701  -4.605   0.111
  180   HD11  LEU  23          1HD1      LEU  23   6.140  -5.935  -1.068
  181   HD12  LEU  23          2HD1      LEU  23   6.130  -4.488  -0.057
  182   HD13  LEU  23          3HD1      LEU  23   5.384  -4.452  -1.656
  183   HD21  LEU  23          1HD2      LEU  23   3.372  -5.717  -2.102
  184   HD22  LEU  23          2HD2      LEU  23   2.415  -6.391  -0.782
  185   HD23  LEU  23          3HD2      LEU  23   3.863  -7.232  -1.345
  186    H    SER  24           H        SER  24   5.195  -5.728   3.719
  187    HA   SER  24           HA       SER  24   5.833  -8.309   4.678
  188    HB2  SER  24          2HB       SER  24   6.527  -5.779   6.111
  189    HB3  SER  24          1HB       SER  24   7.411  -7.301   6.001
  190    HG   SER  24           HG       SER  24   7.242  -5.205   4.172
  191    H    TYR  25           H        TYR  25   3.579  -5.909   5.709
  192    HA   TYR  25           HA       TYR  25   3.376  -6.728   8.412
  193    HB2  TYR  25          2HB       TYR  25   1.844  -4.914   6.595
  194    HB3  TYR  25          1HB       TYR  25   1.001  -5.543   8.022
  195    HD1  TYR  25          1HD       TYR  25   4.412  -4.179   7.296
  196    HD2  TYR  25          2HD       TYR  25   1.026  -4.169   9.862
  197    HE1  TYR  25          1HE       TYR  25   5.513  -2.514   8.710
  198    HE2  TYR  25          2HE       TYR  25   2.110  -2.496  11.296
  199    HH   TYR  25           HH       TYR  25   4.844  -0.760  10.367
  200    H    ALA  26           H        ALA  26   1.254  -7.289   5.584
  201    HA   ALA  26           HA       ALA  26  -0.465  -8.923   7.199
  202    HB1  ALA  26          1HB       ALA  26  -1.763  -9.235   5.274
  203    HB2  ALA  26          2HB       ALA  26  -0.406  -8.868   4.210
  204    HB3  ALA  26          3HB       ALA  26  -1.136  -7.588   5.181
  205    H    GLN  27           H        GLN  27   1.404  -9.804   4.270
  206    HA   GLN  27           HA       GLN  27   1.407 -12.527   5.366
  207    HB2  GLN  27          2HB       GLN  27   1.563 -11.975   2.417
  208    HB3  GLN  27          1HB       GLN  27   1.090 -13.450   3.254
  209    HG2  GLN  27          2HG       GLN  27  -0.936 -12.290   4.113
  210    HG3  GLN  27          1HG       GLN  27  -0.510 -10.908   3.109
  211   HE21  GLN  27          1HE2      GLN  27  -0.833 -10.991   0.923
  212   HE22  GLN  27          2HE2      GLN  27  -1.707 -12.290   0.157
  213    H    GLY  28           H        GLY  28   3.295  -9.997   4.010
  214    HA2  GLY  28          2HA       GLY  28   5.608  -9.937   3.686
  215    HA3  GLY  28          1HA       GLY  28   5.677 -11.668   3.989
  216    H    GLN  29           H        GLN  29   3.211 -11.682   1.986
  217    HA   GLN  29           HA       GLN  29   4.850 -12.226  -0.339
  218    HB2  GLN  29          2HB       GLN  29   1.852 -12.231  -0.352
  219    HB3  GLN  29          1HB       GLN  29   2.966 -13.253  -1.247
  220    HG2  GLN  29          2HG       GLN  29   3.614 -14.263   0.968
  221    HG3  GLN  29          1HG       GLN  29   2.229 -13.397   1.651
  222   HE21  GLN  29          1HE2      GLN  29   0.132 -14.067   1.061
  223   HE22  GLN  29          2HE2      GLN  29  -0.162 -15.594   0.313
  224    H    ASP  30           H        ASP  30   3.221 -11.532  -2.433
  225    HA   ASP  30           HA       ASP  30   3.654  -8.682  -2.626
  226    HB2  ASP  30          2HB       ASP  30   2.409 -10.586  -4.622
  227    HB3  ASP  30          1HB       ASP  30   2.886  -8.923  -4.945
  228    H    LYS  31           H        LYS  31   1.391 -10.193  -1.018
  229    HA   LYS  31           HA       LYS  31  -0.728  -8.356  -1.805
  230    HB2  LYS  31          2HB       LYS  31  -0.923 -11.345  -1.666
  231    HB3  LYS  31          1HB       LYS  31  -2.320 -10.356  -1.281
  232    HG2  LYS  31          2HG       LYS  31  -1.854  -9.299  -3.616
  233    HG3  LYS  31          1HG       LYS  31  -0.974 -10.800  -3.897
  234    HD2  LYS  31          2HD       LYS  31  -2.959 -12.076  -3.216
  235    HD3  LYS  31          1HD       LYS  31  -3.827 -10.570  -2.954
  236    HE2  LYS  31          2HE       LYS  31  -4.550 -11.388  -4.976
  237    HE3  LYS  31          1HE       LYS  31  -3.471 -10.050  -5.358
  238    HZ1  LYS  31          1HZ       LYS  31  -3.030 -11.904  -6.817
  239    HZ2  LYS  31          2HZ       LYS  31  -2.776 -12.935  -5.504
  240    HZ3  LYS  31          3HZ       LYS  31  -1.701 -11.662  -5.798
  241    H    VAL  32           H        VAL  32  -2.580  -8.624  -0.181
  242    HA   VAL  32           HA       VAL  32  -1.514  -9.093   2.501
  243    HB   VAL  32           HB       VAL  32  -2.767  -6.611   1.416
  244   HG11  VAL  32          1HG1      VAL  32  -4.189  -7.076   3.278
  245   HG12  VAL  32          2HG1      VAL  32  -3.032  -5.842   3.778
  246   HG13  VAL  32          3HG1      VAL  32  -2.814  -7.516   4.285
  247   HG21  VAL  32          1HG2      VAL  32  -0.418  -7.268   3.149
  248   HG22  VAL  32          2HG2      VAL  32  -0.993  -5.631   2.852
  249   HG23  VAL  32          3HG2      VAL  32  -0.418  -6.619   1.510
  250    H    THR  33           H        THR  33  -2.897  -9.805   4.011
  251    HA   THR  33           HA       THR  33  -5.363 -10.993   3.238
  252    HB   THR  33           HB       THR  33  -5.561 -11.512   5.677
  253    HG1  THR  33          1HG       THR  33  -3.941 -10.832   7.061
  254   HG21  THR  33          1HG2      THR  33  -4.358 -13.054   4.216
  255   HG22  THR  33          2HG2      THR  33  -3.586 -12.980   5.798
  256   HG23  THR  33          3HG2      THR  33  -2.879 -12.122   4.431
  257    H    GLU  34           H        GLU  34  -7.281 -10.560   4.861
  258    HA   GLU  34           HA       GLU  34  -8.361  -8.077   4.266
  259    HB2  GLU  34          2HB       GLU  34  -9.640 -10.062   4.904
  260    HB3  GLU  34          1HB       GLU  34  -9.104  -9.873   6.573
  261    HG2  GLU  34          2HG       GLU  34 -11.250  -8.965   6.526
  262    HG3  GLU  34          1HG       GLU  34 -10.181  -7.562   6.458
  263    H    ALA  35           H        ALA  35  -6.125  -8.826   6.799
  264    HA   ALA  35           HA       ALA  35  -7.174  -7.123   8.822
  265    HB1  ALA  35          1HB       ALA  35  -5.795  -9.083   9.330
  266    HB2  ALA  35          2HB       ALA  35  -5.126  -7.605  10.028
  267    HB3  ALA  35          3HB       ALA  35  -4.413  -8.291   8.569
  268    H    MET  36           H        MET  36  -4.125  -6.885   6.966
  269    HA   MET  36           HA       MET  36  -3.624  -4.212   7.703
  270    HB2  MET  36          2HB       MET  36  -2.440  -6.186   5.949
  271    HB3  MET  36          1HB       MET  36  -2.430  -4.605   5.205
  272    HG2  MET  36          2HG       MET  36  -1.581  -4.365   7.910
  273    HG3  MET  36          1HG       MET  36  -0.654  -5.638   7.115
  274    HE1  MET  36          1HE       MET  36  -2.331  -2.515   5.595
  275    HE2  MET  36          2HE       MET  36  -1.005  -1.358   5.465
  276    HE3  MET  36          3HE       MET  36  -1.628  -1.812   7.049
  277    H    ILE  37           H        ILE  37  -5.628  -5.703   5.319
  278    HA   ILE  37           HA       ILE  37  -5.835  -3.474   3.561
  279    HB   ILE  37           HB       ILE  37  -7.243  -6.041   3.904
  280   HG12  ILE  37          2HG1      ILE  37  -5.901  -6.475   2.168
  281   HG13  ILE  37          1HG1      ILE  37  -6.713  -5.221   1.263
  282   HG21  ILE  37          1HG2      ILE  37  -9.114  -4.540   3.686
  283   HG22  ILE  37          2HG2      ILE  37  -8.867  -5.416   2.175
  284   HG23  ILE  37          3HG2      ILE  37  -8.348  -3.736   2.317
  285   HD11  ILE  37          1HD1      ILE  37  -5.163  -3.580   1.889
  286   HD12  ILE  37          2HD1      ILE  37  -4.252  -4.991   1.364
  287   HD13  ILE  37          3HD1      ILE  37  -4.424  -4.646   3.083
  288    H    ASP  38           H        ASP  38  -7.827  -4.722   6.213
  289    HA   ASP  38           HA       ASP  38  -9.851  -2.886   6.336
  290    HB2  ASP  38          2HB       ASP  38  -9.467  -5.025   7.574
  291    HB3  ASP  38          1HB       ASP  38  -8.390  -4.142   8.643
  292    H    GLN  39           H        GLN  39  -6.583  -2.677   7.723
  293    HA   GLN  39           HA       GLN  39  -7.075  -0.387   9.298
  294    HB2  GLN  39          2HB       GLN  39  -4.904  -0.563   9.930
  295    HB3  GLN  39          1HB       GLN  39  -4.978  -2.099   9.090
  296    HG2  GLN  39          2HG       GLN  39  -3.015  -1.173   8.312
  297    HG3  GLN  39          1HG       GLN  39  -4.157  -0.770   7.037
  298   HE21  GLN  39          1HE2      GLN  39  -2.960   0.968   6.308
  299   HE22  GLN  39          2HE2      GLN  39  -2.804   2.431   7.212
  300    H    LEU  40           H        LEU  40  -5.828  -0.807   6.021
  301    HA   LEU  40           HA       LEU  40  -5.427   1.937   5.491
  302    HB2  LEU  40          2HB       LEU  40  -4.417   0.187   4.128
  303    HB3  LEU  40          1HB       LEU  40  -6.006  -0.327   3.566
  304    HG   LEU  40           HG       LEU  40  -6.003   2.296   2.843
  305   HD11  LEU  40          1HD1      LEU  40  -3.433   1.844   3.675
  306   HD12  LEU  40          2HD1      LEU  40  -3.953   3.153   2.603
  307   HD13  LEU  40          3HD1      LEU  40  -3.318   1.648   1.924
  308   HD21  LEU  40          1HD2      LEU  40  -4.915  -0.050   1.285
  309   HD22  LEU  40          2HD2      LEU  40  -5.442   1.482   0.588
  310   HD23  LEU  40          3HD2      LEU  40  -6.608   0.437   1.401
  311    H    ILE  41           H        ILE  41  -8.119  -0.236   4.616
  312    HA   ILE  41           HA       ILE  41  -9.589   1.757   3.288
  313    HB   ILE  41           HB       ILE  41 -10.465  -0.845   4.522
  314   HG12  ILE  41          2HG1      ILE  41  -8.880  -0.752   2.528
  315   HG13  ILE  41          1HG1      ILE  41 -10.334  -1.715   2.317
  316   HG21  ILE  41          1HG2      ILE  41 -12.070   1.058   2.819
  317   HG22  ILE  41          2HG2      ILE  41 -12.400   0.596   4.490
  318   HG23  ILE  41          3HG2      ILE  41 -12.541  -0.596   3.201
  319   HD11  ILE  41          1HD1      ILE  41 -11.346   0.118   1.058
  320   HD12  ILE  41          2HD1      ILE  41  -9.823  -0.410   0.337
  321   HD13  ILE  41          3HD1      ILE  41  -9.880   1.075   1.286
  322    H    CYS  42           H        CYS  42  -9.657   0.736   6.687
  323    HA   CYS  42           HA       CYS  42 -11.926   2.368   7.326
  324    HB2  CYS  42          2HB       CYS  42 -11.285   0.350   8.640
  325    HB3  CYS  42          1HB       CYS  42  -9.849   1.203   9.195
  326    HG   CYS  42           HG       CYS  42 -11.666   3.317  10.244
  327    H    GLY  43           H        GLY  43  -8.614   2.908   6.849
  328    HA2  GLY  43          2HA       GLY  43  -8.046   5.075   8.500
  329    HA3  GLY  43          1HA       GLY  43  -7.338   4.803   6.916
  330    H    ALA  44           H        ALA  44  -9.391   5.203   5.176
  331    HA   ALA  44           HA       ALA  44  -9.810   8.080   5.510
  332    HB1  ALA  44          1HB       ALA  44 -10.191   6.342   3.077
  333    HB2  ALA  44          2HB       ALA  44  -8.779   7.340   3.438
  334    HB3  ALA  44          3HB       ALA  44 -10.343   8.100   3.130
  335    H    PHE  45           H        PHE  45 -11.675   5.150   4.750
  336    HA   PHE  45           HA       PHE  45 -14.072   6.613   5.618
  337    HB2  PHE  45          2HB       PHE  45 -15.010   4.519   4.113
  338    HB3  PHE  45          1HB       PHE  45 -15.009   6.235   3.693
  339    HD1  PHE  45          1HD       PHE  45 -12.672   3.361   3.694
  340    HD2  PHE  45          2HD       PHE  45 -14.100   6.769   1.604
  341    HE1  PHE  45          1HE       PHE  45 -11.172   2.823   1.815
  342    HE2  PHE  45          2HE       PHE  45 -12.590   6.256  -0.275
  343    HZ   PHE  45           HZ       PHE  45 -11.109   4.280  -0.164
  344    HA   PRO  46           HA       PRO  46 -14.207   3.127   8.337
  345    HB2  PRO  46          2HB       PRO  46 -14.874   4.524  10.518
  346    HB3  PRO  46          1HB       PRO  46 -13.225   4.475   9.905
  347    HG2  PRO  46          2HG       PRO  46 -15.240   6.647   9.719
  348    HG3  PRO  46          1HG       PRO  46 -13.477   6.761   9.809
  349    HD2  PRO  46          2HD       PRO  46 -15.081   6.911   7.455
  350    HD3  PRO  46          1HD       PRO  46 -13.311   6.811   7.541
  351    H    GLY  47           H        GLY  47 -16.018   2.433   9.859
  352    HA2  GLY  47          2HA       GLY  47 -18.262   2.194  10.398
  353    HA3  GLY  47          1HA       GLY  47 -18.619   3.603   9.411
  354    H    LEU  48           H        LEU  48 -16.735   1.191   7.906
  355    HA   LEU  48           HA       LEU  48 -18.914   0.603   6.084
  356    HB2  LEU  48          2HB       LEU  48 -16.054  -0.362   6.087
  357    HB3  LEU  48          1HB       LEU  48 -17.211  -0.633   4.802
  358    HG   LEU  48           HG       LEU  48 -15.943   1.976   5.622
  359   HD11  LEU  48          1HD1      LEU  48 -15.129   1.950   3.321
  360   HD12  LEU  48          2HD1      LEU  48 -15.940   0.406   3.049
  361   HD13  LEU  48          3HD1      LEU  48 -14.611   0.511   4.202
  362   HD21  LEU  48          1HD2      LEU  48 -18.172   1.522   3.640
  363   HD22  LEU  48          2HD2      LEU  48 -17.277   3.026   3.850
  364   HD23  LEU  48          3HD2      LEU  48 -18.289   2.413   5.158
  365    H    SER  49           H        SER  49 -20.196  -1.126   6.287
  366    HA   SER  49           HA       SER  49 -19.606  -3.286   8.061
  367    HB2  SER  49          2HB       SER  49 -21.584  -3.325   5.774
  368    HB3  SER  49          1HB       SER  49 -21.642  -4.261   7.271
  369    HG   SER  49           HG       SER  49 -22.330  -2.535   8.353
  370    H    TRP  50           H        TRP  50 -19.294  -5.604   7.216
  371    HA   TRP  50           HA       TRP  50 -16.977  -5.526   5.641
  372    HB2  TRP  50          2HB       TRP  50 -17.491  -7.349   7.279
  373    HB3  TRP  50          1HB       TRP  50 -18.640  -7.998   6.109
  374    HD1  TRP  50           HD       TRP  50 -14.865  -7.135   6.203
  375    HE1  TRP  50          1HE       TRP  50 -13.659  -8.830   4.679
  376    HE3  TRP  50          3HE       TRP  50 -18.930  -9.718   4.521
  377    HZ2  TRP  50          2HZ       TRP  50 -14.376 -10.971   3.019
  378    HZ3  TRP  50          3HZ       TRP  50 -18.581 -11.584   2.961
  379    HH2  TRP  50           HH       TRP  50 -16.344 -12.199   2.220
  380    H    GLU  51           H        GLU  51 -20.319  -6.185   4.769
  381    HA   GLU  51           HA       GLU  51 -19.901  -7.072   2.141
  382    HB2  GLU  51          2HB       GLU  51 -22.187  -5.390   3.187
  383    HB3  GLU  51          1HB       GLU  51 -22.193  -6.310   1.690
  384    HG2  GLU  51          2HG       GLU  51 -22.033  -7.421   4.474
  385    HG3  GLU  51          1HG       GLU  51 -23.406  -7.494   3.394
  386    H    GLN  52           H        GLN  52 -20.203  -3.821   3.461
  387    HA   GLN  52           HA       GLN  52 -20.058  -2.466   0.959
  388    HB2  GLN  52          2HB       GLN  52 -21.128  -1.462   2.909
  389    HB3  GLN  52          1HB       GLN  52 -19.610  -1.498   3.791
  390    HG2  GLN  52          2HG       GLN  52 -20.115   0.736   3.003
  391    HG3  GLN  52          1HG       GLN  52 -18.655   0.112   2.237
  392   HE21  GLN  52          1HE2      GLN  52 -18.638  -0.269   0.062
  393   HE22  GLN  52          2HE2      GLN  52 -19.901   0.255  -0.999
  394    H    LEU  53           H        LEU  53 -17.720  -3.508   3.350
  395    HA   LEU  53           HA       LEU  53 -15.585  -1.952   2.229
  396    HB2  LEU  53          2HB       LEU  53 -15.671  -2.516   4.616
  397    HB3  LEU  53          1HB       LEU  53 -15.507  -4.213   4.223
  398    HG   LEU  53           HG       LEU  53 -13.371  -2.324   3.327
  399   HD11  LEU  53          1HD1      LEU  53 -12.212  -2.602   5.460
  400   HD12  LEU  53          2HD1      LEU  53 -13.616  -3.447   6.115
  401   HD13  LEU  53          3HD1      LEU  53 -13.738  -1.745   5.669
  402   HD21  LEU  53          1HD2      LEU  53 -11.951  -4.265   3.639
  403   HD22  LEU  53          2HD2      LEU  53 -13.336  -4.685   2.630
  404   HD23  LEU  53          3HD2      LEU  53 -13.301  -5.170   4.324
  405    H    GLN  54           H        GLN  54 -16.737  -5.273   1.963
  406    HA   GLN  54           HA       GLN  54 -14.484  -6.272   0.592
  407    HB2  GLN  54          2HB       GLN  54 -15.719  -8.215   0.180
  408    HB3  GLN  54          1HB       GLN  54 -16.304  -7.614   1.710
  409    HG2  GLN  54          2HG       GLN  54 -18.331  -6.902   0.800
  410    HG3  GLN  54          1HG       GLN  54 -17.717  -6.992  -0.850
  411   HE21  GLN  54          1HE2      GLN  54 -18.969  -8.800   1.848
  412   HE22  GLN  54          2HE2      GLN  54 -19.262 -10.262   0.977
  413    H    GLU  55           H        GLU  55 -17.490  -4.768  -0.523
  414    HA   GLU  55           HA       GLU  55 -16.876  -5.072  -3.283
  415    HB2  GLU  55          2HB       GLU  55 -18.666  -3.444  -3.696
  416    HB3  GLU  55          1HB       GLU  55 -19.177  -4.716  -2.598
  417    HG2  GLU  55          2HG       GLU  55 -19.000  -3.251  -0.728
  418    HG3  GLU  55          1HG       GLU  55 -18.264  -2.011  -1.698
  419    H    LYS  56           H        LYS  56 -16.052  -2.732  -0.839
  420    HA   LYS  56           HA       LYS  56 -15.128  -0.582  -2.286
  421    HB2  LYS  56          2HB       LYS  56 -14.911  -1.337   0.321
  422    HB3  LYS  56          1HB       LYS  56 -13.241  -1.559  -0.216
  423    HG2  LYS  56          2HG       LYS  56 -13.384   0.640   0.640
  424    HG3  LYS  56          1HG       LYS  56 -13.386   0.816  -1.118
  425    HD2  LYS  56          2HD       LYS  56 -15.878   0.929  -1.030
  426    HD3  LYS  56          1HD       LYS  56 -15.769   0.940   0.729
  427    HE2  LYS  56          2HE       LYS  56 -15.995   3.196   0.080
  428    HE3  LYS  56          1HE       LYS  56 -14.294   2.981   0.492
  429    HZ1  LYS  56          1HZ       LYS  56 -14.561   4.243  -1.547
  430    HZ2  LYS  56          2HZ       LYS  56 -15.421   2.973  -2.256
  431    HZ3  LYS  56          3HZ       LYS  56 -13.789   2.774  -1.866
  432    H    LYS  57           H        LYS  57 -13.296  -3.504  -1.431
  433    HA   LYS  57           HA       LYS  57 -11.223  -2.705  -3.337
  434    HB2  LYS  57          2HB       LYS  57 -10.606  -5.119  -1.901
  435    HB3  LYS  57          1HB       LYS  57  -9.772  -3.576  -1.879
  436    HG2  LYS  57          2HG       LYS  57 -10.337  -3.658   0.295
  437    HG3  LYS  57          1HG       LYS  57 -11.837  -2.956  -0.313
  438    HD2  LYS  57          2HD       LYS  57 -12.811  -4.665   0.757
  439    HD3  LYS  57          1HD       LYS  57 -12.320  -5.611  -0.648
  440    HE2  LYS  57          2HE       LYS  57 -10.286  -6.312   0.514
  441    HE3  LYS  57          1HE       LYS  57 -10.720  -5.314   1.891
  442    HZ1  LYS  57          1HZ       LYS  57 -11.939  -7.838   0.986
  443    HZ2  LYS  57          2HZ       LYS  57 -12.851  -6.738   1.890
  444    HZ3  LYS  57          3HZ       LYS  57 -11.432  -7.384   2.545
  445    H    LYS  58           H        LYS  58 -13.972  -4.215  -3.686
  446    HA   LYS  58           HA       LYS  58 -13.522  -6.699  -4.830
  447    HB2  LYS  58          2HB       LYS  58 -15.612  -4.665  -4.961
  448    HB3  LYS  58          1HB       LYS  58 -15.477  -5.599  -6.442
  449    HG2  LYS  58          2HG       LYS  58 -15.770  -6.820  -3.708
  450    HG3  LYS  58          1HG       LYS  58 -17.116  -6.492  -4.800
  451    HD2  LYS  58          2HD       LYS  58 -16.060  -7.939  -6.491
  452    HD3  LYS  58          1HD       LYS  58 -14.770  -8.306  -5.345
  453    HE2  LYS  58          2HE       LYS  58 -16.352  -9.326  -3.833
  454    HE3  LYS  58          1HE       LYS  58 -17.695  -8.860  -4.876
  455    HZ1  LYS  58          1HZ       LYS  58 -15.519 -10.744  -5.594
  456    HZ2  LYS  58          2HZ       LYS  58 -16.797 -10.290  -6.603
  457    HZ3  LYS  58          3HZ       LYS  58 -17.105 -11.172  -5.194
  458    H    GLY  59           H        GLY  59 -13.355  -7.375  -7.024
  459    HA2  GLY  59          2HA       GLY  59 -12.847  -6.991  -9.306
  460    HA3  GLY  59          1HA       GLY  59 -12.288  -5.378  -8.886
  461    H    ARG  60           H        ARG  60 -10.372  -5.479  -7.221
  462    HA   ARG  60           HA       ARG  60  -8.458  -7.214  -8.580
  463    HB2  ARG  60          2HB       ARG  60  -8.271  -4.627  -8.552
  464    HB3  ARG  60          1HB       ARG  60  -7.644  -4.860  -6.923
  465    HG2  ARG  60          2HG       ARG  60  -5.890  -4.687  -8.675
  466    HG3  ARG  60          1HG       ARG  60  -5.825  -6.181  -7.737
  467    HD2  ARG  60          2HD       ARG  60  -6.851  -7.422  -9.499
  468    HD3  ARG  60          1HD       ARG  60  -7.215  -5.949 -10.400
  469    HE   ARG  60           HE       ARG  60  -4.415  -6.264  -9.954
  470   HH11  ARG  60          1HH1      ARG  60  -7.084  -7.318 -11.954
  471   HH12  ARG  60          2HH1      ARG  60  -6.074  -7.794 -13.279
  472   HH21  ARG  60          1HH2      ARG  60  -3.080  -6.885 -11.696
  473   HH22  ARG  60          2HH2      ARG  60  -3.793  -7.541 -13.136
  474    H    ALA  61           H        ALA  61  -9.549  -6.275  -5.358
  475    HA   ALA  61           HA       ALA  61  -7.712  -8.189  -4.150
  476    HB1  ALA  61          1HB       ALA  61  -9.967  -6.849  -2.689
  477    HB2  ALA  61          2HB       ALA  61  -8.481  -5.981  -3.047
  478    HB3  ALA  61          3HB       ALA  61  -8.428  -7.434  -2.050
  479    H    ALA  62           H        ALA  62 -10.730  -8.026  -5.569
  480    HA   ALA  62           HA       ALA  62 -12.471  -9.425  -5.882
  481    HB1  ALA  62          1HB       ALA  62 -10.578 -11.551  -4.884
  482    HB2  ALA  62          2HB       ALA  62 -10.708 -10.991  -6.551
  483    HB3  ALA  62          3HB       ALA  62 -12.068 -11.821  -5.790
  484    H    ALA  63           H        ALA  63 -11.360 -11.427  -3.229
  485    HA   ALA  63           HA       ALA  63 -13.376 -10.165  -1.491
  486    HB1  ALA  63          1HB       ALA  63 -13.537 -12.296  -0.296
  487    HB2  ALA  63          2HB       ALA  63 -12.361 -13.011  -1.399
  488    HB3  ALA  63          3HB       ALA  63 -13.937 -12.496  -2.001
  489    H    ASN  64           H        ASN  64 -10.467 -12.190  -1.200
  490    HA   ASN  64           HA       ASN  64  -9.295 -10.148   0.545
  491    HB2  ASN  64          2HB       ASN  64  -9.492 -13.102   1.086
  492    HB3  ASN  64          1HB       ASN  64  -8.262 -12.102   1.846
  493   HD21  ASN  64          1HD2      ASN  64  -9.843  -9.773   2.096
  494   HD22  ASN  64          2HD2      ASN  64 -11.036 -10.060   3.320
  495    H    GLY  65           H        GLY  65  -7.417  -9.508  -0.110
  496    HA2  GLY  65          2HA       GLY  65  -5.120 -10.550  -0.699
  497    HA3  GLY  65          1HA       GLY  65  -5.979 -11.111  -2.136
  498    H    TYR  66           H        TYR  66  -5.441  -8.063  -0.307
  499    HA   TYR  66           HA       TYR  66  -5.554  -6.556  -2.759
  500    HB2  TYR  66          2HB       TYR  66  -5.662  -5.848  -0.046
  501    HB3  TYR  66          1HB       TYR  66  -4.149  -5.186  -0.645
  502    HD1  TYR  66          1HD       TYR  66  -5.154  -3.021  -0.012
  503    HD2  TYR  66          2HD       TYR  66  -6.770  -5.371  -3.142
  504    HE1  TYR  66          1HE       TYR  66  -6.310  -1.033  -0.878
  505    HE2  TYR  66          2HE       TYR  66  -7.943  -3.407  -4.025
  506    HH   TYR  66           HH       TYR  66  -7.257  -0.244  -2.999
  507    H    ASP  67           H        ASP  67  -4.069  -6.413  -4.155
  508    HA   ASP  67           HA       ASP  67  -1.407  -7.325  -3.451
  509    HB2  ASP  67          2HB       ASP  67  -1.236  -8.098  -5.626
  510    HB3  ASP  67          1HB       ASP  67  -2.972  -8.261  -5.322
  511    H    ARG  68           H        ARG  68   0.288  -6.230  -4.680
  512    HA   ARG  68           HA       ARG  68   0.438  -3.723  -3.494
  513    HB2  ARG  68          2HB       ARG  68   2.647  -3.545  -4.525
  514    HB3  ARG  68          1HB       ARG  68   2.385  -5.153  -3.865
  515    HG2  ARG  68          2HG       ARG  68   1.859  -5.977  -6.112
  516    HG3  ARG  68          1HG       ARG  68   2.179  -4.367  -6.761
  517    HD2  ARG  68          2HD       ARG  68   4.480  -4.542  -5.780
  518    HD3  ARG  68          1HD       ARG  68   4.119  -6.228  -5.408
  519    HE   ARG  68           HE       ARG  68   3.571  -5.782  -8.115
  520   HH11  ARG  68          1HH1      ARG  68   6.281  -5.996  -5.919
  521   HH12  ARG  68          2HH1      ARG  68   7.418  -6.404  -7.158
  522   HH21  ARG  68          1HH2      ARG  68   5.047  -6.340  -9.749
  523   HH22  ARG  68          2HH2      ARG  68   6.711  -6.621  -9.347
  524    H    SER  69           H        SER  69  -0.429  -4.571  -6.794
  525    HA   SER  69           HA       SER  69  -0.146  -1.905  -7.795
  526    HB2  SER  69          2HB       SER  69  -1.873  -4.144  -8.874
  527    HB3  SER  69          1HB       SER  69  -1.348  -2.704  -9.744
  528    HG   SER  69           HG       SER  69   0.745  -3.448  -9.714
  529    H    ALA  70           H        ALA  70  -2.838  -3.846  -6.580
  530    HA   ALA  70           HA       ALA  70  -4.869  -1.910  -6.952
  531    HB1  ALA  70          1HB       ALA  70  -5.196  -4.380  -6.545
  532    HB2  ALA  70          2HB       ALA  70  -6.242  -3.310  -5.613
  533    HB3  ALA  70          3HB       ALA  70  -4.844  -4.061  -4.842
  534    H    PHE  71           H        PHE  71  -2.996  -2.900  -4.138
  535    HA   PHE  71           HA       PHE  71  -4.120  -1.114  -2.308
  536    HB2  PHE  71          2HB       PHE  71  -2.794  -3.080  -1.643
  537    HB3  PHE  71          1HB       PHE  71  -1.350  -2.341  -2.311
  538    HD1  PHE  71          1HD       PHE  71  -3.675  -2.378   0.470
  539    HD2  PHE  71          2HD       PHE  71  -0.302  -0.431  -1.207
  540    HE1  PHE  71          1HE       PHE  71  -3.249  -1.297   2.628
  541    HE2  PHE  71          2HE       PHE  71   0.133   0.650   0.951
  542    HZ   PHE  71           HZ       PHE  71  -1.337   0.233   2.863
  543    H    PHE  72           H        PHE  72  -1.211  -0.820  -4.348
  544    HA   PHE  72           HA       PHE  72  -0.420   1.674  -3.294
  545    HB2  PHE  72          2HB       PHE  72   1.124   0.221  -4.536
  546    HB3  PHE  72          1HB       PHE  72   0.205   0.516  -6.009
  547    HD1  PHE  72          1HD       PHE  72   1.836   2.485  -3.294
  548    HD2  PHE  72          2HD       PHE  72   1.060   2.074  -7.457
  549    HE1  PHE  72          1HE       PHE  72   3.206   4.473  -3.741
  550    HE2  PHE  72          2HE       PHE  72   2.433   4.064  -7.913
  551    HZ   PHE  72           HZ       PHE  72   3.507   5.268  -6.053
  552    H    SER  73           H        SER  73  -2.491   0.785  -5.959
  553    HA   SER  73           HA       SER  73  -2.726   3.297  -7.176
  554    HB2  SER  73          2HB       SER  73  -3.485   1.105  -8.145
  555    HB3  SER  73          1HB       SER  73  -4.863   1.155  -7.047
  556    HG   SER  73           HG       SER  73  -4.457   3.432  -8.568
  557    H    LEU  74           H        LEU  74  -4.455   1.844  -4.472
  558    HA   LEU  74           HA       LEU  74  -6.363   3.959  -4.220
  559    HB2  LEU  74          2HB       LEU  74  -6.788   1.674  -3.400
  560    HB3  LEU  74          1HB       LEU  74  -5.498   1.860  -2.230
  561    HG   LEU  74           HG       LEU  74  -6.758   3.499  -1.004
  562   HD11  LEU  74          1HD1      LEU  74  -8.817   3.269  -3.198
  563   HD12  LEU  74          2HD1      LEU  74  -7.804   4.673  -2.861
  564   HD13  LEU  74          3HD1      LEU  74  -9.018   4.161  -1.690
  565   HD21  LEU  74          1HD2      LEU  74  -7.260   1.231  -0.456
  566   HD22  LEU  74          2HD2      LEU  74  -8.368   1.097  -1.819
  567   HD23  LEU  74          3HD2      LEU  74  -8.775   2.137  -0.450
  568    H    VAL  75           H        VAL  75  -3.369   3.103  -2.510
  569    HA   VAL  75           HA       VAL  75  -3.535   5.183  -0.594
  570    HB   VAL  75           HB       VAL  75  -1.015   3.802  -1.529
  571   HG11  VAL  75          1HG1      VAL  75  -0.224   5.376  -0.121
  572   HG12  VAL  75          2HG1      VAL  75  -0.602   4.089   1.032
  573   HG13  VAL  75          3HG1      VAL  75  -1.713   5.444   0.819
  574   HG21  VAL  75          1HG2      VAL  75  -1.489   2.322   0.491
  575   HG22  VAL  75          2HG2      VAL  75  -2.415   2.017  -0.983
  576   HG23  VAL  75          3HG2      VAL  75  -3.153   2.895   0.358
  577    H    ALA  76           H        ALA  76  -1.890   4.950  -3.729
  578    HA   ALA  76           HA       ALA  76  -0.409   7.339  -3.515
  579    HB1  ALA  76          1HB       ALA  76  -1.384   5.987  -6.024
  580    HB2  ALA  76          2HB       ALA  76   0.087   5.574  -5.147
  581    HB3  ALA  76          3HB       ALA  76  -0.070   7.158  -5.905
  582    H    SER  77           H        SER  77  -3.720   6.899  -3.828
  583    HA   SER  77           HA       SER  77  -4.098   9.537  -5.053
  584    HB2  SER  77          2HB       SER  77  -6.172   7.413  -4.475
  585    HB3  SER  77          1HB       SER  77  -6.378   8.852  -5.473
  586    HG   SER  77           HG       SER  77  -5.073   6.445  -6.035
  587    H    ASP  78           H        ASP  78  -3.914   8.044  -2.067
  588    HA   ASP  78           HA       ASP  78  -5.596  10.097  -0.793
  589    HB2  ASP  78          2HB       ASP  78  -5.525   7.142  -0.401
  590    HB3  ASP  78          1HB       ASP  78  -5.886   8.177   0.977
  591    H    GLU  79           H        GLU  79  -4.207  11.455   0.135
  592    HA   GLU  79           HA       GLU  79  -1.568  10.773   0.891
  593    HB2  GLU  79          2HB       GLU  79  -1.291  12.983   1.282
  594    HB3  GLU  79          1HB       GLU  79  -2.798  13.102   0.392
  595    HG2  GLU  79          2HG       GLU  79  -4.013  13.115   2.550
  596    HG3  GLU  79          1HG       GLU  79  -2.451  13.127   3.380
  597    H    GLN  80           H        GLN  80  -4.583  10.776   2.701
  598    HA   GLN  80           HA       GLN  80  -3.313  10.621   5.240
  599    HB2  GLN  80          2HB       GLN  80  -5.405  10.486   6.128
  600    HB3  GLN  80          1HB       GLN  80  -5.828  11.076   4.536
  601    HG2  GLN  80          2HG       GLN  80  -5.744   8.211   4.576
  602    HG3  GLN  80          1HG       GLN  80  -6.822   8.841   5.822
  603   HE21  GLN  80          1HE2      GLN  80  -6.240   8.506   2.460
  604   HE22  GLN  80          2HE2      GLN  80  -7.780   9.067   1.915
  605    H    TYR  81           H        TYR  81  -3.746   8.479   2.684
  606    HA   TYR  81           HA       TYR  81  -3.588   6.047   4.241
  607    HB2  TYR  81          2HB       TYR  81  -3.913   6.633   1.314
  608    HB3  TYR  81          1HB       TYR  81  -3.398   5.034   1.844
  609    HD1  TYR  81          1HD       TYR  81  -5.761   4.962   0.347
  610    HD2  TYR  81          2HD       TYR  81  -5.348   6.032   4.440
  611    HE1  TYR  81          1HE       TYR  81  -8.089   4.229   0.769
  612    HE2  TYR  81          2HE       TYR  81  -7.645   5.345   4.853
  613    HH   TYR  81           HH       TYR  81  -9.447   3.513   2.657
  614    H    VAL  82           H        VAL  82  -1.577   7.915   1.988
  615    HA   VAL  82           HA       VAL  82   0.567   6.163   1.939
  616    HB   VAL  82           HB       VAL  82   1.810   8.145   1.249
  617   HG11  VAL  82          1HG1      VAL  82   0.523   8.624  -0.812
  618   HG12  VAL  82          2HG1      VAL  82  -0.809   7.714  -0.093
  619   HG13  VAL  82          3HG1      VAL  82   0.715   6.906  -0.459
  620   HG21  VAL  82          1HG2      VAL  82   1.022   9.924   2.447
  621   HG22  VAL  82          2HG2      VAL  82  -0.637   9.604   1.946
  622   HG23  VAL  82          3HG2      VAL  82   0.528  10.238   0.780
  623    H    ARG  83           H        ARG  83  -0.005   9.036   3.862
  624    HA   ARG  83           HA       ARG  83   2.208   8.674   5.572
  625    HB2  ARG  83          2HB       ARG  83  -0.231  10.171   6.434
  626    HB3  ARG  83          1HB       ARG  83   1.440  10.466   6.850
  627    HG2  ARG  83          2HG       ARG  83   1.895  11.350   4.683
  628    HG3  ARG  83          1HG       ARG  83   0.288  10.899   4.115
  629    HD2  ARG  83          2HD       ARG  83  -0.443  12.825   4.728
  630    HD3  ARG  83          1HD       ARG  83  -0.149  12.379   6.404
  631    HE   ARG  83           HE       ARG  83   2.238  13.329   5.210
  632   HH11  ARG  83          1HH1      ARG  83  -0.838  14.468   6.429
  633   HH12  ARG  83          2HH1      ARG  83  -0.216  16.006   6.939
  634   HH21  ARG  83          1HH2      ARG  83   3.076  15.342   5.905
  635   HH22  ARG  83          2HH2      ARG  83   2.014  16.505   6.636
  636    H    PHE  84           H        PHE  84  -1.043   7.404   5.557
  637    HA   PHE  84           HA       PHE  84  -1.279   6.739   8.273
  638    HB2  PHE  84          2HB       PHE  84  -2.731   6.120   5.997
  639    HB3  PHE  84          1HB       PHE  84  -2.138   4.544   6.537
  640    HD1  PHE  84          1HD       PHE  84  -2.854   3.608   8.627
  641    HD2  PHE  84          2HD       PHE  84  -4.268   7.409   7.354
  642    HE1  PHE  84          1HE       PHE  84  -4.625   3.521  10.335
  643    HE2  PHE  84          2HE       PHE  84  -6.041   7.329   9.057
  644    HZ   PHE  84           HZ       PHE  84  -6.223   5.382  10.552
  645    H    ILE  85           H        ILE  85   0.272   4.979   5.643
  646    HA   ILE  85           HA       ILE  85   1.252   2.929   7.413
  647    HB   ILE  85           HB       ILE  85   1.630   3.489   4.506
  648   HG12  ILE  85          2HG1      ILE  85   0.812   1.085   6.154
  649   HG13  ILE  85          1HG1      ILE  85  -0.256   2.125   5.217
  650   HG21  ILE  85          1HG2      ILE  85   3.882   3.074   5.135
  651   HG22  ILE  85          2HG2      ILE  85   3.264   1.571   4.449
  652   HG23  ILE  85          3HG2      ILE  85   3.408   1.751   6.195
  653   HD11  ILE  85          1HD1      ILE  85   0.825   1.349   3.157
  654   HD12  ILE  85          2HD1      ILE  85   0.130   0.022   4.085
  655   HD13  ILE  85          3HD1      ILE  85   1.873   0.286   4.107
  656    H    ALA  86           H        ALA  86   2.693   5.716   5.758
  657    HA   ALA  86           HA       ALA  86   5.294   5.586   6.610
  658    HB1  ALA  86          1HB       ALA  86   3.687   8.135   6.589
  659    HB2  ALA  86          2HB       ALA  86   4.249   7.334   5.125
  660    HB3  ALA  86          3HB       ALA  86   5.415   7.949   6.300
  661    H    GLN  87           H        GLN  87   2.497   6.655   8.472
  662    HA   GLN  87           HA       GLN  87   3.968   7.557  10.715
  663    HB2  GLN  87          2HB       GLN  87   1.083   6.741  10.409
  664    HB3  GLN  87          1HB       GLN  87   1.753   7.381  11.902
  665    HG2  GLN  87          2HG       GLN  87   2.302   9.464  10.794
  666    HG3  GLN  87          1HG       GLN  87   1.711   8.822   9.261
  667   HE21  GLN  87          1HE2      GLN  87   0.836  11.156  10.747
  668   HE22  GLN  87          2HE2      GLN  87  -0.849  10.922  11.063
  669    H    HIS  88           H        HIS  88   2.317   4.567   9.868
  670    HA   HIS  88           HA       HIS  88   2.781   3.242  12.345
  671    HB2  HIS  88          2HB       HIS  88   2.081   2.183   9.603
  672    HB3  HIS  88          1HB       HIS  88   2.235   1.154  11.018
  673    HD1  HIS  88          1HD       HIS  88   0.709   3.139  12.987
  674    HD2  HIS  88          2HD       HIS  88  -0.623   1.834   9.269
  675    HE1  HIS  88          1HE       HIS  88  -1.796   3.328  13.059
  676    HE2  HIS  88          2HE       HIS  88  -2.586   2.359  10.872
  677    H    PHE  89           H        PHE  89   4.629   3.531   9.367
  678    HA   PHE  89           HA       PHE  89   6.808   2.017  10.578
  679    HB2  PHE  89          2HB       PHE  89   5.233   0.453   9.338
  680    HB3  PHE  89          1HB       PHE  89   5.747   1.257   7.864
  681    HD1  PHE  89          1HD       PHE  89   7.418   0.293   6.668
  682    HD2  PHE  89          2HD       PHE  89   7.267  -0.369  10.862
  683    HE1  PHE  89          1HE       PHE  89   9.305  -1.278   6.478
  684    HE2  PHE  89          2HE       PHE  89   9.171  -1.919  10.691
  685    HZ   PHE  89           HZ       PHE  89  10.192  -2.375   8.497
  686    HA   PRO  90           HA       PRO  90   9.084   5.417   8.571
  687    HB2  PRO  90          2HB       PRO  90  11.171   3.545   9.604
  688    HB3  PRO  90          1HB       PRO  90  11.088   5.304   9.717
  689    HG2  PRO  90          2HG       PRO  90  10.502   3.802  11.821
  690    HG3  PRO  90          1HG       PRO  90   9.551   5.254  11.455
  691    HD2  PRO  90          2HD       PRO  90   8.851   2.385  11.060
  692    HD3  PRO  90          1HD       PRO  90   7.809   3.756  11.489
  693    H    CYS  91           H        CYS  91  10.425   5.532   6.734
  694    HA   CYS  91           HA       CYS  91  10.006   3.481   4.802
  695    HB2  CYS  91          2HB       CYS  91  11.476   4.977   3.379
  696    HB3  CYS  91          1HB       CYS  91  10.077   5.791   4.100
  697    HG   CYS  91           HG       CYS  91  13.019   5.906   5.788
  698    H    ALA  92           H        ALA  92  11.207   1.930   4.132
  699    HA   ALA  92           HA       ALA  92  13.302   0.810   5.544
  700    HB1  ALA  92          1HB       ALA  92  12.714   0.519   2.598
  701    HB2  ALA  92          2HB       ALA  92  11.964  -0.409   3.898
  702    HB3  ALA  92          3HB       ALA  92  13.691  -0.581   3.574
  703    HA   PRO  93           HA       PRO  93  16.763   3.273   4.776
  704    HB2  PRO  93          2HB       PRO  93  18.788   1.509   5.013
  705    HB3  PRO  93          1HB       PRO  93  17.802   2.013   6.379
  706    HG2  PRO  93          2HG       PRO  93  17.614  -0.476   4.730
  707    HG3  PRO  93          1HG       PRO  93  17.498  -0.288   6.490
  708    HD2  PRO  93          2HD       PRO  93  15.319  -0.551   4.889
  709    HD3  PRO  93          1HD       PRO  93  15.301   0.385   6.398
  710    H    GLU  94           H        GLU  94  16.253   0.611   2.677
  711    HA   GLU  94           HA       GLU  94  16.704   0.161   0.509
  712    HB2  GLU  94          2HB       GLU  94  16.322   1.903  -1.024
  713    HB3  GLU  94          1HB       GLU  94  15.389   2.322   0.404
  714    HG2  GLU  94          2HG       GLU  94  17.044   3.944   1.063
  715    HG3  GLU  94          1HG       GLU  94  18.098   3.459  -0.262
  716    H    GLU  95           H        GLU  95  19.214   0.749   2.293
  717    HA   GLU  95           HA       GLU  95  21.020   1.370   0.057
  718    HB2  GLU  95          2HB       GLU  95  21.381   1.723   3.022
  719    HB3  GLU  95          1HB       GLU  95  22.695   1.908   1.867
  720    HG2  GLU  95          2HG       GLU  95  21.328   3.661   0.738
  721    HG3  GLU  95          1HG       GLU  95  20.174   3.511   2.063
  722    H    GLU  96           H        GLU  96  20.301  -1.009   2.494
  723    HA   GLU  96           HA       GLU  96  22.705  -2.456   2.351
  724    HB2  GLU  96          2HB       GLU  96  21.401  -4.336   3.317
  725    HB3  GLU  96          1HB       GLU  96  21.196  -2.827   4.189
  726    HG2  GLU  96          2HG       GLU  96  19.037  -2.482   3.173
  727    HG3  GLU  96          1HG       GLU  96  19.251  -3.915   2.168
  728    H    LYS  97           H        LYS  97  19.625  -2.928   0.648
  729    HA   LYS  97           HA       LYS  97  20.810  -3.910  -1.711
  730    HB2  LYS  97          2HB       LYS  97  21.247  -5.833  -0.148
  731    HB3  LYS  97          1HB       LYS  97  19.508  -6.031   0.009
  732    HG2  LYS  97          2HG       LYS  97  19.321  -6.540  -2.350
  733    HG3  LYS  97          1HG       LYS  97  21.049  -6.254  -2.569
  734    HD2  LYS  97          2HD       LYS  97  19.803  -8.402  -0.854
  735    HD3  LYS  97          1HD       LYS  97  20.586  -8.642  -2.418
  736    HE2  LYS  97          2HE       LYS  97  22.688  -7.774  -1.459
  737    HE3  LYS  97          1HE       LYS  97  21.894  -7.629   0.105
  738    HZ1  LYS  97          1HZ       LYS  97  23.179  -9.652  -0.037
  739    HZ2  LYS  97          2HZ       LYS  97  22.307 -10.153  -1.394
  740    HZ3  LYS  97          3HZ       LYS  97  21.534 -10.017   0.104
  741    HA   PRO  98           HA       PRO  98  16.368  -2.728  -2.024
  742    HB2  PRO  98          2HB       PRO  98  16.633  -0.693  -3.741
  743    HB3  PRO  98          1HB       PRO  98  16.963  -0.484  -2.017
  744    HG2  PRO  98          2HG       PRO  98  18.882  -0.852  -4.282
  745    HG3  PRO  98          1HG       PRO  98  18.994   0.231  -2.883
  746    HD2  PRO  98          2HD       PRO  98  20.266  -2.212  -3.086
  747    HD3  PRO  98          1HD       PRO  98  19.897  -1.393  -1.558
  748    HA   PRO  99           HA       PRO  99  15.802  -5.217  -5.718
  749    HB2  PRO  99          2HB       PRO  99  13.238  -4.271  -6.248
  750    HB3  PRO  99          1HB       PRO  99  13.623  -5.637  -5.200
  751    HG2  PRO  99          2HG       PRO  99  13.005  -2.810  -4.485
  752    HG3  PRO  99          1HG       PRO  99  12.565  -4.305  -3.639
  753    HD2  PRO  99          2HD       PRO  99  14.539  -2.714  -2.764
  754    HD3  PRO  99          1HD       PRO  99  14.633  -4.481  -2.615
  755    H    GLU 100           H        GLU 100  14.233  -2.028  -5.919
  756    HA   GLU 100           HA       GLU 100  16.204  -1.239  -7.926
  757    HB2  GLU 100          2HB       GLU 100  14.167  -1.925  -9.171
  758    HB3  GLU 100          1HB       GLU 100  13.225  -0.782  -8.230
  759    HG2  GLU 100          2HG       GLU 100  13.790   0.012 -10.470
  760    HG3  GLU 100          1HG       GLU 100  14.413   1.063  -9.199
  761    H    ILE 101           H        ILE 101  13.272   0.035  -6.385
  762    HA   ILE 101           HA       ILE 101  14.911   2.020  -4.981
  763    HB   ILE 101           HB       ILE 101  13.166   3.774  -5.485
  764   HG12  ILE 101          2HG1      ILE 101  12.423   1.836  -7.682
  765   HG13  ILE 101          1HG1      ILE 101  11.401   2.288  -6.327
  766   HG21  ILE 101          1HG2      ILE 101  15.348   3.877  -6.492
  767   HG22  ILE 101          2HG2      ILE 101  14.138   4.326  -7.695
  768   HG23  ILE 101          3HG2      ILE 101  14.869   2.723  -7.736
  769   HD11  ILE 101          1HD1      ILE 101  10.780   3.408  -8.365
  770   HD12  ILE 101          2HD1      ILE 101  12.396   4.087  -8.499
  771   HD13  ILE 101          3HD1      ILE 101  11.348   4.567  -7.164
  772    H    ASP 102           H        ASP 102  12.301  -0.117  -5.125
  773    HA   ASP 102           HA       ASP 102  10.907  -0.981  -3.587
  774    HB2  ASP 102          2HB       ASP 102  13.121  -0.756  -2.224
  775    HB3  ASP 102          1HB       ASP 102  12.282   0.542  -1.403
  776    H    ALA 103           H        ALA 103  10.294   1.429  -4.905
  777    HA   ALA 103           HA       ALA 103   8.367   2.620  -3.068
  778    HB1  ALA 103          1HB       ALA 103  10.463   4.176  -4.581
  779    HB2  ALA 103          2HB       ALA 103  10.232   4.101  -2.834
  780    HB3  ALA 103          3HB       ALA 103   9.040   4.917  -3.849
  781    H    LEU 104           H        LEU 104   9.581   3.419  -6.319
  782    HA   LEU 104           HA       LEU 104   6.843   3.052  -7.340
  783    HB2  LEU 104          2HB       LEU 104   8.863   5.028  -8.402
  784    HB3  LEU 104          1HB       LEU 104   7.182   4.877  -8.874
  785    HG   LEU 104           HG       LEU 104   6.857   5.397  -6.262
  786   HD11  LEU 104          1HD1      LEU 104   8.418   7.113  -5.546
  787   HD12  LEU 104          2HD1      LEU 104   9.356   6.895  -7.024
  788   HD13  LEU 104          3HD1      LEU 104   9.258   5.592  -5.842
  789   HD21  LEU 104          1HD2      LEU 104   5.789   6.590  -8.086
  790   HD22  LEU 104          2HD2      LEU 104   7.294   7.444  -8.426
  791   HD23  LEU 104          3HD2      LEU 104   6.446   7.724  -6.906
  792    H    GLU 105           H        GLU 105   8.192   0.860  -7.431
  793    HA   GLU 105           HA       GLU 105   9.521   0.720 -10.052
  794    HB2  GLU 105          2HB       GLU 105  10.523  -1.409  -9.159
  795    HB3  GLU 105          1HB       GLU 105  11.078   0.076  -8.388
  796    HG2  GLU 105          2HG       GLU 105   9.514  -0.321  -6.534
  797    HG3  GLU 105          1HG       GLU 105   9.014  -1.829  -7.299
  798    H    LEU 106           H        LEU 106   9.453  -1.622 -10.896
  799    HA   LEU 106           HA       LEU 106   6.655  -2.539 -10.845
  800    HB2  LEU 106          2HB       LEU 106   8.550  -2.122 -13.128
  801    HB3  LEU 106          1HB       LEU 106   7.214  -3.248 -13.276
  802    HG   LEU 106           HG       LEU 106   6.515  -1.228 -14.291
  803   HD11  LEU 106          1HD1      LEU 106   4.836  -2.300 -12.861
  804   HD12  LEU 106          2HD1      LEU 106   4.601  -0.558 -12.987
  805   HD13  LEU 106          3HD1      LEU 106   5.315  -1.247 -11.531
  806   HD21  LEU 106          1HD2      LEU 106   7.414   0.202 -11.798
  807   HD22  LEU 106          2HD2      LEU 106   6.555   0.943 -13.148
  808   HD23  LEU 106          3HD2      LEU 106   8.172   0.281 -13.389
  809    H    LYS 107           H        LYS 107  10.048  -3.402 -11.180
  810    HA   LYS 107           HA       LYS 107   9.292  -6.229 -10.857
  811    HB2  LYS 107          2HB       LYS 107  11.806  -5.128 -12.124
  812    HB3  LYS 107          1HB       LYS 107  11.380  -6.826 -11.979
  813    HG2  LYS 107          2HG       LYS 107   9.910  -4.757 -13.602
  814    HG3  LYS 107          1HG       LYS 107  10.972  -6.019 -14.228
  815    HD2  LYS 107          2HD       LYS 107   9.449  -7.727 -13.337
  816    HD3  LYS 107          1HD       LYS 107   8.387  -6.456 -12.732
  817    HE2  LYS 107          2HE       LYS 107   7.540  -7.330 -14.827
  818    HE3  LYS 107          1HE       LYS 107   8.049  -5.657 -15.024
  819    HZ1  LYS 107          1HZ       LYS 107  10.112  -6.446 -16.013
  820    HZ2  LYS 107          2HZ       LYS 107   8.776  -7.015 -16.876
  821    HZ3  LYS 107          3HZ       LYS 107   9.608  -8.049 -15.831
  822    H    THR 108           H        THR 108   9.312  -6.312  -8.662
  823    HA   THR 108           HA       THR 108  11.467  -5.211  -7.122
  824    HB   THR 108           HB       THR 108   9.212  -7.041  -6.272
  825    HG1  THR 108          1HG       THR 108   9.504  -4.195  -6.215
  826   HG21  THR 108          1HG2      THR 108   9.671  -6.205  -4.013
  827   HG22  THR 108          2HG2      THR 108  11.036  -5.275  -4.629
  828   HG23  THR 108          3HG2      THR 108  11.078  -7.037  -4.674
  829    H    GLN 109           H        GLN 109  13.278  -6.280  -7.968
  830    HA   GLN 109           HA       GLN 109  13.539  -9.136  -7.640
  831    HB2  GLN 109          2HB       GLN 109  15.612  -7.025  -8.284
  832    HB3  GLN 109          1HB       GLN 109  15.882  -8.760  -8.340
  833    HG2  GLN 109          2HG       GLN 109  13.959  -7.209 -10.057
  834    HG3  GLN 109          1HG       GLN 109  15.520  -7.854 -10.560
  835   HE21  GLN 109          1HE2      GLN 109  15.193 -10.336  -9.070
  836   HE22  GLN 109          2HE2      GLN 109  14.033 -11.275  -9.940
  837    H    LYS 110           H        LYS 110  13.317  -9.648  -5.524
  838    HA   LYS 110           HA       LYS 110  14.743  -8.072  -3.519
  839    HB2  LYS 110          2HB       LYS 110  13.331  -9.229  -1.886
  840    HB3  LYS 110          1HB       LYS 110  12.362  -8.468  -3.139
  841    HG2  LYS 110          2HG       LYS 110  12.098 -10.641  -4.244
  842    HG3  LYS 110          1HG       LYS 110  13.044 -11.398  -2.960
  843    HD2  LYS 110          2HD       LYS 110  11.360 -10.575  -1.322
  844    HD3  LYS 110          1HD       LYS 110  10.390  -9.993  -2.674
  845    HE2  LYS 110          2HE       LYS 110  11.232 -12.859  -2.280
  846    HE3  LYS 110          1HE       LYS 110   9.672 -12.206  -1.792
  847    HZ1  LYS 110          1HZ       LYS 110   9.176 -11.705  -4.079
  848    HZ2  LYS 110          2HZ       LYS 110   9.596 -13.338  -3.945
  849    HZ3  LYS 110          3HZ       LYS 110  10.705 -12.229  -4.576
  850    H    GLY 111           H        GLY 111  15.877  -9.186  -1.775
  851    HA2  GLY 111          2HA       GLY 111  17.604 -11.238  -2.883
  852    HA3  GLY 111          1HA       GLY 111  17.834 -10.383  -1.366
  853    H    PHE 112           H        PHE 112  15.189 -12.362  -2.642
  854    HA   PHE 112           HA       PHE 112  15.624 -14.300  -0.486
  855    HB2  PHE 112          2HB       PHE 112  12.955 -13.074  -1.233
  856    HB3  PHE 112          1HB       PHE 112  13.154 -14.458  -0.166
  857    HD1  PHE 112          1HD       PHE 112  14.240 -14.167   2.038
  858    HD2  PHE 112          2HD       PHE 112  13.294 -10.859  -0.465
  859    HE1  PHE 112          1HE       PHE 112  14.451 -12.651   3.966
  860    HE2  PHE 112          2HE       PHE 112  13.507  -9.338   1.455
  861    HZ   PHE 112           HZ       PHE 112  14.086 -10.233   3.675
  Start of MODEL    2
    1    H1   GLY   1          1HT       GLY   1   6.574   4.493 -21.365
    2    H2   GLY   1          2HT       GLY   1   5.045   3.898 -20.958
    3    H    GLY   1           H        GLY   1   5.507   3.341 -20.348
    4    H3   GLY   1          3HT       GLY   1   6.397   3.429 -20.061
    5    HA2  GLY   1          1HA       GLY   1   6.701   5.689 -19.284
    6    HA3  GLY   1          2HA       GLY   1   5.291   6.172 -20.218
    7    H    SER   2           H        SER   2   4.602   6.928 -18.056
    8    HA   SER   2           HA       SER   2   3.160   4.766 -16.685
    9    HB2  SER   2          2HB       SER   2   5.051   5.436 -15.269
   10    HB3  SER   2          1HB       SER   2   4.550   7.121 -15.373
   11    HG   SER   2           HG       SER   2   3.438   6.666 -13.651
   12    H    ALA   3           H        ALA   3   1.034   5.151 -16.423
   13    HA   ALA   3           HA       ALA   3  -0.012   7.686 -17.405
   14    HB1  ALA   3          1HB       ALA   3  -1.471   5.179 -16.571
   15    HB2  ALA   3          2HB       ALA   3  -1.008   5.601 -18.220
   16    HB3  ALA   3          3HB       ALA   3  -2.189   6.586 -17.357
   17    H    MET   4           H        MET   4   1.028   6.505 -14.529
   18    HA   MET   4           HA       MET   4  -0.898   8.120 -13.000
   19    HB2  MET   4          2HB       MET   4  -0.405   6.688 -11.062
   20    HB3  MET   4          1HB       MET   4  -1.074   5.772 -12.399
   21    HG2  MET   4          2HG       MET   4   1.130   4.945 -12.972
   22    HG3  MET   4          1HG       MET   4   1.846   5.919 -11.687
   23    HE1  MET   4          1HE       MET   4   2.200   2.229 -10.376
   24    HE2  MET   4          2HE       MET   4   3.058   3.717 -10.769
   25    HE3  MET   4          3HE       MET   4   2.306   2.768 -12.051
   26    H    GLY   5           H        GLY   5  -0.147   9.643 -11.623
   27    HA2  GLY   5          2HA       GLY   5   2.598   9.782 -10.799
   28    HA3  GLY   5          1HA       GLY   5   2.212  10.952 -12.056
   29    H    HIS   6           H        HIS   6   0.125   9.794  -9.468
   30    HA   HIS   6           HA       HIS   6  -0.468  12.539  -8.746
   31    HB2  HIS   6          2HB       HIS   6  -2.280  10.854  -8.995
   32    HB3  HIS   6          1HB       HIS   6  -1.603   9.955  -7.646
   33    HD1  HIS   6          1HD       HIS   6  -2.223  10.698  -5.317
   34    HD2  HIS   6          2HD       HIS   6  -3.481  13.352  -8.265
   35    HE1  HIS   6          1HE       HIS   6  -3.736  12.342  -4.155
   36    HE2  HIS   6          2HE       HIS   6  -4.466  13.950  -5.951
   37    H    MET   7           H        MET   7   1.646  13.016  -7.887
   38    HA   MET   7           HA       MET   7   2.421  11.665  -5.438
   39    HB2  MET   7          2HB       MET   7   3.669  13.966  -6.946
   40    HB3  MET   7          1HB       MET   7   4.319  13.307  -5.453
   41    HG2  MET   7          2HG       MET   7   4.629  11.144  -6.533
   42    HG3  MET   7          1HG       MET   7   3.959  11.793  -8.029
   43    HE1  MET   7          1HE       MET   7   7.785  11.328  -8.817
   44    HE2  MET   7          2HE       MET   7   6.142  10.895  -9.287
   45    HE3  MET   7          3HE       MET   7   6.807  10.310  -7.761
   46    H    VAL   8           H        VAL   8   2.166  12.423  -3.433
   47    HA   VAL   8           HA       VAL   8   1.107  15.090  -3.011
   48    HB   VAL   8           HB       VAL   8  -0.899  13.818  -3.329
   49   HG11  VAL   8          1HG1      VAL   8  -1.505  11.915  -1.856
   50   HG12  VAL   8          2HG1      VAL   8   0.160  11.890  -1.280
   51   HG13  VAL   8          3HG1      VAL   8  -0.188  11.581  -2.979
   52   HG21  VAL   8          1HG2      VAL   8  -2.026  14.131  -1.152
   53   HG22  VAL   8          2HG2      VAL   8  -1.068  15.521  -1.657
   54   HG23  VAL   8          3HG2      VAL   8  -0.453  14.431  -0.415
   55    H    LYS   9           H        LYS   9   0.599  13.138  -0.382
   56    HA   LYS   9           HA       LYS   9   2.980  13.963   0.977
   57    HB2  LYS   9          2HB       LYS   9   0.698  12.129   1.726
   58    HB3  LYS   9          1HB       LYS   9   2.080  12.404   2.781
   59    HG2  LYS   9          2HG       LYS   9   0.396  14.648   1.723
   60    HG3  LYS   9          1HG       LYS   9   0.021  13.793   3.217
   61    HD2  LYS   9          2HD       LYS   9   2.273  14.364   4.064
   62    HD3  LYS   9          1HD       LYS   9   2.561  15.291   2.594
   63    HE2  LYS   9          2HE       LYS   9   0.714  16.769   3.138
   64    HE3  LYS   9          1HE       LYS   9   0.352  15.815   4.575
   65    HZ1  LYS   9          1HZ       LYS   9   2.498  16.411   5.483
   66    HZ2  LYS   9          2HZ       LYS   9   1.626  17.807   5.098
   67    HZ3  LYS   9          3HZ       LYS   9   2.882  17.292   4.090
   68    H    ILE  10           H        ILE  10   3.662  12.592  -1.321
   69    HA   ILE  10           HA       ILE  10   4.813  10.129  -0.253
   70    HB   ILE  10           HB       ILE  10   3.961  10.591  -3.118
   71   HG12  ILE  10          2HG1      ILE  10   2.811   8.662  -1.094
   72   HG13  ILE  10          1HG1      ILE  10   2.070  10.206  -1.501
   73   HG21  ILE  10          1HG2      ILE  10   4.606   8.274  -3.481
   74   HG22  ILE  10          2HG2      ILE  10   5.079   8.116  -1.790
   75   HG23  ILE  10          3HG2      ILE  10   5.980   9.189  -2.861
   76   HD11  ILE  10          1HD1      ILE  10   1.003   8.389  -2.681
   77   HD12  ILE  10          2HD1      ILE  10   2.544   7.913  -3.390
   78   HD13  ILE  10          3HD1      ILE  10   1.817   9.463  -3.815
   79    H    SER  11           H        SER  11   6.786  10.988   0.244
   80    HA   SER  11           HA       SER  11   8.355  12.169  -1.907
   81    HB2  SER  11          2HB       SER  11   9.484  11.280   0.735
   82    HB3  SER  11          1HB       SER  11   9.956  12.655  -0.269
   83    HG   SER  11           HG       SER  11   7.705  12.378   1.428
   84    H    HIS  12           H        HIS  12  10.745  10.948  -1.854
   85    HA   HIS  12           HA       HIS  12  10.420   8.474  -3.083
   86    HB2  HIS  12          2HB       HIS  12  12.785   9.494  -1.504
   87    HB3  HIS  12          1HB       HIS  12  12.819   8.050  -2.510
   88    HD1  HIS  12          1HD       HIS  12  12.971   8.342  -5.040
   89    HD2  HIS  12          2HD       HIS  12  12.706  11.938  -2.959
   90    HE1  HIS  12          1HE       HIS  12  13.478  10.142  -6.718
   91    HE2  HIS  12          2HE       HIS  12  13.068  12.299  -5.494
   92    H    GLU  13           H        GLU  13  11.142   9.265   0.252
   93    HA   GLU  13           HA       GLU  13  11.345   6.602   1.154
   94    HB2  GLU  13          2HB       GLU  13  11.356   7.562   3.390
   95    HB3  GLU  13          1HB       GLU  13  12.390   8.486   2.298
   96    HG2  GLU  13          2HG       GLU  13  10.492  10.096   2.022
   97    HG3  GLU  13          1HG       GLU  13   9.667   9.238   3.324
   98    H    ASP  14           H        ASP  14   8.572   8.779   0.793
   99    HA   ASP  14           HA       ASP  14   6.946   7.323   2.622
  100    HB2  ASP  14          2HB       ASP  14   6.213   9.264   0.447
  101    HB3  ASP  14          1HB       ASP  14   5.054   8.550   1.566
  102    H    THR  15           H        THR  15   7.237   7.302  -0.933
  103    HA   THR  15           HA       THR  15   5.293   5.351  -1.432
  104    HB   THR  15           HB       THR  15   7.481   4.909  -3.188
  105    HG1  THR  15          1HG       THR  15   8.435   6.795  -3.133
  106   HG21  THR  15          1HG2      THR  15   4.824   6.292  -3.411
  107   HG22  THR  15          2HG2      THR  15   5.265   4.672  -3.952
  108   HG23  THR  15          3HG2      THR  15   5.904   6.087  -4.787
  109    H    GLN  16           H        GLN  16   8.715   5.078  -0.637
  110    HA   GLN  16           HA       GLN  16   8.949   2.296  -0.728
  111    HB2  GLN  16          2HB       GLN  16  10.392   4.310   1.010
  112    HB3  GLN  16          1HB       GLN  16  10.876   2.630   0.827
  113    HG2  GLN  16          2HG       GLN  16  11.234   2.999  -1.568
  114    HG3  GLN  16          1HG       GLN  16  10.743   4.674  -1.371
  115   HE21  GLN  16          1HE2      GLN  16  12.139   6.142  -0.566
  116   HE22  GLN  16          2HE2      GLN  16  13.812   5.820  -0.270
  117    H    ARG  17           H        ARG  17   7.895   4.475   1.818
  118    HA   ARG  17           HA       ARG  17   7.664   2.646   3.916
  119    HB2  ARG  17          2HB       ARG  17   6.415   5.278   3.272
  120    HB3  ARG  17          1HB       ARG  17   5.753   4.338   4.598
  121    HG2  ARG  17          2HG       ARG  17   7.455   4.830   5.945
  122    HG3  ARG  17          1HG       ARG  17   8.652   4.567   4.678
  123    HD2  ARG  17          2HD       ARG  17   8.382   6.748   3.827
  124    HD3  ARG  17          1HD       ARG  17   6.922   7.024   4.791
  125    HE   ARG  17           HE       ARG  17   9.348   6.508   6.295
  126   HH11  ARG  17          1HH1      ARG  17   7.249   8.965   4.933
  127   HH12  ARG  17          2HH1      ARG  17   7.799  10.194   6.029
  128   HH21  ARG  17          1HH2      ARG  17  10.050   8.132   7.736
  129   HH22  ARG  17          2HH2      ARG  17   9.379   9.727   7.610
  130    H    ILE  18           H        ILE  18   5.239   3.685   1.511
  131    HA   ILE  18           HA       ILE  18   3.098   2.314   2.671
  132    HB   ILE  18           HB       ILE  18   3.461   3.065  -0.224
  133   HG12  ILE  18          2HG1      ILE  18   1.584   4.595   1.382
  134   HG13  ILE  18          1HG1      ILE  18   3.212   4.669   2.048
  135   HG21  ILE  18          1HG2      ILE  18   1.010   2.277   1.349
  136   HG22  ILE  18          2HG2      ILE  18   1.759   1.359   0.039
  137   HG23  ILE  18          3HG2      ILE  18   0.997   2.915  -0.298
  138   HD11  ILE  18          1HD1      ILE  18   4.072   5.505  -0.003
  139   HD12  ILE  18          2HD1      ILE  18   2.687   6.490   0.470
  140   HD13  ILE  18          3HD1      ILE  18   2.518   5.283  -0.807
  141    H    LYS  19           H        LYS  19   5.242   1.252  -0.012
  142    HA   LYS  19           HA       LYS  19   3.872  -1.196  -0.398
  143    HB2  LYS  19          2HB       LYS  19   6.727  -0.456  -1.013
  144    HB3  LYS  19          1HB       LYS  19   5.996  -1.980  -1.470
  145    HG2  LYS  19          2HG       LYS  19   4.315  -0.744  -2.804
  146    HG3  LYS  19          1HG       LYS  19   5.184   0.750  -2.438
  147    HD2  LYS  19          2HD       LYS  19   7.154  -0.055  -3.543
  148    HD3  LYS  19          1HD       LYS  19   6.441  -1.653  -3.764
  149    HE2  LYS  19          2HE       LYS  19   5.428   0.902  -4.983
  150    HE3  LYS  19          1HE       LYS  19   6.447  -0.269  -5.811
  151    HZ1  LYS  19          1HZ       LYS  19   4.155  -0.587  -6.407
  152    HZ2  LYS  19          2HZ       LYS  19   3.705  -0.755  -4.786
  153    HZ3  LYS  19          3HZ       LYS  19   4.693  -1.920  -5.515
  154    H    THR  20           H        THR  20   6.787  -0.384   1.451
  155    HA   THR  20           HA       THR  20   7.458  -3.000   2.079
  156    HB   THR  20           HB       THR  20   9.030  -1.107   2.300
  157    HG1  THR  20          1HG       THR  20  10.018  -1.905   4.197
  158   HG21  THR  20          1HG2      THR  20   7.609   0.546   3.338
  159   HG22  THR  20          2HG2      THR  20   8.991   0.227   4.389
  160   HG23  THR  20          3HG2      THR  20   7.414  -0.469   4.762
  161    H    ALA  21           H        ALA  21   5.350  -0.735   3.801
  162    HA   ALA  21           HA       ALA  21   5.217  -2.405   6.098
  163    HB1  ALA  21          1HB       ALA  21   3.452  -0.904   6.855
  164    HB2  ALA  21          2HB       ALA  21   3.373  -0.180   5.245
  165    HB3  ALA  21          3HB       ALA  21   4.827   0.005   6.229
  166    H    PHE  22           H        PHE  22   2.769  -1.560   3.673
  167    HA   PHE  22           HA       PHE  22   0.697  -3.211   4.337
  168    HB2  PHE  22          2HB       PHE  22   0.145  -1.956   2.588
  169    HB3  PHE  22          1HB       PHE  22   1.784  -1.886   1.982
  170    HD1  PHE  22          1HD       PHE  22  -1.262  -3.940   2.007
  171    HD2  PHE  22          2HD       PHE  22   2.376  -3.017   0.060
  172    HE1  PHE  22          1HE       PHE  22  -2.030  -5.220  -0.003
  173    HE2  PHE  22          2HE       PHE  22   1.682  -4.314  -1.898
  174    HZ   PHE  22           HZ       PHE  22  -0.523  -5.408  -1.939
  175    H    LEU  23           H        LEU  23   3.376  -4.258   2.163
  176    HA   LEU  23           HA       LEU  23   2.413  -6.885   1.844
  177    HB2  LEU  23          2HB       LEU  23   5.267  -5.920   1.718
  178    HB3  LEU  23          1HB       LEU  23   4.640  -7.397   1.009
  179    HG   LEU  23           HG       LEU  23   3.540  -4.734   0.194
  180   HD11  LEU  23          1HD1      LEU  23   5.170  -4.708  -1.633
  181   HD12  LEU  23          2HD1      LEU  23   5.970  -6.120  -0.941
  182   HD13  LEU  23          3HD1      LEU  23   5.960  -4.591  -0.058
  183   HD21  LEU  23          1HD2      LEU  23   3.722  -7.461  -1.076
  184   HD22  LEU  23          2HD2      LEU  23   3.141  -6.018  -1.902
  185   HD23  LEU  23          3HD2      LEU  23   2.271  -6.636  -0.498
  186    H    SER  24           H        SER  24   5.074  -5.699   3.927
  187    HA   SER  24           HA       SER  24   5.680  -8.236   5.003
  188    HB2  SER  24          2HB       SER  24   7.114  -7.108   6.497
  189    HB3  SER  24          1HB       SER  24   7.272  -6.382   4.908
  190    HG   SER  24           HG       SER  24   6.279  -4.588   5.584
  191    H    TYR  25           H        TYR  25   3.400  -5.811   5.898
  192    HA   TYR  25           HA       TYR  25   3.080  -6.551   8.607
  193    HB2  TYR  25          2HB       TYR  25   1.545  -4.867   6.657
  194    HB3  TYR  25          1HB       TYR  25   0.725  -5.404   8.132
  195    HD1  TYR  25          1HD       TYR  25   4.210  -4.233   7.438
  196    HD2  TYR  25          2HD       TYR  25   0.650  -3.685   9.693
  197    HE1  TYR  25          1HE       TYR  25   5.297  -2.432   8.680
  198    HE2  TYR  25          2HE       TYR  25   1.726  -1.873  10.959
  199    HH   TYR  25           HH       TYR  25   4.176  -1.246  11.547
  200    H    ALA  26           H        ALA  26   1.112  -7.257   5.719
  201    HA   ALA  26           HA       ALA  26  -0.693  -8.864   7.251
  202    HB1  ALA  26          1HB       ALA  26  -1.825  -9.252   5.236
  203    HB2  ALA  26          2HB       ALA  26  -0.380  -8.935   4.271
  204    HB3  ALA  26          3HB       ALA  26  -1.187  -7.610   5.119
  205    H    GLN  27           H        GLN  27   1.352  -9.808   4.488
  206    HA   GLN  27           HA       GLN  27   1.353 -12.497   5.654
  207    HB2  GLN  27          2HB       GLN  27   1.624 -12.004   2.709
  208    HB3  GLN  27          1HB       GLN  27   1.149 -13.475   3.554
  209    HG2  GLN  27          2HG       GLN  27  -0.948 -12.357   4.278
  210    HG3  GLN  27          1HG       GLN  27  -0.502 -10.979   3.276
  211   HE21  GLN  27          1HE2      GLN  27  -0.749 -11.081   1.089
  212   HE22  GLN  27          2HE2      GLN  27  -1.515 -12.426   0.287
  213    H    GLY  28           H        GLY  28   3.264  -9.957   4.344
  214    HA2  GLY  28          2HA       GLY  28   5.563  -9.842   4.036
  215    HA3  GLY  28          1HA       GLY  28   5.692 -11.531   4.512
  216    H    GLN  29           H        GLN  29   3.264 -11.598   2.375
  217    HA   GLN  29           HA       GLN  29   5.006 -12.456   0.213
  218    HB2  GLN  29          2HB       GLN  29   2.013 -12.499   0.117
  219    HB3  GLN  29          1HB       GLN  29   3.161 -13.590  -0.646
  220    HG2  GLN  29          2HG       GLN  29   3.750 -14.470   1.572
  221    HG3  GLN  29          1HG       GLN  29   2.521 -13.414   2.277
  222   HE21  GLN  29          1HE2      GLN  29   0.747 -13.852  -0.073
  223   HE22  GLN  29          2HE2      GLN  29   0.066 -15.421   0.166
  224    H    ASP  30           H        ASP  30   3.323 -12.043  -1.953
  225    HA   ASP  30           HA       ASP  30   3.979  -9.333  -2.646
  226    HB2  ASP  30          2HB       ASP  30   4.044 -11.392  -4.168
  227    HB3  ASP  30          1HB       ASP  30   2.294 -11.259  -4.244
  228    H    LYS  31           H        LYS  31   1.420 -10.627  -0.949
  229    HA   LYS  31           HA       LYS  31  -0.390  -8.499  -1.806
  230    HB2  LYS  31          2HB       LYS  31  -1.090 -11.426  -1.542
  231    HB3  LYS  31          1HB       LYS  31  -2.296 -10.150  -1.556
  232    HG2  LYS  31          2HG       LYS  31  -0.885  -9.593  -3.812
  233    HG3  LYS  31          1HG       LYS  31  -0.796 -11.346  -3.758
  234    HD2  LYS  31          2HD       LYS  31  -3.341  -9.740  -3.550
  235    HD3  LYS  31          1HD       LYS  31  -2.763 -10.535  -5.015
  236    HE2  LYS  31          2HE       LYS  31  -3.274 -11.991  -2.445
  237    HE3  LYS  31          1HE       LYS  31  -4.520 -11.703  -3.652
  238    HZ1  LYS  31          1HZ       LYS  31  -1.981 -13.174  -4.116
  239    HZ2  LYS  31          2HZ       LYS  31  -3.191 -12.910  -5.267
  240    HZ3  LYS  31          3HZ       LYS  31  -3.504 -13.881  -3.921
  241    H    VAL  32           H        VAL  32  -2.404  -8.678  -0.230
  242    HA   VAL  32           HA       VAL  32  -1.386  -9.113   2.483
  243    HB   VAL  32           HB       VAL  32  -2.513  -6.609   1.327
  244   HG11  VAL  32          1HG1      VAL  32  -2.774  -7.507   4.178
  245   HG12  VAL  32          2HG1      VAL  32  -4.028  -6.883   3.110
  246   HG13  VAL  32          3HG1      VAL  32  -2.765  -5.809   3.711
  247   HG21  VAL  32          1HG2      VAL  32  -0.293  -7.283   3.223
  248   HG22  VAL  32          2HG2      VAL  32  -0.733  -5.659   2.701
  249   HG23  VAL  32          3HG2      VAL  32  -0.146  -6.831   1.524
  250    H    THR  33           H        THR  33  -2.737 -10.022   3.865
  251    HA   THR  33           HA       THR  33  -5.288 -10.929   2.978
  252    HB   THR  33           HB       THR  33  -5.527 -11.652   5.388
  253    HG1  THR  33          1HG       THR  33  -3.501 -11.502   6.606
  254   HG21  THR  33          1HG2      THR  33  -2.985 -12.467   3.991
  255   HG22  THR  33          2HG2      THR  33  -4.583 -13.159   3.714
  256   HG23  THR  33          3HG2      THR  33  -3.786 -13.372   5.272
  257    H    GLU  34           H        GLU  34  -7.259 -10.374   4.219
  258    HA   GLU  34           HA       GLU  34  -7.650  -7.707   3.553
  259    HB2  GLU  34          2HB       GLU  34  -9.343  -9.301   3.171
  260    HB3  GLU  34          1HB       GLU  34  -9.525  -9.619   4.902
  261    HG2  GLU  34          2HG       GLU  34 -10.443  -7.451   5.271
  262    HG3  GLU  34          1HG       GLU  34 -10.026  -6.933   3.638
  263    H    ALA  35           H        ALA  35  -6.735  -8.993   6.562
  264    HA   ALA  35           HA       ALA  35  -8.005  -7.243   8.359
  265    HB1  ALA  35          1HB       ALA  35  -6.340  -7.937   9.973
  266    HB2  ALA  35          2HB       ALA  35  -5.331  -8.593   8.687
  267    HB3  ALA  35          3HB       ALA  35  -6.891  -9.333   9.044
  268    H    MET  36           H        MET  36  -4.636  -7.141   7.090
  269    HA   MET  36           HA       MET  36  -4.132  -4.529   8.019
  270    HB2  MET  36          2HB       MET  36  -2.845  -6.326   6.007
  271    HB3  MET  36          1HB       MET  36  -2.387  -4.642   6.057
  272    HG2  MET  36          2HG       MET  36  -2.282  -6.506   8.410
  273    HG3  MET  36          1HG       MET  36  -0.903  -6.096   7.387
  274    HE1  MET  36          1HE       MET  36  -1.041  -2.112   7.960
  275    HE2  MET  36          2HE       MET  36  -2.217  -2.949   6.946
  276    HE3  MET  36          3HE       MET  36  -0.509  -3.380   6.854
  277    H    ILE  37           H        ILE  37  -5.828  -5.816   5.312
  278    HA   ILE  37           HA       ILE  37  -5.657  -3.509   3.651
  279    HB   ILE  37           HB       ILE  37  -7.222  -5.974   3.695
  280   HG12  ILE  37          2HG1      ILE  37  -5.678  -6.349   2.129
  281   HG13  ILE  37          1HG1      ILE  37  -6.467  -5.131   1.165
  282   HG21  ILE  37          1HG2      ILE  37  -8.110  -3.530   2.180
  283   HG22  ILE  37          2HG2      ILE  37  -9.024  -4.409   3.407
  284   HG23  ILE  37          3HG2      ILE  37  -8.664  -5.172   1.859
  285   HD11  ILE  37          1HD1      ILE  37  -5.023  -3.418   1.989
  286   HD12  ILE  37          2HD1      ILE  37  -4.076  -4.753   1.342
  287   HD13  ILE  37          3HD1      ILE  37  -4.253  -4.568   3.084
  288    H    ASP  38           H        ASP  38  -8.012  -4.678   6.037
  289    HA   ASP  38           HA       ASP  38  -9.869  -2.633   5.992
  290    HB2  ASP  38          2HB       ASP  38  -9.850  -4.897   7.123
  291    HB3  ASP  38          1HB       ASP  38  -8.920  -4.147   8.409
  292    H    GLN  39           H        GLN  39  -6.735  -2.861   7.620
  293    HA   GLN  39           HA       GLN  39  -6.904  -0.640   9.291
  294    HB2  GLN  39          2HB       GLN  39  -4.983  -1.921   9.608
  295    HB3  GLN  39          1HB       GLN  39  -4.662  -2.051   7.887
  296    HG2  GLN  39          2HG       GLN  39  -4.409   0.613   9.204
  297    HG3  GLN  39          1HG       GLN  39  -3.154  -0.595   9.442
  298   HE21  GLN  39          1HE2      GLN  39  -3.231   2.024   7.971
  299   HE22  GLN  39          2HE2      GLN  39  -2.625   1.650   6.399
  300    H    LEU  40           H        LEU  40  -5.814  -0.898   5.949
  301    HA   LEU  40           HA       LEU  40  -5.402   1.884   5.636
  302    HB2  LEU  40          2HB       LEU  40  -4.223   0.319   4.269
  303    HB3  LEU  40          1HB       LEU  40  -5.731  -0.330   3.612
  304    HG   LEU  40           HG       LEU  40  -5.816   2.388   3.022
  305   HD11  LEU  40          1HD1      LEU  40  -3.268   1.931   3.737
  306   HD12  LEU  40          2HD1      LEU  40  -3.758   3.145   2.554
  307   HD13  LEU  40          3HD1      LEU  40  -3.183   1.567   2.010
  308   HD21  LEU  40          1HD2      LEU  40  -6.582   0.616   1.551
  309   HD22  LEU  40          2HD2      LEU  40  -4.925   0.046   1.336
  310   HD23  LEU  40          3HD2      LEU  40  -5.403   1.624   0.708
  311    H    ILE  41           H        ILE  41  -8.009  -0.280   4.523
  312    HA   ILE  41           HA       ILE  41  -9.451   1.705   3.169
  313    HB   ILE  41           HB       ILE  41 -10.341  -0.902   4.379
  314   HG12  ILE  41          2HG1      ILE  41  -8.724  -0.732   2.383
  315   HG13  ILE  41          1HG1      ILE  41 -10.121  -1.780   2.204
  316   HG21  ILE  41          1HG2      ILE  41 -12.273   0.568   4.317
  317   HG22  ILE  41          2HG2      ILE  41 -12.409  -0.677   3.075
  318   HG23  ILE  41          3HG2      ILE  41 -11.941   0.964   2.630
  319   HD11  ILE  41          1HD1      ILE  41  -9.858   1.018   1.126
  320   HD12  ILE  41          2HD1      ILE  41 -11.250  -0.052   0.909
  321   HD13  ILE  41          3HD1      ILE  41  -9.688  -0.473   0.198
  322    H    CYS  42           H        CYS  42  -9.713   0.623   6.552
  323    HA   CYS  42           HA       CYS  42 -11.943   2.331   7.126
  324    HB2  CYS  42          2HB       CYS  42 -11.417   0.239   8.399
  325    HB3  CYS  42          1HB       CYS  42 -10.006   1.045   9.068
  326    HG   CYS  42           HG       CYS  42 -13.251   1.364   9.886
  327    H    GLY  43           H        GLY  43  -8.587   2.722   6.835
  328    HA2  GLY  43          2HA       GLY  43  -7.954   4.837   8.494
  329    HA3  GLY  43          1HA       GLY  43  -7.271   4.583   6.897
  330    H    ALA  44           H        ALA  44  -9.306   5.134   5.172
  331    HA   ALA  44           HA       ALA  44  -9.679   7.996   5.680
  332    HB1  ALA  44          1HB       ALA  44  -8.611   7.238   3.544
  333    HB2  ALA  44          2HB       ALA  44 -10.031   8.267   3.328
  334    HB3  ALA  44          3HB       ALA  44 -10.161   6.523   3.094
  335    H    PHE  45           H        PHE  45 -11.565   5.194   4.562
  336    HA   PHE  45           HA       PHE  45 -13.966   6.614   5.496
  337    HB2  PHE  45          2HB       PHE  45 -14.904   4.665   3.838
  338    HB3  PHE  45          1HB       PHE  45 -14.800   6.395   3.494
  339    HD1  PHE  45          1HD       PHE  45 -12.595   3.422   3.487
  340    HD2  PHE  45          2HD       PHE  45 -13.791   6.951   1.457
  341    HE1  PHE  45          1HE       PHE  45 -11.050   2.872   1.642
  342    HE2  PHE  45          2HE       PHE  45 -12.239   6.428  -0.384
  343    HZ   PHE  45           HZ       PHE  45 -10.857   4.384  -0.290
  344    HA   PRO  46           HA       PRO  46 -14.194   2.956   7.969
  345    HB2  PRO  46          2HB       PRO  46 -14.912   4.173  10.215
  346    HB3  PRO  46          1HB       PRO  46 -13.264   4.280   9.606
  347    HG2  PRO  46          2HG       PRO  46 -15.455   6.302   9.493
  348    HG3  PRO  46          1HG       PRO  46 -13.716   6.550   9.705
  349    HD2  PRO  46          2HD       PRO  46 -15.158   6.761   7.271
  350    HD3  PRO  46          1HD       PRO  46 -13.392   6.716   7.454
  351    H    GLY  47           H        GLY  47 -16.054   2.303   9.570
  352    HA2  GLY  47          2HA       GLY  47 -18.303   1.978   9.989
  353    HA3  GLY  47          1HA       GLY  47 -18.654   3.391   9.006
  354    H    LEU  48           H        LEU  48 -16.679   0.959   7.608
  355    HA   LEU  48           HA       LEU  48 -18.751   0.445   5.642
  356    HB2  LEU  48          2HB       LEU  48 -15.883  -0.485   5.776
  357    HB3  LEU  48          1HB       LEU  48 -16.970  -0.791   4.438
  358    HG   LEU  48           HG       LEU  48 -15.790   1.842   5.300
  359   HD11  LEU  48          1HD1      LEU  48 -15.703   0.284   2.721
  360   HD12  LEU  48          2HD1      LEU  48 -14.402   0.407   3.906
  361   HD13  LEU  48          3HD1      LEU  48 -14.923   1.840   3.017
  362   HD21  LEU  48          1HD2      LEU  48 -17.955   1.367   3.254
  363   HD22  LEU  48          2HD2      LEU  48 -17.099   2.887   3.512
  364   HD23  LEU  48          3HD2      LEU  48 -18.136   2.234   4.779
  365    H    SER  49           H        SER  49 -20.076  -1.232   5.778
  366    HA   SER  49           HA       SER  49 -19.589  -3.456   7.506
  367    HB2  SER  49          2HB       SER  49 -21.882  -2.614   6.842
  368    HB3  SER  49          1HB       SER  49 -21.587  -3.283   5.236
  369    HG   SER  49           HG       SER  49 -22.138  -4.565   7.638
  370    H    TRP  50           H        TRP  50 -19.522  -5.765   6.543
  371    HA   TRP  50           HA       TRP  50 -17.121  -5.829   5.113
  372    HB2  TRP  50          2HB       TRP  50 -17.909  -7.668   6.622
  373    HB3  TRP  50          1HB       TRP  50 -19.017  -8.159   5.341
  374    HD1  TRP  50           HD       TRP  50 -15.214  -7.497   5.611
  375    HE1  TRP  50          1HE       TRP  50 -14.025  -9.238   4.136
  376    HE3  TRP  50          3HE       TRP  50 -19.317  -9.926   3.824
  377    HZ2  TRP  50          2HZ       TRP  50 -14.773 -11.363   2.458
  378    HZ3  TRP  50          3HZ       TRP  50 -18.997 -11.802   2.276
  379    HH2  TRP  50           HH       TRP  50 -16.761 -12.516   1.604
  380    H    GLU  51           H        GLU  51 -20.439  -6.326   3.993
  381    HA   GLU  51           HA       GLU  51 -19.779  -7.124   1.388
  382    HB2  GLU  51          2HB       GLU  51 -22.227  -5.723   2.443
  383    HB3  GLU  51          1HB       GLU  51 -22.083  -6.293   0.789
  384    HG2  GLU  51          2HG       GLU  51 -21.625  -8.578   1.758
  385    HG3  GLU  51          1HG       GLU  51 -22.114  -7.921   3.303
  386    H    GLN  52           H        GLN  52 -20.088  -3.943   2.822
  387    HA   GLN  52           HA       GLN  52 -19.940  -2.466   0.389
  388    HB2  GLN  52          2HB       GLN  52 -20.920  -1.521   2.421
  389    HB3  GLN  52          1HB       GLN  52 -19.382  -1.662   3.254
  390    HG2  GLN  52          2HG       GLN  52 -19.742   0.618   2.630
  391    HG3  GLN  52          1HG       GLN  52 -18.413  -0.036   1.677
  392   HE21  GLN  52          1HE2      GLN  52 -18.669  -0.316  -0.519
  393   HE22  GLN  52          2HE2      GLN  52 -19.987   0.382  -1.397
  394    H    LEU  53           H        LEU  53 -17.572  -3.605   2.732
  395    HA   LEU  53           HA       LEU  53 -15.415  -2.123   1.544
  396    HB2  LEU  53          2HB       LEU  53 -15.382  -2.556   3.923
  397    HB3  LEU  53          1HB       LEU  53 -15.434  -4.282   3.648
  398    HG   LEU  53           HG       LEU  53 -13.130  -2.772   2.503
  399   HD11  LEU  53          1HD1      LEU  53 -13.326  -1.864   4.767
  400   HD12  LEU  53          2HD1      LEU  53 -11.915  -2.912   4.613
  401   HD13  LEU  53          3HD1      LEU  53 -13.367  -3.502   5.419
  402   HD21  LEU  53          1HD2      LEU  53 -13.381  -5.171   2.099
  403   HD22  LEU  53          2HD2      LEU  53 -13.387  -5.465   3.841
  404   HD23  LEU  53          3HD2      LEU  53 -11.940  -4.824   3.058
  405    H    GLN  54           H        GLN  54 -16.642  -5.421   1.405
  406    HA   GLN  54           HA       GLN  54 -14.463  -6.534   0.024
  407    HB2  GLN  54          2HB       GLN  54 -15.800  -8.409  -0.400
  408    HB3  GLN  54          1HB       GLN  54 -16.355  -7.783   1.131
  409    HG2  GLN  54          2HG       GLN  54 -18.338  -6.967   0.223
  410    HG3  GLN  54          1HG       GLN  54 -17.728  -7.068  -1.424
  411   HE21  GLN  54          1HE2      GLN  54 -19.020  -8.887   1.267
  412   HE22  GLN  54          2HE2      GLN  54 -19.391 -10.310   0.363
  413    H    GLU  55           H        GLU  55 -17.395  -4.887  -1.104
  414    HA   GLU  55           HA       GLU  55 -16.848  -5.328  -3.860
  415    HB2  GLU  55          2HB       GLU  55 -18.623  -3.681  -4.291
  416    HB3  GLU  55          1HB       GLU  55 -19.120  -4.928  -3.159
  417    HG2  GLU  55          2HG       GLU  55 -19.842  -3.279  -1.880
  418    HG3  GLU  55          1HG       GLU  55 -18.176  -2.941  -1.519
  419    H    LYS  56           H        LYS  56 -15.997  -2.812  -1.572
  420    HA   LYS  56           HA       LYS  56 -14.905  -0.845  -3.147
  421    HB2  LYS  56          2HB       LYS  56 -14.613  -1.678  -0.469
  422    HB3  LYS  56          1HB       LYS  56 -12.977  -1.640  -1.121
  423    HG2  LYS  56          2HG       LYS  56 -13.438   0.481  -0.130
  424    HG3  LYS  56          1HG       LYS  56 -13.436   0.702  -1.881
  425    HD2  LYS  56          2HD       LYS  56 -15.889   0.580  -1.889
  426    HD3  LYS  56          1HD       LYS  56 -15.879   0.384  -0.137
  427    HE2  LYS  56          2HE       LYS  56 -16.367   2.667  -0.616
  428    HE3  LYS  56          1HE       LYS  56 -14.731   2.588   0.031
  429    HZ1  LYS  56          1HZ       LYS  56 -15.414   2.783  -2.852
  430    HZ2  LYS  56          2HZ       LYS  56 -13.855   2.782  -2.197
  431    HZ3  LYS  56          3HZ       LYS  56 -14.905   4.071  -1.880
  432    H    LYS  57           H        LYS  57 -13.424  -3.858  -2.142
  433    HA   LYS  57           HA       LYS  57 -11.110  -3.396  -3.824
  434    HB2  LYS  57          2HB       LYS  57 -11.663  -5.637  -1.890
  435    HB3  LYS  57          1HB       LYS  57 -10.112  -5.107  -2.517
  436    HG2  LYS  57          2HG       LYS  57  -9.922  -3.459  -1.060
  437    HG3  LYS  57          1HG       LYS  57 -11.598  -3.012  -1.208
  438    HD2  LYS  57          2HD       LYS  57 -10.713  -3.906   1.058
  439    HD3  LYS  57          1HD       LYS  57 -12.278  -4.446   0.460
  440    HE2  LYS  57          2HE       LYS  57  -9.975  -6.090  -0.368
  441    HE3  LYS  57          1HE       LYS  57 -10.313  -6.087   1.353
  442    HZ1  LYS  57          1HZ       LYS  57 -11.471  -7.820  -0.146
  443    HZ2  LYS  57          2HZ       LYS  57 -12.512  -6.548  -0.546
  444    HZ3  LYS  57          3HZ       LYS  57 -12.361  -7.047   1.069
  445    H    LYS  58           H        LYS  58 -14.042  -4.673  -4.436
  446    HA   LYS  58           HA       LYS  58 -13.425  -7.134  -5.691
  447    HB2  LYS  58          2HB       LYS  58 -15.690  -5.188  -5.969
  448    HB3  LYS  58          1HB       LYS  58 -15.546  -6.542  -7.080
  449    HG2  LYS  58          2HG       LYS  58 -15.673  -6.813  -4.087
  450    HG3  LYS  58          1HG       LYS  58 -17.063  -6.956  -5.167
  451    HD2  LYS  58          2HD       LYS  58 -15.951  -8.828  -6.311
  452    HD3  LYS  58          1HD       LYS  58 -14.596  -8.693  -5.188
  453    HE2  LYS  58          2HE       LYS  58 -16.097 -10.470  -4.495
  454    HE3  LYS  58          1HE       LYS  58 -16.107  -9.160  -3.318
  455    HZ1  LYS  58          1HZ       LYS  58 -18.337  -9.942  -3.750
  456    HZ2  LYS  58          2HZ       LYS  58 -18.164  -9.639  -5.402
  457    HZ3  LYS  58          3HZ       LYS  58 -18.172  -8.354  -4.307
  458    H    GLY  59           H        GLY  59 -12.289  -7.523  -7.430
  459    HA2  GLY  59          2HA       GLY  59 -12.168  -6.807  -9.880
  460    HA3  GLY  59          1HA       GLY  59 -11.638  -5.271  -9.206
  461    H    ARG  60           H        ARG  60  -9.890  -5.781  -7.338
  462    HA   ARG  60           HA       ARG  60  -7.889  -7.410  -8.732
  463    HB2  ARG  60          2HB       ARG  60  -7.643  -4.838  -8.706
  464    HB3  ARG  60          1HB       ARG  60  -7.165  -5.055  -7.027
  465    HG2  ARG  60          2HG       ARG  60  -5.277  -4.934  -8.650
  466    HG3  ARG  60          1HG       ARG  60  -5.297  -6.385  -7.642
  467    HD2  ARG  60          2HD       ARG  60  -6.153  -7.711  -9.406
  468    HD3  ARG  60          1HD       ARG  60  -6.507  -6.290 -10.395
  469    HE   ARG  60           HE       ARG  60  -3.857  -6.106 -10.105
  470   HH11  ARG  60          1HH1      ARG  60  -5.905  -8.813 -10.944
  471   HH12  ARG  60          2HH1      ARG  60  -4.694  -9.594 -11.908
  472   HH21  ARG  60          1HH2      ARG  60  -2.255  -7.130 -11.372
  473   HH22  ARG  60          2HH2      ARG  60  -2.617  -8.633 -12.158
  474    H    ALA  61           H        ALA  61  -9.082  -6.355  -5.581
  475    HA   ALA  61           HA       ALA  61  -7.419  -8.341  -4.242
  476    HB1  ALA  61          1HB       ALA  61  -9.607  -7.000  -2.767
  477    HB2  ALA  61          2HB       ALA  61  -8.302  -5.975  -3.345
  478    HB3  ALA  61          3HB       ALA  61  -7.945  -7.328  -2.269
  479    H    ALA  62           H        ALA  62 -10.398  -8.008  -5.732
  480    HA   ALA  62           HA       ALA  62 -12.217  -9.307  -6.031
  481    HB1  ALA  62          1HB       ALA  62 -10.546 -10.965  -6.687
  482    HB2  ALA  62          2HB       ALA  62 -11.929 -11.724  -5.898
  483    HB3  ALA  62          3HB       ALA  62 -10.420 -11.503  -5.012
  484    H    ALA  63           H        ALA  63 -11.681 -11.669  -3.656
  485    HA   ALA  63           HA       ALA  63 -13.599 -10.354  -1.891
  486    HB1  ALA  63          1HB       ALA  63 -14.063 -12.673  -2.528
  487    HB2  ALA  63          2HB       ALA  63 -13.804 -12.524  -0.789
  488    HB3  ALA  63          3HB       ALA  63 -12.529 -13.176  -1.817
  489    H    ASN  64           H        ASN  64 -10.758 -12.414  -1.282
  490    HA   ASN  64           HA       ASN  64  -9.902 -10.435   0.710
  491    HB2  ASN  64          2HB       ASN  64  -9.986 -13.434   0.942
  492    HB3  ASN  64          1HB       ASN  64  -8.941 -12.456   1.963
  493   HD21  ASN  64          1HD2      ASN  64 -10.823 -10.245   2.059
  494   HD22  ASN  64          2HD2      ASN  64 -12.090 -10.735   3.131
  495    H    GLY  65           H        GLY  65  -8.050  -9.583   0.302
  496    HA2  GLY  65          2HA       GLY  65  -5.617 -10.217   0.221
  497    HA3  GLY  65          1HA       GLY  65  -6.052 -11.194  -1.168
  498    H    TYR  66           H        TYR  66  -5.808  -7.841   0.009
  499    HA   TYR  66           HA       TYR  66  -5.816  -6.685  -2.597
  500    HB2  TYR  66          2HB       TYR  66  -5.328  -5.707   0.006
  501    HB3  TYR  66          1HB       TYR  66  -3.959  -5.268  -0.982
  502    HD1  TYR  66          1HD       TYR  66  -5.129  -3.064   0.026
  503    HD2  TYR  66          2HD       TYR  66  -6.604  -5.305  -3.249
  504    HE1  TYR  66          1HE       TYR  66  -6.316  -1.073  -0.764
  505    HE2  TYR  66          2HE       TYR  66  -7.813  -3.334  -4.059
  506    HH   TYR  66           HH       TYR  66  -8.679  -1.235  -3.244
  507    H    ASP  67           H        ASP  67  -3.945  -5.779  -3.681
  508    HA   ASP  67           HA       ASP  67  -1.566  -7.421  -3.335
  509    HB2  ASP  67          2HB       ASP  67  -1.707  -8.274  -5.419
  510    HB3  ASP  67          1HB       ASP  67  -3.403  -7.785  -5.328
  511    H    ARG  68           H        ARG  68   0.295  -6.380  -4.470
  512    HA   ARG  68           HA       ARG  68   0.635  -3.884  -3.326
  513    HB2  ARG  68          2HB       ARG  68   2.706  -3.743  -4.816
  514    HB3  ARG  68          1HB       ARG  68   2.588  -5.129  -3.740
  515    HG2  ARG  68          2HG       ARG  68   1.813  -6.511  -5.599
  516    HG3  ARG  68          1HG       ARG  68   1.932  -5.120  -6.677
  517    HD2  ARG  68          2HD       ARG  68   4.314  -5.005  -6.329
  518    HD3  ARG  68          1HD       ARG  68   4.237  -6.296  -5.129
  519    HE   ARG  68           HE       ARG  68   3.628  -7.812  -6.914
  520   HH11  ARG  68          1HH1      ARG  68   4.943  -4.717  -7.897
  521   HH12  ARG  68          2HH1      ARG  68   5.425  -5.274  -9.463
  522   HH21  ARG  68          1HH2      ARG  68   4.254  -8.543  -8.983
  523   HH22  ARG  68          2HH2      ARG  68   5.053  -7.458 -10.075
  524    H    SER  69           H        SER  69  -0.290  -4.654  -6.653
  525    HA   SER  69           HA       SER  69   0.049  -1.985  -7.585
  526    HB2  SER  69          2HB       SER  69   0.020  -4.074  -9.015
  527    HB3  SER  69          1HB       SER  69  -1.731  -4.095  -8.805
  528    HG   SER  69           HG       SER  69  -1.932  -2.368 -10.055
  529    H    ALA  70           H        ALA  70  -2.785  -3.879  -6.567
  530    HA   ALA  70           HA       ALA  70  -4.722  -1.873  -6.978
  531    HB1  ALA  70          1HB       ALA  70  -6.180  -3.202  -5.672
  532    HB2  ALA  70          2HB       ALA  70  -4.843  -3.954  -4.804
  533    HB3  ALA  70          3HB       ALA  70  -5.120  -4.337  -6.509
  534    H    PHE  71           H        PHE  71  -2.952  -2.867  -4.104
  535    HA   PHE  71           HA       PHE  71  -4.034  -1.051  -2.297
  536    HB2  PHE  71          2HB       PHE  71  -2.671  -3.021  -1.667
  537    HB3  PHE  71          1HB       PHE  71  -1.248  -2.239  -2.327
  538    HD1  PHE  71          1HD       PHE  71  -3.694  -2.181   0.385
  539    HD2  PHE  71          2HD       PHE  71  -0.118  -0.497  -1.151
  540    HE1  PHE  71          1HE       PHE  71  -3.276  -1.134   2.558
  541    HE2  PHE  71          2HE       PHE  71   0.309   0.558   1.025
  542    HZ   PHE  71           HZ       PHE  71  -1.269   0.251   2.877
  543    H    PHE  72           H        PHE  72  -1.152  -0.790  -4.361
  544    HA   PHE  72           HA       PHE  72  -0.313   1.689  -3.312
  545    HB2  PHE  72          2HB       PHE  72   1.211   0.222  -4.522
  546    HB3  PHE  72          1HB       PHE  72   0.291   0.468  -6.002
  547    HD1  PHE  72          1HD       PHE  72   1.890   2.554  -3.358
  548    HD2  PHE  72          2HD       PHE  72   1.202   1.934  -7.510
  549    HE1  PHE  72          1HE       PHE  72   3.272   4.516  -3.873
  550    HE2  PHE  72          2HE       PHE  72   2.587   3.898  -8.037
  551    HZ   PHE  72           HZ       PHE  72   3.623   5.194  -6.217
  552    H    SER  73           H        SER  73  -2.404   0.842  -5.967
  553    HA   SER  73           HA       SER  73  -2.590   3.384  -7.156
  554    HB2  SER  73          2HB       SER  73  -4.614   1.132  -7.135
  555    HB3  SER  73          1HB       SER  73  -4.626   2.508  -8.239
  556    HG   SER  73           HG       SER  73  -2.810   0.352  -8.088
  557    H    LEU  74           H        LEU  74  -4.317   1.900  -4.478
  558    HA   LEU  74           HA       LEU  74  -6.246   4.005  -4.230
  559    HB2  LEU  74          2HB       LEU  74  -6.668   1.715  -3.419
  560    HB3  LEU  74          1HB       LEU  74  -5.383   1.902  -2.244
  561    HG   LEU  74           HG       LEU  74  -6.649   3.546  -1.026
  562   HD11  LEU  74          1HD1      LEU  74  -7.700   4.711  -2.879
  563   HD12  LEU  74          2HD1      LEU  74  -8.921   4.183  -1.720
  564   HD13  LEU  74          3HD1      LEU  74  -8.694   3.298  -3.231
  565   HD21  LEU  74          1HD2      LEU  74  -8.249   1.134  -1.831
  566   HD22  LEU  74          2HD2      LEU  74  -8.656   2.176  -0.465
  567   HD23  LEU  74          3HD2      LEU  74  -7.138   1.276  -0.469
  568    H    VAL  75           H        VAL  75  -3.306   3.113  -2.432
  569    HA   VAL  75           HA       VAL  75  -3.475   5.197  -0.539
  570    HB   VAL  75           HB       VAL  75  -0.912   3.892  -1.460
  571   HG11  VAL  75          1HG1      VAL  75  -0.229   5.460   0.013
  572   HG12  VAL  75          2HG1      VAL  75  -0.556   4.110   1.106
  573   HG13  VAL  75          3HG1      VAL  75  -1.730   5.416   0.933
  574   HG21  VAL  75          1HG2      VAL  75  -1.359   2.302   0.444
  575   HG22  VAL  75          2HG2      VAL  75  -2.327   2.065  -1.014
  576   HG23  VAL  75          3HG2      VAL  75  -3.030   2.863   0.394
  577    H    ALA  76           H        ALA  76  -1.825   4.998  -3.672
  578    HA   ALA  76           HA       ALA  76  -0.374   7.391  -3.469
  579    HB1  ALA  76          1HB       ALA  76   0.074   5.695  -5.176
  580    HB2  ALA  76          2HB       ALA  76  -0.161   7.292  -5.888
  581    HB3  ALA  76          3HB       ALA  76  -1.453   6.092  -5.966
  582    H    SER  77           H        SER  77  -3.709   6.840  -3.894
  583    HA   SER  77           HA       SER  77  -4.166   9.503  -5.010
  584    HB2  SER  77          2HB       SER  77  -6.181   7.310  -4.482
  585    HB3  SER  77          1HB       SER  77  -6.398   8.741  -5.492
  586    HG   SER  77           HG       SER  77  -5.021   6.370  -6.010
  587    H    ASP  78           H        ASP  78  -3.923   8.021  -2.024
  588    HA   ASP  78           HA       ASP  78  -5.665  10.036  -0.775
  589    HB2  ASP  78          2HB       ASP  78  -5.548   7.081  -0.293
  590    HB3  ASP  78          1HB       ASP  78  -5.979   8.166   1.030
  591    H    GLU  79           H        GLU  79  -4.320  11.406   0.210
  592    HA   GLU  79           HA       GLU  79  -1.728  10.730   1.111
  593    HB2  GLU  79          2HB       GLU  79  -1.591  12.941   1.033
  594    HB3  GLU  79          1HB       GLU  79  -3.335  13.105   0.941
  595    HG2  GLU  79          2HG       GLU  79  -1.910  12.762   3.568
  596    HG3  GLU  79          1HG       GLU  79  -2.066  14.336   2.791
  597    H    GLN  80           H        GLN  80  -4.835  10.574   2.715
  598    HA   GLN  80           HA       GLN  80  -3.925  10.452   5.368
  599    HB2  GLN  80          2HB       GLN  80  -6.180   8.724   4.372
  600    HB3  GLN  80          1HB       GLN  80  -5.999   9.479   5.945
  601    HG2  GLN  80          2HG       GLN  80  -7.605  10.802   5.029
  602    HG3  GLN  80          1HG       GLN  80  -6.159  11.695   4.565
  603   HE21  GLN  80          1HE2      GLN  80  -7.144   8.692   3.051
  604   HE22  GLN  80          2HE2      GLN  80  -7.581   9.382   1.523
  605    H    TYR  81           H        TYR  81  -3.685   8.275   2.761
  606    HA   TYR  81           HA       TYR  81  -3.469   5.894   4.372
  607    HB2  TYR  81          2HB       TYR  81  -3.671   6.434   1.424
  608    HB3  TYR  81          1HB       TYR  81  -3.227   4.845   2.034
  609    HD1  TYR  81          1HD       TYR  81  -5.567   4.900   0.415
  610    HD2  TYR  81          2HD       TYR  81  -5.228   5.882   4.529
  611    HE1  TYR  81          1HE       TYR  81  -7.926   4.269   0.750
  612    HE2  TYR  81          2HE       TYR  81  -7.563   5.294   4.863
  613    HH   TYR  81           HH       TYR  81  -9.375   3.571   2.600
  614    H    VAL  82           H        VAL  82  -1.499   7.879   2.198
  615    HA   VAL  82           HA       VAL  82   0.713   6.215   2.172
  616    HB   VAL  82           HB       VAL  82   1.879   8.246   1.495
  617   HG11  VAL  82          1HG1      VAL  82   0.630   8.667  -0.580
  618   HG12  VAL  82          2HG1      VAL  82  -0.721   7.771   0.122
  619   HG13  VAL  82          3HG1      VAL  82   0.804   6.950  -0.208
  620   HG21  VAL  82          1HG2      VAL  82  -0.635   9.608   2.183
  621   HG22  VAL  82          2HG2      VAL  82   0.512  10.282   1.024
  622   HG23  VAL  82          3HG2      VAL  82   1.013   9.990   2.691
  623    H    ARG  83           H        ARG  83   0.056   9.102   4.097
  624    HA   ARG  83           HA       ARG  83   2.240   8.653   5.822
  625    HB2  ARG  83          2HB       ARG  83   1.070  10.357   7.336
  626    HB3  ARG  83          1HB       ARG  83   1.724  10.881   5.801
  627    HG2  ARG  83          2HG       ARG  83  -0.642  10.568   4.899
  628    HG3  ARG  83          1HG       ARG  83  -1.143  10.512   6.597
  629    HD2  ARG  83          2HD       ARG  83   0.264  12.702   6.733
  630    HD3  ARG  83          1HD       ARG  83   0.068  12.669   4.983
  631    HE   ARG  83           HE       ARG  83  -2.426  12.544   5.554
  632   HH11  ARG  83          1HH1      ARG  83  -0.044  14.278   7.456
  633   HH12  ARG  83          2HH1      ARG  83  -1.145  15.539   7.910
  634   HH21  ARG  83          1HH2      ARG  83  -3.855  14.219   6.109
  635   HH22  ARG  83          2HH2      ARG  83  -3.317  15.501   7.154
  636    H    PHE  84           H        PHE  84  -1.040   7.462   5.851
  637    HA   PHE  84           HA       PHE  84  -1.178   6.721   8.558
  638    HB2  PHE  84          2HB       PHE  84  -2.780   6.224   6.402
  639    HB3  PHE  84          1HB       PHE  84  -2.072   4.627   6.664
  640    HD1  PHE  84          1HD       PHE  84  -2.464   3.421   8.728
  641    HD2  PHE  84          2HD       PHE  84  -4.327   7.167   7.979
  642    HE1  PHE  84          1HE       PHE  84  -4.068   2.975  10.540
  643    HE2  PHE  84          2HE       PHE  84  -5.939   6.734   9.791
  644    HZ   PHE  84           HZ       PHE  84  -5.810   4.635  11.074
  645    H    ILE  85           H        ILE  85   0.273   5.032   5.799
  646    HA   ILE  85           HA       ILE  85   1.335   2.950   7.478
  647    HB   ILE  85           HB       ILE  85   1.491   3.532   4.564
  648   HG12  ILE  85          2HG1      ILE  85   0.806   1.137   6.279
  649   HG13  ILE  85          1HG1      ILE  85  -0.305   2.138   5.352
  650   HG21  ILE  85          1HG2      ILE  85   3.784   3.139   4.922
  651   HG22  ILE  85          2HG2      ILE  85   3.126   1.592   4.380
  652   HG23  ILE  85          3HG2      ILE  85   3.462   1.859   6.088
  653   HD11  ILE  85          1HD1      ILE  85   0.670   1.305   3.278
  654   HD12  ILE  85          2HD1      ILE  85   0.064  -0.010   4.286
  655   HD13  ILE  85          3HD1      ILE  85   1.798   0.302   4.201
  656    H    ALA  86           H        ALA  86   2.769   5.683   5.701
  657    HA   ALA  86           HA       ALA  86   5.410   5.409   6.395
  658    HB1  ALA  86          1HB       ALA  86   5.641   7.787   6.044
  659    HB2  ALA  86          2HB       ALA  86   3.913   8.023   6.281
  660    HB3  ALA  86          3HB       ALA  86   4.493   7.136   4.872
  661    H    GLN  87           H        GLN  87   2.807   6.727   8.389
  662    HA   GLN  87           HA       GLN  87   4.551   7.548  10.491
  663    HB2  GLN  87          2HB       GLN  87   2.320   8.547  10.155
  664    HB3  GLN  87          1HB       GLN  87   1.578   7.009  10.576
  665    HG2  GLN  87          2HG       GLN  87   2.583   7.153  12.805
  666    HG3  GLN  87          1HG       GLN  87   3.281   8.713  12.378
  667   HE21  GLN  87          1HE2      GLN  87   0.932   9.528  10.855
  668   HE22  GLN  87          2HE2      GLN  87  -0.278   9.925  12.023
  669    H    HIS  88           H        HIS  88   2.612   4.685   9.793
  670    HA   HIS  88           HA       HIS  88   3.052   3.347  12.256
  671    HB2  HIS  88          2HB       HIS  88   2.163   2.471   9.532
  672    HB3  HIS  88          1HB       HIS  88   2.615   1.252  10.715
  673    HD1  HIS  88          1HD       HIS  88   1.350   2.511  13.227
  674    HD2  HIS  88          2HD       HIS  88  -0.569   2.182   9.547
  675    HE1  HIS  88          1HE       HIS  88  -1.104   2.591  13.737
  676    HE2  HIS  88          2HE       HIS  88  -2.232   2.162  11.536
  677    H    PHE  89           H        PHE  89   4.717   3.197   9.128
  678    HA   PHE  89           HA       PHE  89   7.000   1.916  10.442
  679    HB2  PHE  89          2HB       PHE  89   5.467   0.181   9.462
  680    HB3  PHE  89          1HB       PHE  89   5.776   0.886   7.882
  681    HD1  PHE  89          1HD       PHE  89   7.522   0.104   6.606
  682    HD2  PHE  89          2HD       PHE  89   7.540  -0.616  10.795
  683    HE1  PHE  89          1HE       PHE  89   9.468  -1.374   6.334
  684    HE2  PHE  89          2HE       PHE  89   9.500  -2.081  10.539
  685    HZ   PHE  89           HZ       PHE  89  10.467  -2.463   8.308
  686    HA   PRO  90           HA       PRO  90   8.913   5.193   7.963
  687    HB2  PRO  90          2HB       PRO  90  11.303   3.922   9.175
  688    HB3  PRO  90          1HB       PRO  90  10.823   5.621   9.151
  689    HG2  PRO  90          2HG       PRO  90  10.611   4.174  11.378
  690    HG3  PRO  90          1HG       PRO  90   9.379   5.374  10.946
  691    HD2  PRO  90          2HD       PRO  90   9.293   2.397  10.685
  692    HD3  PRO  90          1HD       PRO  90   8.014   3.520  11.176
  693    H    CYS  91           H        CYS  91  10.528   5.213   6.285
  694    HA   CYS  91           HA       CYS  91  10.078   3.099   4.465
  695    HB2  CYS  91          2HB       CYS  91  10.286   5.215   3.488
  696    HB3  CYS  91          1HB       CYS  91  11.682   5.630   4.460
  697    HG   CYS  91           HG       CYS  91  12.461   3.072   2.555
  698    H    ALA  92           H        ALA  92  11.219   1.469   3.829
  699    HA   ALA  92           HA       ALA  92  13.468   0.580   5.405
  700    HB1  ALA  92          1HB       ALA  92  12.125  -0.623   2.979
  701    HB2  ALA  92          2HB       ALA  92  11.776  -1.010   4.665
  702    HB3  ALA  92          3HB       ALA  92  13.341  -1.427   3.969
  703    HA   PRO  93           HA       PRO  93  16.811   1.929   2.802
  704    HB2  PRO  93          2HB       PRO  93  18.320  -0.333   2.496
  705    HB3  PRO  93          1HB       PRO  93  18.327   0.656   3.954
  706    HG2  PRO  93          2HG       PRO  93  16.793  -1.845   3.375
  707    HG3  PRO  93          1HG       PRO  93  17.704  -1.415   4.837
  708    HD2  PRO  93          2HD       PRO  93  15.051  -1.181   4.778
  709    HD3  PRO  93          1HD       PRO  93  16.046   0.051   5.580
  710    H    GLU  94           H        GLU  94  17.748   1.710   0.706
  711    HA   GLU  94           HA       GLU  94  15.751   0.949  -1.216
  712    HB2  GLU  94          2HB       GLU  94  17.278   2.023  -2.852
  713    HB3  GLU  94          1HB       GLU  94  16.868   3.066  -1.498
  714    HG2  GLU  94          2HG       GLU  94  19.038   2.514  -0.458
  715    HG3  GLU  94          1HG       GLU  94  19.442   1.551  -1.876
  716    H    GLU  95           H        GLU  95  16.463  -1.352  -0.161
  717    HA   GLU  95           HA       GLU  95  18.639  -2.577  -1.647
  718    HB2  GLU  95          2HB       GLU  95  16.756  -3.621   0.469
  719    HB3  GLU  95          1HB       GLU  95  18.004  -4.593  -0.290
  720    HG2  GLU  95          2HG       GLU  95  18.539  -2.041   1.190
  721    HG3  GLU  95          1HG       GLU  95  18.566  -3.637   1.929
  722    H    GLU  96           H        GLU  96  18.105  -4.895  -2.450
  723    HA   GLU  96           HA       GLU  96  16.045  -4.549  -4.464
  724    HB2  GLU  96          2HB       GLU  96  18.147  -6.696  -4.135
  725    HB3  GLU  96          1HB       GLU  96  17.064  -6.536  -5.513
  726    HG2  GLU  96          2HG       GLU  96  18.031  -4.317  -5.977
  727    HG3  GLU  96          1HG       GLU  96  19.159  -4.559  -4.646
  728    H    LYS  97           H        LYS  97  16.389  -6.118  -1.469
  729    HA   LYS  97           HA       LYS  97  14.513  -8.209  -1.904
  730    HB2  LYS  97          2HB       LYS  97  15.339  -6.856   0.671
  731    HB3  LYS  97          1HB       LYS  97  14.329  -8.288   0.578
  732    HG2  LYS  97          2HG       LYS  97  16.154  -9.527  -0.444
  733    HG3  LYS  97          1HG       LYS  97  17.166  -8.083  -0.410
  734    HD2  LYS  97          2HD       LYS  97  17.763  -9.485   1.448
  735    HD3  LYS  97          1HD       LYS  97  16.944  -8.052   2.065
  736    HE2  LYS  97          2HE       LYS  97  16.136  -9.983   3.245
  737    HE3  LYS  97          1HE       LYS  97  14.849  -9.368   2.211
  738    HZ1  LYS  97          1HZ       LYS  97  14.994 -11.771   2.107
  739    HZ2  LYS  97          2HZ       LYS  97  16.603 -11.684   1.594
  740    HZ3  LYS  97          3HZ       LYS  97  15.366 -11.095   0.602
  741    HA   PRO  98           HA       PRO  98  11.346  -4.659  -0.306
  742    HB2  PRO  98          2HB       PRO  98  13.079  -2.539  -1.514
  743    HB3  PRO  98          1HB       PRO  98  11.918  -2.417  -0.185
  744    HG2  PRO  98          2HG       PRO  98  14.518  -2.505   0.312
  745    HG3  PRO  98          1HG       PRO  98  13.372  -3.382   1.342
  746    HD2  PRO  98          2HD       PRO  98  15.244  -4.426  -0.722
  747    HD3  PRO  98          1HD       PRO  98  14.687  -5.170   0.788
  748    HA   PRO  99           HA       PRO  99   9.875  -5.085  -4.437
  749    HB2  PRO  99          2HB       PRO  99   7.662  -3.534  -4.332
  750    HB3  PRO  99          1HB       PRO  99   7.773  -5.097  -3.515
  751    HG2  PRO  99          2HG       PRO  99   8.112  -2.342  -2.392
  752    HG3  PRO  99          1HG       PRO  99   7.244  -3.729  -1.709
  753    HD2  PRO  99          2HD       PRO  99   9.729  -3.011  -0.907
  754    HD3  PRO  99          1HD       PRO  99   9.168  -4.695  -0.905
  755    H    GLU 100           H        GLU 100  11.541  -4.073  -5.575
  756    HA   GLU 100           HA       GLU 100  12.533  -2.578  -6.936
  757    HB2  GLU 100          2HB       GLU 100   9.635  -2.019  -7.336
  758    HB3  GLU 100          1HB       GLU 100  10.837  -0.998  -8.117
  759    HG2  GLU 100          2HG       GLU 100  11.822  -2.859  -9.197
  760    HG3  GLU 100          1HG       GLU 100  10.744  -3.980  -8.361
  761    H    ILE 101           H        ILE 101  13.603  -1.678  -5.182
  762    HA   ILE 101           HA       ILE 101  14.529  -0.003  -4.006
  763    HB   ILE 101           HB       ILE 101  12.973   2.052  -5.522
  764   HG12  ILE 101          2HG1      ILE 101  13.464   0.434  -7.256
  765   HG13  ILE 101          1HG1      ILE 101  14.558   1.779  -7.431
  766   HG21  ILE 101          1HG2      ILE 101  14.654   2.749  -3.894
  767   HG22  ILE 101          2HG2      ILE 101  15.129   3.203  -5.529
  768   HG23  ILE 101          3HG2      ILE 101  15.879   1.811  -4.748
  769   HD11  ILE 101          1HD1      ILE 101  15.534  -0.428  -7.818
  770   HD12  ILE 101          2HD1      ILE 101  15.240  -0.815  -6.129
  771   HD13  ILE 101          3HD1      ILE 101  16.354   0.490  -6.551
  772    H    ASP 102           H        ASP 102  11.593  -0.941  -3.723
  773    HA   ASP 102           HA       ASP 102  10.302  -1.120  -1.873
  774    HB2  ASP 102          2HB       ASP 102  12.439  -0.200  -0.684
  775    HB3  ASP 102          1HB       ASP 102  11.551   1.301  -0.611
  776    H    ALA 103           H        ALA 103  10.604   1.499  -3.893
  777    HA   ALA 103           HA       ALA 103   8.086   2.720  -2.936
  778    HB1  ALA 103          1HB       ALA 103  10.546   3.994  -4.053
  779    HB2  ALA 103          2HB       ALA 103   9.558   4.465  -2.666
  780    HB3  ALA 103          3HB       ALA 103   8.980   4.767  -4.301
  781    H    LEU 104           H        LEU 104  10.001   2.421  -5.934
  782    HA   LEU 104           HA       LEU 104   8.156   1.310  -7.607
  783    HB2  LEU 104          2HB       LEU 104   6.935   3.052  -8.654
  784    HB3  LEU 104          1HB       LEU 104   6.740   3.286  -6.927
  785    HG   LEU 104           HG       LEU 104   8.963   4.839  -7.619
  786   HD11  LEU 104          1HD1      LEU 104   8.368   4.650  -9.967
  787   HD12  LEU 104          2HD1      LEU 104   8.101   6.295  -9.388
  788   HD13  LEU 104          3HD1      LEU 104   6.732   5.206  -9.613
  789   HD21  LEU 104          1HD2      LEU 104   6.091   5.618  -7.135
  790   HD22  LEU 104          2HD2      LEU 104   7.472   6.714  -7.067
  791   HD23  LEU 104          3HD2      LEU 104   7.341   5.387  -5.912
  792    H    GLU 105           H        GLU 105  10.837   3.312  -7.038
  793    HA   GLU 105           HA       GLU 105  11.294   4.248  -9.669
  794    HB2  GLU 105          2HB       GLU 105  13.110   4.130  -7.265
  795    HB3  GLU 105          1HB       GLU 105  13.487   4.978  -8.760
  796    HG2  GLU 105          2HG       GLU 105  11.603   6.446  -8.460
  797    HG3  GLU 105          1HG       GLU 105  11.088   5.544  -7.037
  798    H    LEU 106           H        LEU 106  13.603   3.899 -10.625
  799    HA   LEU 106           HA       LEU 106  13.603   1.083 -11.323
  800    HB2  LEU 106          2HB       LEU 106  15.080   3.423 -12.514
  801    HB3  LEU 106          1HB       LEU 106  15.103   1.792 -13.152
  802    HG   LEU 106           HG       LEU 106  12.657   3.552 -12.949
  803   HD11  LEU 106          1HD1      LEU 106  14.194   4.356 -14.643
  804   HD12  LEU 106          2HD1      LEU 106  12.782   3.614 -15.396
  805   HD13  LEU 106          3HD1      LEU 106  14.311   2.736 -15.333
  806   HD21  LEU 106          1HD2      LEU 106  11.590   1.804 -14.316
  807   HD22  LEU 106          2HD2      LEU 106  12.070   1.216 -12.725
  808   HD23  LEU 106          3HD2      LEU 106  13.036   0.809 -14.143
  809    H    LYS 107           H        LYS 107  16.014   3.519 -10.328
  810    HA   LYS 107           HA       LYS 107  17.478   1.504  -8.867
  811    HB2  LYS 107          2HB       LYS 107  18.298   1.184 -11.171
  812    HB3  LYS 107          1HB       LYS 107  18.748   2.879 -11.246
  813    HG2  LYS 107          2HG       LYS 107  20.383   2.542  -9.483
  814    HG3  LYS 107          1HG       LYS 107  19.906   0.848  -9.349
  815    HD2  LYS 107          2HD       LYS 107  21.031   2.124 -11.841
  816    HD3  LYS 107          1HD       LYS 107  21.976   1.198 -10.678
  817    HE2  LYS 107          2HE       LYS 107  19.634   0.162 -12.274
  818    HE3  LYS 107          1HE       LYS 107  21.332  -0.159 -12.614
  819    HZ1  LYS 107          1HZ       LYS 107  19.872  -0.972 -10.158
  820    HZ2  LYS 107          2HZ       LYS 107  21.507  -1.267 -10.468
  821    HZ3  LYS 107          3HZ       LYS 107  20.321  -1.992 -11.427
  822    H    THR 108           H        THR 108  18.638   2.377  -7.233
  823    HA   THR 108           HA       THR 108  19.276   3.867  -5.670
  824    HB   THR 108           HB       THR 108  20.555   5.862  -6.431
  825    HG1  THR 108          1HG       THR 108  19.224   5.406  -8.733
  826   HG21  THR 108          1HG2      THR 108  21.682   3.739  -6.131
  827   HG22  THR 108          2HG2      THR 108  22.360   4.591  -7.518
  828   HG23  THR 108          3HG2      THR 108  21.245   3.248  -7.767
  829    H    GLN 109           H        GLN 109  19.286   6.475  -5.272
  830    HA   GLN 109           HA       GLN 109  16.991   7.897  -6.116
  831    HB2  GLN 109          2HB       GLN 109  15.841   7.929  -3.885
  832    HB3  GLN 109          1HB       GLN 109  15.734   6.391  -4.728
  833    HG2  GLN 109          2HG       GLN 109  17.565   5.526  -3.334
  834    HG3  GLN 109          1HG       GLN 109  17.593   7.057  -2.459
  835   HE21  GLN 109          1HE2      GLN 109  15.769   4.164  -3.110
  836   HE22  GLN 109          2HE2      GLN 109  14.698   4.293  -1.758
  837    H    LYS 110           H        LYS 110  16.695   9.519  -3.791
  838    HA   LYS 110           HA       LYS 110  19.103  11.067  -4.057
  839    HB2  LYS 110          2HB       LYS 110  16.679  11.492  -2.304
  840    HB3  LYS 110          1HB       LYS 110  17.975  12.654  -2.534
  841    HG2  LYS 110          2HG       LYS 110  17.421  12.884  -4.865
  842    HG3  LYS 110          1HG       LYS 110  16.207  11.610  -4.735
  843    HD2  LYS 110          2HD       LYS 110  15.168  13.816  -4.706
  844    HD3  LYS 110          1HD       LYS 110  14.931  12.985  -3.167
  845    HE2  LYS 110          2HE       LYS 110  16.809  14.258  -2.216
  846    HE3  LYS 110          1HE       LYS 110  16.990  15.112  -3.746
  847    HZ1  LYS 110          1HZ       LYS 110  14.625  15.190  -1.954
  848    HZ2  LYS 110          2HZ       LYS 110  14.712  15.941  -3.466
  849    HZ3  LYS 110          3HZ       LYS 110  15.735  16.441  -2.216
  850    H    GLY 111           H        GLY 111  17.543   9.191  -1.505
  851    HA2  GLY 111          2HA       GLY 111  18.765   7.974   0.131
  852    HA3  GLY 111          1HA       GLY 111  20.120   9.071  -0.107
  853    H    PHE 112           H        PHE 112  19.625  11.394   0.465
  854    HA   PHE 112           HA       PHE 112  19.211  12.942   2.063
  855    HB2  PHE 112          2HB       PHE 112  16.947  12.644   0.992
  856    HB3  PHE 112          1HB       PHE 112  16.529  11.573   2.320
  857    HD1  PHE 112          1HD       PHE 112  15.429  12.469   4.132
  858    HD2  PHE 112          2HD       PHE 112  17.862  15.002   1.730
  859    HE1  PHE 112          1HE       PHE 112  14.700  14.413   5.450
  860    HE2  PHE 112          2HE       PHE 112  17.138  16.949   3.044
  861    HZ   PHE 112           HZ       PHE 112  15.555  16.656   4.905
  Start of MODEL    3
    1    H1   GLY   1          1HT       GLY   1 -11.618  10.286  -1.264
    2    H2   GLY   1          2HT       GLY   1 -12.362  11.214  -2.464
    3    H    GLY   1           H        GLY   1 -12.239  10.438  -1.995
    4    H3   GLY   1          3HT       GLY   1 -11.498  11.975  -1.227
    5    HA2  GLY   1          1HA       GLY   1 -10.200  11.983  -3.236
    6    HA3  GLY   1          2HA       GLY   1  -9.447  10.968  -2.014
    7    H    SER   2           H        SER   2  -8.462   9.398  -3.090
    8    HA   SER   2           HA       SER   2  -8.095   7.589  -4.414
    9    HB2  SER   2          2HB       SER   2 -11.090   7.204  -4.292
   10    HB3  SER   2          1HB       SER   2  -9.862   5.963  -4.549
   11    HG   SER   2           HG       SER   2  -9.098   6.957  -2.346
   12    H    ALA   3           H        ALA   3  -8.457  10.083  -5.781
   13    HA   ALA   3           HA       ALA   3 -10.053   9.442  -8.141
   14    HB1  ALA   3          1HB       ALA   3  -9.721  11.769  -8.773
   15    HB2  ALA   3          2HB       ALA   3  -8.623  11.991  -7.409
   16    HB3  ALA   3          3HB       ALA   3 -10.327  11.645  -7.120
   17    H    MET   4           H        MET   4  -7.262   8.401  -7.319
   18    HA   MET   4           HA       MET   4  -5.403   7.646  -8.357
   19    HB2  MET   4          2HB       MET   4  -6.975   8.406 -10.815
   20    HB3  MET   4          1HB       MET   4  -5.392   7.648 -10.893
   21    HG2  MET   4          2HG       MET   4  -7.865   6.492  -9.627
   22    HG3  MET   4          1HG       MET   4  -7.141   6.003 -11.158
   23    HE1  MET   4          1HE       MET   4  -4.724   4.875 -11.344
   24    HE2  MET   4          2HE       MET   4  -3.718   4.482  -9.949
   25    HE3  MET   4          3HE       MET   4  -4.006   6.167 -10.383
   26    H    GLY   5           H        GLY   5  -5.264  10.161  -7.276
   27    HA2  GLY   5          2HA       GLY   5  -4.067  12.082  -8.972
   28    HA3  GLY   5          1HA       GLY   5  -3.847  11.971  -7.230
   29    H    HIS   6           H        HIS   6  -1.908  12.524  -9.436
   30    HA   HIS   6           HA       HIS   6  -0.242  10.129  -9.409
   31    HB2  HIS   6          2HB       HIS   6  -0.694  11.452 -11.529
   32    HB3  HIS   6          1HB       HIS   6   0.315  12.724 -10.850
   33    HD1  HIS   6          1HD       HIS   6   2.797  12.489 -11.155
   34    HD2  HIS   6          2HD       HIS   6   0.740   8.994 -12.036
   35    HE1  HIS   6          1HE       HIS   6   4.498  10.944 -12.172
   36    HE2  HIS   6          2HE       HIS   6   3.194   8.902 -12.850
   37    H    MET   7           H        MET   7   0.746   9.979  -7.489
   38    HA   MET   7           HA       MET   7   2.253  10.333  -5.839
   39    HB2  MET   7          2HB       MET   7   3.289  12.550  -7.616
   40    HB3  MET   7          1HB       MET   7   4.124  11.882  -6.222
   41    HG2  MET   7          2HG       MET   7   4.223   9.702  -7.339
   42    HG3  MET   7          1HG       MET   7   3.416  10.397  -8.744
   43    HE1  MET   7          1HE       MET   7   5.317   9.699 -10.452
   44    HE2  MET   7          2HE       MET   7   6.051   8.830  -9.108
   45    HE3  MET   7          3HE       MET   7   7.036   9.898 -10.105
   46    H    VAL   8           H        VAL   8   1.420  11.022  -3.998
   47    HA   VAL   8           HA       VAL   8   0.287  13.717  -3.903
   48    HB   VAL   8           HB       VAL   8  -1.393  12.013  -3.661
   49   HG11  VAL   8          1HG1      VAL   8   0.242  10.957  -1.372
   50   HG12  VAL   8          2HG1      VAL   8  -0.184  10.137  -2.872
   51   HG13  VAL   8          3HG1      VAL   8  -1.433  10.508  -1.686
   52   HG21  VAL   8          1HG2      VAL   8  -2.390  12.684  -1.522
   53   HG22  VAL   8          2HG2      VAL   8  -1.770  14.047  -2.449
   54   HG23  VAL   8          3HG2      VAL   8  -0.864  13.438  -1.065
   55    H    LYS   9           H        LYS   9   0.487  12.436  -0.855
   56    HA   LYS   9           HA       LYS   9   2.785  13.990  -0.142
   57    HB2  LYS   9          2HB       LYS   9   1.063  12.070   1.442
   58    HB3  LYS   9          1HB       LYS   9   2.467  12.886   2.127
   59    HG2  LYS   9          2HG       LYS   9   0.059  14.238   0.965
   60    HG3  LYS   9          1HG       LYS   9   0.373  14.000   2.681
   61    HD2  LYS   9          2HD       LYS   9   2.423  15.341   2.463
   62    HD3  LYS   9          1HD       LYS   9   2.047  15.614   0.760
   63    HE2  LYS   9          2HE       LYS   9  -0.019  16.721   1.367
   64    HE3  LYS   9          1HE       LYS   9   0.289  16.404   3.073
   65    HZ1  LYS   9          1HZ       LYS   9   2.245  17.795   2.958
   66    HZ2  LYS   9          2HZ       LYS   9   0.882  18.662   2.455
   67    HZ3  LYS   9          3HZ       LYS   9   1.984  18.085   1.312
   68    H    ILE  10           H        ILE  10   3.061  11.787  -2.063
   69    HA   ILE  10           HA       ILE  10   4.715   9.878  -0.645
   70    HB   ILE  10           HB       ILE  10   3.724   9.910  -3.492
   71   HG12  ILE  10          2HG1      ILE  10   3.033   8.207  -1.095
   72   HG13  ILE  10          1HG1      ILE  10   2.000   9.423  -1.842
   73   HG21  ILE  10          1HG2      ILE  10   4.687   7.697  -3.719
   74   HG22  ILE  10          2HG2      ILE  10   5.318   7.775  -2.075
   75   HG23  ILE  10          3HG2      ILE  10   5.948   8.861  -3.314
   76   HD11  ILE  10          1HD1      ILE  10   1.363   7.136  -2.444
   77   HD12  ILE  10          2HD1      ILE  10   2.945   6.901  -3.186
   78   HD13  ILE  10          3HD1      ILE  10   1.829   8.094  -3.851
   79    H    SER  11           H        SER  11   6.583  10.819  -0.241
   80    HA   SER  11           HA       SER  11   8.198  11.794  -2.472
   81    HB2  SER  11          2HB       SER  11   8.883  11.517   0.475
   82    HB3  SER  11          1HB       SER  11   9.854  12.347  -0.744
   83    HG   SER  11           HG       SER  11   7.488  13.413  -0.924
   84    H    HIS  12           H        HIS  12  10.677  10.747  -1.984
   85    HA   HIS  12           HA       HIS  12  10.576   8.140  -2.947
   86    HB2  HIS  12          2HB       HIS  12  12.720   9.383  -1.216
   87    HB3  HIS  12          1HB       HIS  12  12.904   7.887  -2.121
   88    HD1  HIS  12          1HD       HIS  12  12.840   8.109  -4.783
   89    HD2  HIS  12          2HD       HIS  12  13.247  11.666  -2.674
   90    HE1  HIS  12          1HE       HIS  12  13.632   9.799  -6.461
   91    HE2  HIS  12          2HE       HIS  12  13.694  11.979  -5.201
   92    H    GLU  13           H        GLU  13  10.736   9.358   0.325
   93    HA   GLU  13           HA       GLU  13  11.062   6.824   1.535
   94    HB2  GLU  13          2HB       GLU  13  10.665   8.014   3.648
   95    HB3  GLU  13          1HB       GLU  13  11.843   8.825   2.612
   96    HG2  GLU  13          2HG       GLU  13  10.012  10.346   1.853
   97    HG3  GLU  13          1HG       GLU  13   8.986   9.626   3.095
   98    H    ASP  14           H        ASP  14   8.140   8.747   0.742
   99    HA   ASP  14           HA       ASP  14   6.559   7.199   2.543
  100    HB2  ASP  14          2HB       ASP  14   6.080   9.520   1.037
  101    HB3  ASP  14          1HB       ASP  14   4.903   8.342   0.510
  102    H    THR  15           H        THR  15   7.092   7.071  -0.978
  103    HA   THR  15           HA       THR  15   5.378   4.921  -1.480
  104    HB   THR  15           HB       THR  15   7.739   4.566  -3.034
  105    HG1  THR  15          1HG       THR  15   8.415   6.620  -2.659
  106   HG21  THR  15          1HG2      THR  15   5.484   4.066  -3.775
  107   HG22  THR  15          2HG2      THR  15   6.233   5.234  -4.861
  108   HG23  THR  15          3HG2      THR  15   5.051   5.771  -3.668
  109    H    GLN  16           H        GLN  16   8.781   4.957  -0.462
  110    HA   GLN  16           HA       GLN  16   9.236   2.221  -0.266
  111    HB2  GLN  16          2HB       GLN  16  10.220   4.550   1.361
  112    HB3  GLN  16          1HB       GLN  16  10.688   2.906   1.767
  113    HG2  GLN  16          2HG       GLN  16  11.745   2.630  -0.368
  114    HG3  GLN  16          1HG       GLN  16  11.155   4.201  -0.898
  115   HE21  GLN  16          1HE2      GLN  16  12.122   6.048  -0.148
  116   HE22  GLN  16          2HE2      GLN  16  13.633   6.048   0.693
  117    H    ARG  17           H        ARG  17   7.803   4.470   2.032
  118    HA   ARG  17           HA       ARG  17   7.438   2.717   4.175
  119    HB2  ARG  17          2HB       ARG  17   6.133   5.277   3.314
  120    HB3  ARG  17          1HB       ARG  17   5.484   4.392   4.683
  121    HG2  ARG  17          2HG       ARG  17   7.168   5.003   6.037
  122    HG3  ARG  17          1HG       ARG  17   8.380   4.849   4.768
  123    HD2  ARG  17          2HD       ARG  17   8.006   6.993   3.961
  124    HD3  ARG  17          1HD       ARG  17   6.409   7.104   4.714
  125    HE   ARG  17           HE       ARG  17   8.571   6.894   6.603
  126   HH11  ARG  17          1HH1      ARG  17   6.606   9.125   4.720
  127   HH12  ARG  17          2HH1      ARG  17   6.996  10.482   5.729
  128   HH21  ARG  17          1HH2      ARG  17   9.033   8.684   7.927
  129   HH22  ARG  17          2HH2      ARG  17   8.370  10.240   7.536
  130    H    ILE  18           H        ILE  18   5.124   3.690   1.610
  131    HA   ILE  18           HA       ILE  18   2.971   2.244   2.650
  132    HB   ILE  18           HB       ILE  18   3.452   2.987  -0.230
  133   HG12  ILE  18          2HG1      ILE  18   1.559   4.545   1.364
  134   HG13  ILE  18          1HG1      ILE  18   3.213   4.658   1.958
  135   HG21  ILE  18          1HG2      ILE  18   1.023   2.820  -0.422
  136   HG22  ILE  18          2HG2      ILE  18   0.923   2.315   1.268
  137   HG23  ILE  18          3HG2      ILE  18   1.727   1.283   0.082
  138   HD11  ILE  18          1HD1      ILE  18   2.633   6.419   0.352
  139   HD12  ILE  18          2HD1      ILE  18   2.377   5.179  -0.879
  140   HD13  ILE  18          3HD1      ILE  18   3.980   5.407  -0.169
  141    H    LYS  19           H        LYS  19   5.229   1.286   0.020
  142    HA   LYS  19           HA       LYS  19   3.986  -1.203  -0.468
  143    HB2  LYS  19          2HB       LYS  19   6.957  -0.892  -0.713
  144    HB3  LYS  19          1HB       LYS  19   5.852  -1.813  -1.727
  145    HG2  LYS  19          2HG       LYS  19   4.883   0.389  -2.495
  146    HG3  LYS  19          1HG       LYS  19   6.264   1.159  -1.711
  147    HD2  LYS  19          2HD       LYS  19   6.812   0.885  -4.013
  148    HD3  LYS  19          1HD       LYS  19   7.753  -0.304  -3.112
  149    HE2  LYS  19          2HE       LYS  19   6.185  -2.041  -3.724
  150    HE3  LYS  19          1HE       LYS  19   5.149  -0.853  -4.508
  151    HZ1  LYS  19          1HZ       LYS  19   6.860  -0.440  -6.139
  152    HZ2  LYS  19          2HZ       LYS  19   6.513  -2.099  -6.091
  153    HZ3  LYS  19          3HZ       LYS  19   7.918  -1.512  -5.356
  154    H    THR  20           H        THR  20   6.765  -0.308   1.525
  155    HA   THR  20           HA       THR  20   7.488  -2.922   2.076
  156    HB   THR  20           HB       THR  20   9.028  -0.976   2.339
  157    HG1  THR  20          1HG       THR  20  10.182  -2.164   3.671
  158   HG21  THR  20          1HG2      THR  20   7.593   0.578   3.516
  159   HG22  THR  20          2HG2      THR  20   9.005   0.225   4.516
  160   HG23  THR  20          3HG2      THR  20   7.452  -0.532   4.879
  161    H    ALA  21           H        ALA  21   5.340  -0.720   3.812
  162    HA   ALA  21           HA       ALA  21   5.206  -2.410   6.098
  163    HB1  ALA  21          1HB       ALA  21   3.361  -0.187   5.242
  164    HB2  ALA  21          2HB       ALA  21   4.806  -0.003   6.243
  165    HB3  ALA  21          3HB       ALA  21   3.426  -0.922   6.847
  166    H    PHE  22           H        PHE  22   2.759  -1.532   3.678
  167    HA   PHE  22           HA       PHE  22   0.700  -3.194   4.329
  168    HB2  PHE  22          2HB       PHE  22   0.132  -1.896   2.611
  169    HB3  PHE  22          1HB       PHE  22   1.758  -1.845   1.969
  170    HD1  PHE  22          1HD       PHE  22  -1.281  -3.928   2.070
  171    HD2  PHE  22          2HD       PHE  22   2.255  -2.898  -0.009
  172    HE1  PHE  22          1HE       PHE  22  -2.113  -5.174   0.065
  173    HE2  PHE  22          2HE       PHE  22   1.497  -4.163  -1.965
  174    HZ   PHE  22           HZ       PHE  22  -0.690  -5.293  -1.937
  175    H    LEU  23           H        LEU  23   3.344  -4.164   2.106
  176    HA   LEU  23           HA       LEU  23   2.430  -6.792   1.724
  177    HB2  LEU  23          2HB       LEU  23   5.261  -5.761   1.621
  178    HB3  LEU  23          1HB       LEU  23   4.669  -7.234   0.874
  179    HG   LEU  23           HG       LEU  23   3.507  -4.571   0.144
  180   HD11  LEU  23          1HD1      LEU  23   5.943  -5.878  -1.066
  181   HD12  LEU  23          2HD1      LEU  23   5.923  -4.385  -0.126
  182   HD13  LEU  23          3HD1      LEU  23   5.114  -4.453  -1.694
  183   HD21  LEU  23          1HD2      LEU  23   3.706  -7.264  -1.194
  184   HD22  LEU  23          2HD2      LEU  23   3.121  -5.805  -1.992
  185   HD23  LEU  23          3HD2      LEU  23   2.251  -6.453  -0.600
  186    H    SER  24           H        SER  24   5.087  -5.627   3.833
  187    HA   SER  24           HA       SER  24   5.748  -8.201   4.795
  188    HB2  SER  24          2HB       SER  24   7.194  -7.121   6.296
  189    HB3  SER  24          1HB       SER  24   7.300  -6.305   4.746
  190    HG   SER  24           HG       SER  24   6.255  -4.582   5.539
  191    H    TYR  25           H        TYR  25   3.479  -5.822   5.831
  192    HA   TYR  25           HA       TYR  25   3.230  -6.673   8.510
  193    HB2  TYR  25          2HB       TYR  25   1.685  -4.882   6.676
  194    HB3  TYR  25          1HB       TYR  25   0.857  -5.513   8.110
  195    HD1  TYR  25          1HD       TYR  25   4.155  -3.980   7.252
  196    HD2  TYR  25          2HD       TYR  25   0.981  -4.260  10.062
  197    HE1  TYR  25          1HE       TYR  25   5.260  -2.296   8.634
  198    HE2  TYR  25          2HE       TYR  25   2.075  -2.564  11.469
  199    HH   TYR  25           HH       TYR  25   4.398  -1.700  11.836
  200    H    ALA  26           H        ALA  26   1.212  -7.288   5.635
  201    HA   ALA  26           HA       ALA  26  -0.537  -8.966   7.158
  202    HB1  ALA  26          1HB       ALA  26  -1.078  -7.659   5.071
  203    HB2  ALA  26          2HB       ALA  26  -1.714  -9.298   5.175
  204    HB3  ALA  26          3HB       ALA  26  -0.293  -8.964   4.178
  205    H    GLN  27           H        GLN  27   1.437  -9.799   4.316
  206    HA   GLN  27           HA       GLN  27   1.582 -12.504   5.434
  207    HB2  GLN  27          2HB       GLN  27   1.714 -11.943   2.490
  208    HB3  GLN  27          1HB       GLN  27   1.332 -13.450   3.320
  209    HG2  GLN  27          2HG       GLN  27  -0.785 -12.424   4.150
  210    HG3  GLN  27          1HG       GLN  27  -0.426 -11.013   3.158
  211   HE21  GLN  27          1HE2      GLN  27  -0.734 -11.090   0.977
  212   HE22  GLN  27          2HE2      GLN  27  -1.462 -12.456   0.176
  213    H    GLY  28           H        GLY  28   3.319  -9.876   4.051
  214    HA2  GLY  28          2HA       GLY  28   5.629  -9.679   3.739
  215    HA3  GLY  28          1HA       GLY  28   5.798 -11.403   4.035
  216    H    GLN  29           H        GLN  29   3.345 -11.546   2.026
  217    HA   GLN  29           HA       GLN  29   5.121 -12.076  -0.218
  218    HB2  GLN  29          2HB       GLN  29   2.202 -12.572  -0.419
  219    HB3  GLN  29          1HB       GLN  29   3.552 -13.549  -0.976
  220    HG2  GLN  29          2HG       GLN  29   4.013 -14.125   1.402
  221    HG3  GLN  29          1HG       GLN  29   2.510 -13.299   1.823
  222   HE21  GLN  29          1HE2      GLN  29   0.521 -14.165   0.984
  223   HE22  GLN  29          2HE2      GLN  29   0.410 -15.842   0.576
  224    H    ASP  30           H        ASP  30   3.357 -11.872  -2.330
  225    HA   ASP  30           HA       ASP  30   3.695  -9.182  -3.116
  226    HB2  ASP  30          2HB       ASP  30   3.705 -11.037  -4.707
  227    HB3  ASP  30          1HB       ASP  30   2.029 -11.401  -4.327
  228    H    LYS  31           H        LYS  31   1.254 -10.590  -1.194
  229    HA   LYS  31           HA       LYS  31  -0.558  -8.394  -1.831
  230    HB2  LYS  31          2HB       LYS  31  -1.407 -11.284  -1.559
  231    HB3  LYS  31          1HB       LYS  31  -2.496  -9.915  -1.729
  232    HG2  LYS  31          2HG       LYS  31  -1.070  -9.537  -3.927
  233    HG3  LYS  31          1HG       LYS  31  -0.811 -11.263  -3.756
  234    HD2  LYS  31          2HD       LYS  31  -3.463  -9.846  -3.905
  235    HD3  LYS  31          1HD       LYS  31  -2.749 -10.870  -5.158
  236    HE2  LYS  31          2HE       LYS  31  -3.832 -11.603  -2.481
  237    HE3  LYS  31          1HE       LYS  31  -4.390 -12.150  -4.054
  238    HZ1  LYS  31          1HZ       LYS  31  -3.108 -13.848  -2.849
  239    HZ2  LYS  31          2HZ       LYS  31  -1.751 -12.845  -2.880
  240    HZ3  LYS  31          3HZ       LYS  31  -2.398 -13.434  -4.326
  241    H    VAL  32           H        VAL  32  -2.515  -8.668  -0.193
  242    HA   VAL  32           HA       VAL  32  -1.366  -9.120   2.461
  243    HB   VAL  32           HB       VAL  32  -2.530  -6.624   1.346
  244   HG11  VAL  32          1HG1      VAL  32  -3.965  -6.891   3.204
  245   HG12  VAL  32          2HG1      VAL  32  -2.692  -5.788   3.720
  246   HG13  VAL  32          3HG1      VAL  32  -2.659  -7.477   4.221
  247   HG21  VAL  32          1HG2      VAL  32  -0.676  -5.671   2.610
  248   HG22  VAL  32          2HG2      VAL  32  -0.152  -6.887   1.447
  249   HG23  VAL  32          3HG2      VAL  32  -0.239  -7.283   3.162
  250    H    THR  33           H        THR  33  -2.629 -10.042   3.894
  251    HA   THR  33           HA       THR  33  -5.223 -10.938   3.172
  252    HB   THR  33           HB       THR  33  -5.326 -11.612   5.619
  253    HG1  THR  33          1HG       THR  33  -3.408 -11.401   6.807
  254   HG21  THR  33          1HG2      THR  33  -2.932 -12.505   4.019
  255   HG22  THR  33          2HG2      THR  33  -4.562 -13.174   3.918
  256   HG23  THR  33          3HG2      THR  33  -3.617 -13.367   5.395
  257    H    GLU  34           H        GLU  34  -7.114 -10.386   4.535
  258    HA   GLU  34           HA       GLU  34  -7.549  -7.733   3.819
  259    HB2  GLU  34          2HB       GLU  34  -9.235  -9.282   3.476
  260    HB3  GLU  34          1HB       GLU  34  -9.335  -9.697   5.193
  261    HG2  GLU  34          2HG       GLU  34 -10.323  -7.599   5.719
  262    HG3  GLU  34          1HG       GLU  34  -9.965  -6.957   4.117
  263    H    ALA  35           H        ALA  35  -6.543  -8.944   6.838
  264    HA   ALA  35           HA       ALA  35  -7.739  -7.131   8.620
  265    HB1  ALA  35          1HB       ALA  35  -6.577  -9.185   9.341
  266    HB2  ALA  35          2HB       ALA  35  -6.001  -7.748  10.185
  267    HB3  ALA  35          3HB       ALA  35  -5.041  -8.446   8.885
  268    H    MET  36           H        MET  36  -4.450  -7.074   7.180
  269    HA   MET  36           HA       MET  36  -3.879  -4.439   8.003
  270    HB2  MET  36          2HB       MET  36  -2.726  -6.321   5.993
  271    HB3  MET  36          1HB       MET  36  -2.240  -4.643   5.959
  272    HG2  MET  36          2HG       MET  36  -2.048  -6.425   8.364
  273    HG3  MET  36          1HG       MET  36  -0.719  -6.077   7.257
  274    HE1  MET  36          1HE       MET  36  -1.845  -2.908   6.722
  275    HE2  MET  36          2HE       MET  36  -0.171  -3.461   6.644
  276    HE3  MET  36          3HE       MET  36  -0.605  -2.110   7.691
  277    H    ILE  37           H        ILE  37  -5.694  -5.807   5.416
  278    HA   ILE  37           HA       ILE  37  -5.617  -3.565   3.668
  279    HB   ILE  37           HB       ILE  37  -7.220  -5.998   3.927
  280   HG12  ILE  37          2HG1      ILE  37  -5.625  -6.492   2.442
  281   HG13  ILE  37          1HG1      ILE  37  -6.520  -5.479   1.348
  282   HG21  ILE  37          1HG2      ILE  37  -8.056  -3.652   2.236
  283   HG22  ILE  37          2HG2      ILE  37  -8.963  -4.364   3.571
  284   HG23  ILE  37          3HG2      ILE  37  -8.696  -5.289   2.096
  285   HD11  ILE  37          1HD1      ILE  37  -4.202  -4.893   1.294
  286   HD12  ILE  37          2HD1      ILE  37  -4.228  -4.577   3.024
  287   HD13  ILE  37          3HD1      ILE  37  -5.167  -3.562   1.923
  288    H    ASP  38           H        ASP  38  -7.803  -4.625   6.240
  289    HA   ASP  38           HA       ASP  38  -9.663  -2.566   6.205
  290    HB2  ASP  38          2HB       ASP  38  -9.540  -4.827   7.414
  291    HB3  ASP  38          1HB       ASP  38  -8.668  -3.958   8.666
  292    H    GLN  39           H        GLN  39  -6.460  -2.780   7.658
  293    HA   GLN  39           HA       GLN  39  -6.518  -0.541   9.314
  294    HB2  GLN  39          2HB       GLN  39  -4.594  -1.840   9.534
  295    HB3  GLN  39          1HB       GLN  39  -4.375  -1.992   7.799
  296    HG2  GLN  39          2HG       GLN  39  -4.048   0.700   9.018
  297    HG3  GLN  39          1HG       GLN  39  -2.796  -0.507   9.292
  298   HE21  GLN  39          1HE2      GLN  39  -2.873   2.032   7.709
  299   HE22  GLN  39          2HE2      GLN  39  -2.301   1.589   6.145
  300    H    LEU  40           H        LEU  40  -5.599  -0.853   5.926
  301    HA   LEU  40           HA       LEU  40  -5.217   1.917   5.525
  302    HB2  LEU  40          2HB       LEU  40  -4.167   0.294   4.104
  303    HB3  LEU  40          1HB       LEU  40  -5.731  -0.326   3.567
  304    HG   LEU  40           HG       LEU  40  -5.893   2.320   2.888
  305   HD11  LEU  40          1HD1      LEU  40  -3.288   1.859   1.761
  306   HD12  LEU  40          2HD1      LEU  40  -3.230   1.861   3.525
  307   HD13  LEU  40          3HD1      LEU  40  -3.895   3.253   2.665
  308   HD21  LEU  40          1HD2      LEU  40  -4.812   0.029   1.248
  309   HD22  LEU  40          2HD2      LEU  40  -5.407   1.554   0.594
  310   HD23  LEU  40          3HD2      LEU  40  -6.510   0.470   1.446
  311    H    ILE  41           H        ILE  41  -7.880  -0.261   4.567
  312    HA   ILE  41           HA       ILE  41  -9.382   1.701   3.264
  313    HB   ILE  41           HB       ILE  41 -10.212  -0.894   4.541
  314   HG12  ILE  41          2HG1      ILE  41  -8.675  -0.796   2.509
  315   HG13  ILE  41          1HG1      ILE  41 -10.122  -1.777   2.338
  316   HG21  ILE  41          1HG2      ILE  41 -12.159   0.558   4.534
  317   HG22  ILE  41          2HG2      ILE  41 -12.328  -0.704   3.314
  318   HG23  ILE  41          3HG2      ILE  41 -11.891   0.935   2.832
  319   HD11  ILE  41          1HD1      ILE  41  -9.681   0.993   1.255
  320   HD12  ILE  41          2HD1      ILE  41 -11.183   0.080   1.119
  321   HD13  ILE  41          3HD1      ILE  41  -9.718  -0.510   0.335
  322    H    CYS  42           H        CYS  42  -9.477   0.711   6.681
  323    HA   CYS  42           HA       CYS  42 -11.746   2.356   7.289
  324    HB2  CYS  42          2HB       CYS  42 -11.154   0.352   8.623
  325    HB3  CYS  42          1HB       CYS  42  -9.684   1.157   9.155
  326    HG   CYS  42           HG       CYS  42 -11.868   1.027  11.101
  327    H    GLY  43           H        GLY  43  -8.365   2.820   6.971
  328    HA2  GLY  43          2HA       GLY  43  -7.837   5.065   8.485
  329    HA3  GLY  43          1HA       GLY  43  -7.129   4.742   6.911
  330    H    ALA  44           H        ALA  44  -9.216   5.060   5.169
  331    HA   ALA  44           HA       ALA  44  -9.722   7.934   5.476
  332    HB1  ALA  44          1HB       ALA  44  -8.650   7.024   3.378
  333    HB2  ALA  44          2HB       ALA  44 -10.059   8.063   3.142
  334    HB3  ALA  44          3HB       ALA  44 -10.220   6.315   2.992
  335    H    PHE  45           H        PHE  45 -11.506   4.981   4.541
  336    HA   PHE  45           HA       PHE  45 -13.947   6.353   5.422
  337    HB2  PHE  45          2HB       PHE  45 -14.895   4.476   3.729
  338    HB3  PHE  45          1HB       PHE  45 -14.706   6.197   3.382
  339    HD1  PHE  45          1HD       PHE  45 -12.533   3.180   3.462
  340    HD2  PHE  45          2HD       PHE  45 -13.742   6.635   1.307
  341    HE1  PHE  45          1HE       PHE  45 -10.990   2.575   1.644
  342    HE2  PHE  45          2HE       PHE  45 -12.189   6.050  -0.509
  343    HZ   PHE  45           HZ       PHE  45 -10.801   4.016  -0.337
  344    HA   PRO  46           HA       PRO  46 -14.291   2.631   7.782
  345    HB2  PRO  46          2HB       PRO  46 -15.088   3.808  10.031
  346    HB3  PRO  46          1HB       PRO  46 -13.405   3.864   9.512
  347    HG2  PRO  46          2HG       PRO  46 -15.496   5.981   9.376
  348    HG3  PRO  46          1HG       PRO  46 -13.753   6.145   9.647
  349    HD2  PRO  46          2HD       PRO  46 -15.121   6.479   7.173
  350    HD3  PRO  46          1HD       PRO  46 -13.365   6.388   7.419
  351    H    GLY  47           H        GLY  47 -16.276   2.079   9.333
  352    HA2  GLY  47          2HA       GLY  47 -18.545   1.804   9.603
  353    HA3  GLY  47          1HA       GLY  47 -18.782   3.272   8.666
  354    H    LEU  48           H        LEU  48 -16.950   0.572   7.461
  355    HA   LEU  48           HA       LEU  48 -18.950   0.235   5.350
  356    HB2  LEU  48          2HB       LEU  48 -16.085  -0.690   5.544
  357    HB3  LEU  48          1HB       LEU  48 -17.141  -1.045   4.195
  358    HG   LEU  48           HG       LEU  48 -16.114   1.667   5.028
  359   HD11  LEU  48          1HD1      LEU  48 -14.477   0.342   3.861
  360   HD12  LEU  48          2HD1      LEU  48 -15.079   1.602   2.781
  361   HD13  LEU  48          3HD1      LEU  48 -15.646  -0.061   2.606
  362   HD21  LEU  48          1HD2      LEU  48 -17.288   2.517   3.041
  363   HD22  LEU  48          2HD2      LEU  48 -18.401   1.908   4.266
  364   HD23  LEU  48          3HD2      LEU  48 -18.050   0.942   2.834
  365    H    SER  49           H        SER  49 -20.341  -1.416   5.517
  366    HA   SER  49           HA       SER  49 -19.866  -3.732   7.109
  367    HB2  SER  49          2HB       SER  49 -21.778  -3.398   4.775
  368    HB3  SER  49          1HB       SER  49 -21.860  -4.639   6.028
  369    HG   SER  49           HG       SER  49 -22.054  -2.810   7.536
  370    H    TRP  50           H        TRP  50 -19.637  -5.991   6.073
  371    HA   TRP  50           HA       TRP  50 -17.205  -5.915   4.710
  372    HB2  TRP  50          2HB       TRP  50 -18.024  -7.870   6.072
  373    HB3  TRP  50          1HB       TRP  50 -19.030  -8.311   4.691
  374    HD1  TRP  50           HD       TRP  50 -15.278  -7.734   5.428
  375    HE1  TRP  50          1HE       TRP  50 -13.941  -9.283   3.866
  376    HE3  TRP  50          3HE       TRP  50 -19.164  -9.733   2.800
  377    HZ2  TRP  50          2HZ       TRP  50 -14.507 -11.118   1.809
  378    HZ3  TRP  50          3HZ       TRP  50 -18.685 -11.379   1.040
  379    HH2  TRP  50           HH       TRP  50 -16.389 -12.063   0.554
  380    H    GLU  51           H        GLU  51 -20.470  -6.356   3.468
  381    HA   GLU  51           HA       GLU  51 -19.884  -6.953   0.820
  382    HB2  GLU  51          2HB       GLU  51 -22.135  -5.342   2.011
  383    HB3  GLU  51          1HB       GLU  51 -22.066  -5.778   0.310
  384    HG2  GLU  51          2HG       GLU  51 -22.064  -7.742   2.580
  385    HG3  GLU  51          1HG       GLU  51 -23.477  -7.279   1.659
  386    H    GLN  52           H        GLN  52 -20.067  -3.798   2.405
  387    HA   GLN  52           HA       GLN  52 -19.623  -2.303   0.021
  388    HB2  GLN  52          2HB       GLN  52 -19.733  -1.688   2.935
  389    HB3  GLN  52          1HB       GLN  52 -19.003  -0.507   1.856
  390    HG2  GLN  52          2HG       GLN  52 -21.705  -1.639   1.272
  391    HG3  GLN  52          1HG       GLN  52 -21.506  -0.317   2.421
  392   HE21  GLN  52          1HE2      GLN  52 -19.376  -0.606  -0.311
  393   HE22  GLN  52          2HE2      GLN  52 -20.014   0.729  -1.200
  394    H    LEU  53           H        LEU  53 -17.544  -3.652   2.487
  395    HA   LEU  53           HA       LEU  53 -15.274  -2.114   1.643
  396    HB2  LEU  53          2HB       LEU  53 -15.466  -2.785   3.967
  397    HB3  LEU  53          1HB       LEU  53 -15.491  -4.474   3.508
  398    HG   LEU  53           HG       LEU  53 -13.104  -2.870   2.723
  399   HD11  LEU  53          1HD1      LEU  53 -13.473  -2.181   5.027
  400   HD12  LEU  53          2HD1      LEU  53 -12.083  -3.261   4.917
  401   HD13  LEU  53          3HD1      LEU  53 -13.624  -3.867   5.520
  402   HD21  LEU  53          1HD2      LEU  53 -13.429  -5.673   3.794
  403   HD22  LEU  53          2HD2      LEU  53 -11.960  -4.966   3.121
  404   HD23  LEU  53          3HD2      LEU  53 -13.362  -5.242   2.085
  405    H    GLN  54           H        GLN  54 -16.463  -5.405   1.206
  406    HA   GLN  54           HA       GLN  54 -14.162  -6.347  -0.120
  407    HB2  GLN  54          2HB       GLN  54 -15.370  -8.303  -0.603
  408    HB3  GLN  54          1HB       GLN  54 -15.899  -7.755   0.965
  409    HG2  GLN  54          2HG       GLN  54 -18.011  -7.515   0.317
  410    HG3  GLN  54          1HG       GLN  54 -17.559  -6.783  -1.223
  411   HE21  GLN  54          1HE2      GLN  54 -19.504  -8.965  -0.458
  412   HE22  GLN  54          2HE2      GLN  54 -19.095 -10.267  -1.522
  413    H    GLU  55           H        GLU  55 -17.022  -4.642  -1.232
  414    HA   GLU  55           HA       GLU  55 -16.397  -4.981  -4.002
  415    HB2  GLU  55          2HB       GLU  55 -18.108  -3.349  -4.461
  416    HB3  GLU  55          1HB       GLU  55 -18.690  -4.453  -3.229
  417    HG2  GLU  55          2HG       GLU  55 -19.330  -2.600  -2.179
  418    HG3  GLU  55          1HG       GLU  55 -17.664  -2.464  -1.703
  419    H    LYS  56           H        LYS  56 -15.515  -2.727  -1.488
  420    HA   LYS  56           HA       LYS  56 -14.442  -0.609  -2.888
  421    HB2  LYS  56          2HB       LYS  56 -14.382  -1.457  -0.261
  422    HB3  LYS  56          1HB       LYS  56 -12.684  -1.556  -0.727
  423    HG2  LYS  56          2HG       LYS  56 -13.022   0.591   0.207
  424    HG3  LYS  56          1HG       LYS  56 -12.904   0.825  -1.537
  425    HD2  LYS  56          2HD       LYS  56 -15.406   0.786  -1.622
  426    HD3  LYS  56          1HD       LYS  56 -15.406   0.781   0.142
  427    HE2  LYS  56          2HE       LYS  56 -15.720   3.033  -0.599
  428    HE3  LYS  56          1HE       LYS  56 -14.100   2.898   0.083
  429    HZ1  LYS  56          1HZ       LYS  56 -14.749   2.812  -2.815
  430    HZ2  LYS  56          2HZ       LYS  56 -13.198   2.752  -2.146
  431    HZ3  LYS  56          3HZ       LYS  56 -14.129   4.155  -1.997
  432    H    LYS  57           H        LYS  57 -12.805  -3.612  -1.958
  433    HA   LYS  57           HA       LYS  57 -10.587  -2.909  -3.744
  434    HB2  LYS  57          2HB       LYS  57 -10.033  -5.179  -2.086
  435    HB3  LYS  57          1HB       LYS  57  -9.212  -3.632  -2.149
  436    HG2  LYS  57          2HG       LYS  57  -9.878  -3.641   0.021
  437    HG3  LYS  57          1HG       LYS  57 -11.276  -2.867  -0.713
  438    HD2  LYS  57          2HD       LYS  57 -12.107  -4.516   0.760
  439    HD3  LYS  57          1HD       LYS  57 -12.326  -5.141  -0.873
  440    HE2  LYS  57          2HE       LYS  57 -10.166  -6.413  -0.546
  441    HE3  LYS  57          1HE       LYS  57 -10.233  -5.924   1.137
  442    HZ1  LYS  57          1HZ       LYS  57 -11.241  -8.184   0.439
  443    HZ2  LYS  57          2HZ       LYS  57 -12.563  -7.257  -0.056
  444    HZ3  LYS  57          3HZ       LYS  57 -12.059  -7.223   1.565
  445    H    LYS  58           H        LYS  58 -13.262  -4.350  -4.263
  446    HA   LYS  58           HA       LYS  58 -13.103  -6.980  -4.925
  447    HB2  LYS  58          2HB       LYS  58 -14.764  -6.594  -6.615
  448    HB3  LYS  58          1HB       LYS  58 -15.069  -5.485  -5.286
  449    HG2  LYS  58          2HG       LYS  58 -14.074  -3.664  -6.510
  450    HG3  LYS  58          1HG       LYS  58 -13.609  -4.756  -7.813
  451    HD2  LYS  58          2HD       LYS  58 -16.002  -5.232  -8.214
  452    HD3  LYS  58          1HD       LYS  58 -16.416  -4.047  -6.974
  453    HE2  LYS  58          2HE       LYS  58 -16.571  -3.079  -9.213
  454    HE3  LYS  58          1HE       LYS  58 -15.312  -2.294  -8.260
  455    HZ1  LYS  58          1HZ       LYS  58 -14.868  -4.387 -10.325
  456    HZ2  LYS  58          2HZ       LYS  58 -13.660  -3.642  -9.409
  457    HZ3  LYS  58          3HZ       LYS  58 -14.564  -2.732 -10.510
  458    H    GLY  59           H        GLY  59 -12.728  -8.147  -6.896
  459    HA2  GLY  59          2HA       GLY  59 -11.682  -8.641  -8.892
  460    HA3  GLY  59          1HA       GLY  59 -11.252  -6.944  -9.052
  461    H    ARG  60           H        ARG  60  -9.612  -6.270  -7.272
  462    HA   ARG  60           HA       ARG  60  -7.265  -7.821  -7.888
  463    HB2  ARG  60          2HB       ARG  60  -7.464  -5.384  -6.120
  464    HB3  ARG  60          1HB       ARG  60  -6.033  -6.001  -6.940
  465    HG2  ARG  60          2HG       ARG  60  -8.452  -4.718  -8.176
  466    HG3  ARG  60          1HG       ARG  60  -6.791  -4.121  -8.164
  467    HD2  ARG  60          2HD       ARG  60  -6.077  -5.860  -9.621
  468    HD3  ARG  60          1HD       ARG  60  -7.608  -6.710  -9.462
  469    HE   ARG  60           HE       ARG  60  -7.913  -4.066 -10.512
  470   HH11  ARG  60          1HH1      ARG  60  -7.135  -7.369 -11.362
  471   HH12  ARG  60          2HH1      ARG  60  -7.586  -7.181 -13.025
  472   HH21  ARG  60          1HH2      ARG  60  -8.509  -3.813 -12.695
  473   HH22  ARG  60          2HH2      ARG  60  -8.369  -5.155 -13.785
  474    H    ALA  61           H        ALA  61  -8.821  -6.723  -4.881
  475    HA   ALA  61           HA       ALA  61  -7.474  -8.838  -3.407
  476    HB1  ALA  61          1HB       ALA  61  -7.906  -6.605  -2.363
  477    HB2  ALA  61          2HB       ALA  61  -8.552  -7.966  -1.450
  478    HB3  ALA  61          3HB       ALA  61  -9.628  -6.974  -2.430
  479    H    ALA  62           H        ALA  62 -10.365  -8.118  -5.039
  480    HA   ALA  62           HA       ALA  62 -12.285  -9.207  -5.482
  481    HB1  ALA  62          1HB       ALA  62 -10.672 -11.641  -4.738
  482    HB2  ALA  62          2HB       ALA  62 -10.735 -10.886  -6.333
  483    HB3  ALA  62          3HB       ALA  62 -12.182 -11.635  -5.653
  484    H    ALA  63           H        ALA  63 -11.604 -11.718  -3.180
  485    HA   ALA  63           HA       ALA  63 -13.553 -10.539  -1.332
  486    HB1  ALA  63          1HB       ALA  63 -13.666 -12.744  -0.294
  487    HB2  ALA  63          2HB       ALA  63 -12.416 -13.337  -1.386
  488    HB3  ALA  63          3HB       ALA  63 -13.987 -12.856  -2.024
  489    H    ASN  64           H        ASN  64 -10.508 -12.385  -1.147
  490    HA   ASN  64           HA       ASN  64  -9.587 -10.505   0.898
  491    HB2  ASN  64          2HB       ASN  64  -9.731 -13.495   1.138
  492    HB3  ASN  64          1HB       ASN  64  -8.543 -12.573   2.047
  493   HD21  ASN  64          1HD2      ASN  64 -10.311 -10.286   2.363
  494   HD22  ASN  64          2HD2      ASN  64 -11.484 -10.737   3.552
  495    H    GLY  65           H        GLY  65  -7.744  -9.663   0.336
  496    HA2  GLY  65          2HA       GLY  65  -5.324 -10.400   0.139
  497    HA3  GLY  65          1HA       GLY  65  -5.876 -11.317  -1.248
  498    H    TYR  66           H        TYR  66  -5.830  -7.937  -0.011
  499    HA   TYR  66           HA       TYR  66  -5.825  -6.740  -2.584
  500    HB2  TYR  66          2HB       TYR  66  -5.531  -5.769   0.018
  501    HB3  TYR  66          1HB       TYR  66  -4.069  -5.306  -0.818
  502    HD1  TYR  66          1HD       TYR  66  -5.136  -3.075  -0.028
  503    HD2  TYR  66          2HD       TYR  66  -6.673  -5.385  -3.236
  504    HE1  TYR  66          1HE       TYR  66  -6.217  -1.065  -0.921
  505    HE2  TYR  66          2HE       TYR  66  -7.770  -3.391  -4.147
  506    HH   TYR  66           HH       TYR  66  -8.562  -1.213  -3.406
  507    H    ASP  67           H        ASP  67  -4.194  -6.021  -3.909
  508    HA   ASP  67           HA       ASP  67  -1.675  -7.438  -3.526
  509    HB2  ASP  67          2HB       ASP  67  -1.660  -8.023  -5.792
  510    HB3  ASP  67          1HB       ASP  67  -3.357  -8.188  -5.335
  511    H    ARG  68           H        ARG  68   0.157  -6.325  -4.586
  512    HA   ARG  68           HA       ARG  68   0.312  -3.840  -3.363
  513    HB2  ARG  68          2HB       ARG  68   2.513  -3.569  -4.420
  514    HB3  ARG  68          1HB       ARG  68   2.297  -5.148  -3.688
  515    HG2  ARG  68          2HG       ARG  68   1.918  -6.131  -5.881
  516    HG3  ARG  68          1HG       ARG  68   2.092  -4.539  -6.628
  517    HD2  ARG  68          2HD       ARG  68   4.374  -4.382  -5.804
  518    HD3  ARG  68          1HD       ARG  68   4.204  -5.937  -4.994
  519    HE   ARG  68           HE       ARG  68   3.810  -5.907  -7.877
  520   HH11  ARG  68          1HH1      ARG  68   5.927  -6.536  -5.171
  521   HH12  ARG  68          2HH1      ARG  68   6.989  -7.582  -6.064
  522   HH21  ARG  68          1HH2      ARG  68   5.224  -7.261  -9.081
  523   HH22  ARG  68          2HH2      ARG  68   6.603  -7.965  -8.303
  524    H    SER  69           H        SER  69  -0.242  -4.536  -6.794
  525    HA   SER  69           HA       SER  69   0.005  -1.854  -7.660
  526    HB2  SER  69          2HB       SER  69   0.112  -3.701  -9.247
  527    HB3  SER  69          1HB       SER  69  -1.544  -4.162  -8.862
  528    HG   SER  69           HG       SER  69  -0.801  -1.642  -9.936
  529    H    ALA  70           H        ALA  70  -2.724  -3.795  -6.556
  530    HA   ALA  70           HA       ALA  70  -4.755  -1.872  -7.010
  531    HB1  ALA  70          1HB       ALA  70  -4.785  -3.947  -4.833
  532    HB2  ALA  70          2HB       ALA  70  -5.034  -4.350  -6.535
  533    HB3  ALA  70          3HB       ALA  70  -6.153  -3.262  -5.715
  534    H    PHE  71           H        PHE  71  -2.996  -2.833  -4.113
  535    HA   PHE  71           HA       PHE  71  -4.167  -1.033  -2.338
  536    HB2  PHE  71          2HB       PHE  71  -2.862  -2.983  -1.619
  537    HB3  PHE  71          1HB       PHE  71  -1.402  -2.275  -2.295
  538    HD1  PHE  71          1HD       PHE  71  -3.756  -2.210   0.467
  539    HD2  PHE  71          2HD       PHE  71  -0.300  -0.404  -1.197
  540    HE1  PHE  71          1HE       PHE  71  -3.303  -1.140   2.619
  541    HE2  PHE  71          2HE       PHE  71   0.160   0.671   0.958
  542    HZ   PHE  71           HZ       PHE  71  -1.337   0.316   2.864
  543    H    PHE  72           H        PHE  72  -1.208  -0.750  -4.296
  544    HA   PHE  72           HA       PHE  72  -0.499   1.796  -3.301
  545    HB2  PHE  72          2HB       PHE  72   1.131   0.339  -4.388
  546    HB3  PHE  72          1HB       PHE  72   0.271   0.502  -5.917
  547    HD1  PHE  72          1HD       PHE  72   1.885   2.585  -3.289
  548    HD2  PHE  72          2HD       PHE  72   0.980   2.104  -7.417
  549    HE1  PHE  72          1HE       PHE  72   3.221   4.580  -3.807
  550    HE2  PHE  72          2HE       PHE  72   2.316   4.103  -7.947
  551    HZ   PHE  72           HZ       PHE  72   3.438   5.343  -6.141
  552    H    SER  73           H        SER  73  -2.503   0.756  -5.956
  553    HA   SER  73           HA       SER  73  -2.780   3.170  -7.329
  554    HB2  SER  73          2HB       SER  73  -3.624   1.022  -8.192
  555    HB3  SER  73          1HB       SER  73  -4.852   0.993  -6.930
  556    HG   SER  73           HG       SER  73  -4.847   3.315  -8.387
  557    H    LEU  74           H        LEU  74  -4.440   1.929  -4.486
  558    HA   LEU  74           HA       LEU  74  -6.290   4.107  -4.309
  559    HB2  LEU  74          2HB       LEU  74  -6.738   1.846  -3.407
  560    HB3  LEU  74          1HB       LEU  74  -5.459   2.078  -2.235
  561    HG   LEU  74           HG       LEU  74  -6.720   3.782  -1.099
  562   HD11  LEU  74          1HD1      LEU  74  -7.739   4.871  -3.020
  563   HD12  LEU  74          2HD1      LEU  74  -8.971   4.415  -1.844
  564   HD13  LEU  74          3HD1      LEU  74  -8.749   3.453  -3.305
  565   HD21  LEU  74          1HD2      LEU  74  -8.308   1.337  -1.815
  566   HD22  LEU  74          2HD2      LEU  74  -8.765   2.451  -0.525
  567   HD23  LEU  74          3HD2      LEU  74  -7.245   1.561  -0.427
  568    H    VAL  75           H        VAL  75  -3.304   3.229  -2.606
  569    HA   VAL  75           HA       VAL  75  -3.420   5.361  -0.739
  570    HB   VAL  75           HB       VAL  75  -0.910   3.917  -1.585
  571   HG11  VAL  75          1HG1      VAL  75  -0.055   5.279  -0.070
  572   HG12  VAL  75          2HG1      VAL  75  -0.801   4.178   1.092
  573   HG13  VAL  75          3HG1      VAL  75  -1.628   5.667   0.624
  574   HG21  VAL  75          1HG2      VAL  75  -3.151   2.991   0.166
  575   HG22  VAL  75          2HG2      VAL  75  -1.502   2.406   0.393
  576   HG23  VAL  75          3HG2      VAL  75  -2.337   2.125  -1.140
  577    H    ALA  76           H        ALA  76  -1.824   4.988  -3.875
  578    HA   ALA  76           HA       ALA  76  -0.099   7.179  -3.744
  579    HB1  ALA  76          1HB       ALA  76   0.011   7.057  -6.165
  580    HB2  ALA  76          2HB       ALA  76  -1.437   6.049  -6.195
  581    HB3  ALA  76          3HB       ALA  76   0.047   5.441  -5.459
  582    H    SER  77           H        SER  77  -3.500   7.104  -4.082
  583    HA   SER  77           HA       SER  77  -3.561   9.847  -5.101
  584    HB2  SER  77          2HB       SER  77  -4.992   8.081  -6.164
  585    HB3  SER  77          1HB       SER  77  -5.875   7.955  -4.642
  586    HG   SER  77           HG       SER  77  -6.131  10.362  -4.952
  587    H    ASP  78           H        ASP  78  -3.927   8.015  -2.213
  588    HA   ASP  78           HA       ASP  78  -5.342  10.246  -0.917
  589    HB2  ASP  78          2HB       ASP  78  -5.420   7.281  -0.421
  590    HB3  ASP  78          1HB       ASP  78  -5.995   8.446   0.774
  591    H    GLU  79           H        GLU  79  -3.898  11.481   0.082
  592    HA   GLU  79           HA       GLU  79  -1.379  10.617   1.035
  593    HB2  GLU  79          2HB       GLU  79  -1.038  12.785   1.675
  594    HB3  GLU  79          1HB       GLU  79  -2.263  12.996   0.441
  595    HG2  GLU  79          2HG       GLU  79  -3.968  13.040   2.263
  596    HG3  GLU  79          1HG       GLU  79  -2.623  13.053   3.409
  597    H    GLN  80           H        GLN  80  -4.553  10.745   2.525
  598    HA   GLN  80           HA       GLN  80  -3.898  10.543   5.225
  599    HB2  GLN  80          2HB       GLN  80  -6.001   8.775   4.015
  600    HB3  GLN  80          1HB       GLN  80  -6.005   9.559   5.579
  601    HG2  GLN  80          2HG       GLN  80  -7.039  11.354   4.789
  602    HG3  GLN  80          1HG       GLN  80  -5.969  11.462   3.391
  603   HE21  GLN  80          1HE2      GLN  80  -6.491   8.905   2.307
  604   HE22  GLN  80          2HE2      GLN  80  -8.109   8.872   1.717
  605    H    TYR  81           H        TYR  81  -3.635   8.320   2.624
  606    HA   TYR  81           HA       TYR  81  -3.466   5.961   4.268
  607    HB2  TYR  81          2HB       TYR  81  -3.695   6.511   1.328
  608    HB3  TYR  81          1HB       TYR  81  -3.184   4.924   1.893
  609    HD1  TYR  81          1HD       TYR  81  -5.542   4.913   0.306
  610    HD2  TYR  81          2HD       TYR  81  -5.206   5.849   4.436
  611    HE1  TYR  81          1HE       TYR  81  -7.866   4.143   0.676
  612    HE2  TYR  81          2HE       TYR  81  -7.503   5.128   4.783
  613    HH   TYR  81           HH       TYR  81  -9.573   4.827   3.444
  614    H    VAL  82           H        VAL  82  -1.460   7.877   2.092
  615    HA   VAL  82           HA       VAL  82   0.743   6.214   2.114
  616    HB   VAL  82           HB       VAL  82   1.873   8.032   1.204
  617   HG11  VAL  82          1HG1      VAL  82   0.321   7.032  -0.294
  618   HG12  VAL  82          2HG1      VAL  82   0.438   8.762  -0.623
  619   HG13  VAL  82          3HG1      VAL  82  -0.935   8.128   0.282
  620   HG21  VAL  82          1HG2      VAL  82  -0.116   9.850   2.356
  621   HG22  VAL  82          2HG2      VAL  82   0.853  10.302   0.955
  622   HG23  VAL  82          3HG2      VAL  82   1.653   9.896   2.473
  623    H    ARG  83           H        ARG  83   0.073   9.107   3.973
  624    HA   ARG  83           HA       ARG  83   2.206   8.799   5.786
  625    HB2  ARG  83          2HB       ARG  83  -0.317  10.159   6.610
  626    HB3  ARG  83          1HB       ARG  83   1.329  10.552   7.036
  627    HG2  ARG  83          2HG       ARG  83   1.729  11.571   4.946
  628    HG3  ARG  83          1HG       ARG  83   0.228  10.930   4.270
  629    HD2  ARG  83          2HD       ARG  83  -0.816  12.698   4.898
  630    HD3  ARG  83          1HD       ARG  83  -0.489  12.304   6.581
  631    HE   ARG  83           HE       ARG  83   1.718  13.637   5.360
  632   HH11  ARG  83          1HH1      ARG  83  -1.427  14.154   6.792
  633   HH12  ARG  83          2HH1      ARG  83  -1.072  15.769   7.312
  634   HH21  ARG  83          1HH2      ARG  83   2.203  15.767   6.046
  635   HH22  ARG  83          2HH2      ARG  83   0.995  16.687   6.885
  636    H    PHE  84           H        PHE  84  -1.015   7.454   5.650
  637    HA   PHE  84           HA       PHE  84  -1.291   6.743   8.361
  638    HB2  PHE  84          2HB       PHE  84  -2.826   6.287   6.170
  639    HB3  PHE  84          1HB       PHE  84  -2.135   4.680   6.412
  640    HD1  PHE  84          1HD       PHE  84  -2.483   3.509   8.543
  641    HD2  PHE  84          2HD       PHE  84  -4.512   7.120   7.606
  642    HE1  PHE  84          1HE       PHE  84  -4.130   3.034  10.310
  643    HE2  PHE  84          2HE       PHE  84  -6.164   6.660   9.369
  644    HZ   PHE  84           HZ       PHE  84  -5.974   4.614  10.726
  645    H    ILE  85           H        ILE  85   0.291   5.079   5.685
  646    HA   ILE  85           HA       ILE  85   1.189   2.937   7.385
  647    HB   ILE  85           HB       ILE  85   1.610   3.595   4.506
  648   HG12  ILE  85          2HG1      ILE  85   0.676   1.193   6.089
  649   HG13  ILE  85          1HG1      ILE  85  -0.304   2.249   5.079
  650   HG21  ILE  85          1HG2      ILE  85   3.200   1.643   4.400
  651   HG22  ILE  85          2HG2      ILE  85   3.337   1.771   6.153
  652   HG23  ILE  85          3HG2      ILE  85   3.840   3.115   5.131
  653   HD11  ILE  85          1HD1      ILE  85   0.792   1.410   3.091
  654   HD12  ILE  85          2HD1      ILE  85   0.128   0.080   4.041
  655   HD13  ILE  85          3HD1      ILE  85   1.860   0.400   4.075
  656    H    ALA  86           H        ALA  86   2.714   5.757   5.852
  657    HA   ALA  86           HA       ALA  86   5.287   5.552   6.777
  658    HB1  ALA  86          1HB       ALA  86   5.444   7.927   6.592
  659    HB2  ALA  86          2HB       ALA  86   3.704   8.111   6.799
  660    HB3  ALA  86          3HB       ALA  86   4.340   7.367   5.332
  661    H    GLN  87           H        GLN  87   2.434   6.562   8.539
  662    HA   GLN  87           HA       GLN  87   3.757   7.424  10.882
  663    HB2  GLN  87          2HB       GLN  87   1.515   8.182  10.329
  664    HB3  GLN  87          1HB       GLN  87   0.910   6.537  10.410
  665    HG2  GLN  87          2HG       GLN  87   1.331   6.470  12.795
  666    HG3  GLN  87          1HG       GLN  87   2.032   8.087  12.734
  667   HE21  GLN  87          1HE2      GLN  87   0.487   8.852  14.209
  668   HE22  GLN  87          2HE2      GLN  87  -1.152   9.141  13.736
  669    H    HIS  88           H        HIS  88   2.287   4.405   9.837
  670    HA   HIS  88           HA       HIS  88   2.713   3.004  12.286
  671    HB2  HIS  88          2HB       HIS  88   2.005   2.161   9.494
  672    HB3  HIS  88          1HB       HIS  88   2.454   0.951  10.686
  673    HD1  HIS  88          1HD       HIS  88   0.947   1.395  13.076
  674    HD2  HIS  88          2HD       HIS  88  -0.687   2.404   9.384
  675    HE1  HIS  88          1HE       HIS  88  -1.536   1.466  13.436
  676    HE2  HIS  88          2HE       HIS  88  -2.509   1.939  11.166
  677    H    PHE  89           H        PHE  89   4.494   3.103   9.199
  678    HA   PHE  89           HA       PHE  89   6.786   1.834  10.514
  679    HB2  PHE  89          2HB       PHE  89   5.278   0.095   9.503
  680    HB3  PHE  89          1HB       PHE  89   5.587   0.819   7.935
  681    HD1  PHE  89          1HD       PHE  89   7.441   0.194   6.684
  682    HD2  PHE  89          2HD       PHE  89   7.240  -0.848  10.800
  683    HE1  PHE  89          1HE       PHE  89   9.378  -1.295   6.397
  684    HE2  PHE  89          2HE       PHE  89   9.189  -2.321  10.528
  685    HZ   PHE  89           HZ       PHE  89  10.262  -2.548   8.323
  686    HA   PRO  90           HA       PRO  90   8.750   5.223   8.182
  687    HB2  PRO  90          2HB       PRO  90  11.044   3.679   9.293
  688    HB3  PRO  90          1HB       PRO  90  10.763   5.423   9.284
  689    HG2  PRO  90          2HG       PRO  90  10.394   4.014  11.505
  690    HG3  PRO  90          1HG       PRO  90   9.285   5.326  11.068
  691    HD2  PRO  90          2HD       PRO  90   8.892   2.377  10.894
  692    HD3  PRO  90          1HD       PRO  90   7.716   3.658  11.263
  693    H    CYS  91           H        CYS  91  10.245   5.336   6.433
  694    HA   CYS  91           HA       CYS  91   9.746   3.371   4.477
  695    HB2  CYS  91          2HB       CYS  91  11.271   4.775   3.073
  696    HB3  CYS  91          1HB       CYS  91  10.038   5.727   3.918
  697    HG   CYS  91           HG       CYS  91  13.361   5.483   4.712
  698    H    ALA  92           H        ALA  92  10.661   1.566   4.058
  699    HA   ALA  92           HA       ALA  92  13.465   1.107   4.839
  700    HB1  ALA  92          1HB       ALA  92  11.215  -0.895   5.041
  701    HB2  ALA  92          2HB       ALA  92  11.957  -0.044   6.397
  702    HB3  ALA  92          3HB       ALA  92  12.909  -1.184   5.444
  703    HA   PRO  93           HA       PRO  93  14.003  -0.223   0.656
  704    HB2  PRO  93          2HB       PRO  93  16.277  -1.541   0.835
  705    HB3  PRO  93          1HB       PRO  93  16.224   0.174   1.244
  706    HG2  PRO  93          2HG       PRO  93  16.121  -2.205   3.070
  707    HG3  PRO  93          1HG       PRO  93  17.149  -0.760   3.201
  708    HD2  PRO  93          2HD       PRO  93  14.823  -1.059   4.584
  709    HD3  PRO  93          1HD       PRO  93  15.431   0.521   4.050
  710    H    GLU  94           H        GLU  94  12.039  -1.678   1.065
  711    HA   GLU  94           HA       GLU  94  12.842  -4.446   0.578
  712    HB2  GLU  94          2HB       GLU  94  10.954  -3.458   2.655
  713    HB3  GLU  94          1HB       GLU  94  10.605  -4.992   1.870
  714    HG2  GLU  94          2HG       GLU  94  13.236  -4.364   3.179
  715    HG3  GLU  94          1HG       GLU  94  11.890  -5.140   4.012
  716    H    GLU  95           H        GLU  95  12.444  -3.218  -1.595
  717    HA   GLU  95           HA       GLU  95   9.911  -2.925  -2.663
  718    HB2  GLU  95          2HB       GLU  95  11.931  -2.286  -3.830
  719    HB3  GLU  95          1HB       GLU  95  12.488  -3.944  -3.859
  720    HG2  GLU  95          2HG       GLU  95  11.659  -3.080  -5.974
  721    HG3  GLU  95          1HG       GLU  95  10.835  -4.542  -5.441
  722    H    GLU  96           H        GLU  96  11.980  -5.819  -2.786
  723    HA   GLU  96           HA       GLU  96   9.635  -7.542  -2.780
  724    HB2  GLU  96          2HB       GLU  96  10.027  -6.956  -5.166
  725    HB3  GLU  96          1HB       GLU  96  11.662  -7.585  -5.031
  726    HG2  GLU  96          2HG       GLU  96  10.351  -9.239  -6.094
  727    HG3  GLU  96          1HG       GLU  96  10.670  -9.802  -4.453
  728    H    LYS  97           H        LYS  97  13.021  -7.838  -3.726
  729    HA   LYS  97           HA       LYS  97  13.704  -9.185  -1.277
  730    HB2  LYS  97          2HB       LYS  97  12.844 -11.043  -2.623
  731    HB3  LYS  97          1HB       LYS  97  13.941 -10.629  -3.925
  732    HG2  LYS  97          2HG       LYS  97  15.849 -11.150  -2.502
  733    HG3  LYS  97          1HG       LYS  97  14.753 -11.551  -1.180
  734    HD2  LYS  97          2HD       LYS  97  15.524 -13.566  -2.320
  735    HD3  LYS  97          1HD       LYS  97  13.785 -13.351  -2.528
  736    HE2  LYS  97          2HE       LYS  97  14.193 -12.380  -4.751
  737    HE3  LYS  97          1HE       LYS  97  15.920 -12.647  -4.541
  738    HZ1  LYS  97          1HZ       LYS  97  14.917 -14.390  -5.861
  739    HZ2  LYS  97          2HZ       LYS  97  13.836 -14.758  -4.615
  740    HZ3  LYS  97          3HZ       LYS  97  15.492 -15.021  -4.403
  741    HA   PRO  98           HA       PRO  98  17.486  -7.460  -3.513
  742    HB2  PRO  98          2HB       PRO  98  17.059  -6.694  -6.204
  743    HB3  PRO  98          1HB       PRO  98  17.953  -8.105  -5.640
  744    HG2  PRO  98          2HG       PRO  98  15.566  -8.164  -7.080
  745    HG3  PRO  98          1HG       PRO  98  16.251  -9.512  -6.155
  746    HD2  PRO  98          2HD       PRO  98  14.114  -7.567  -5.379
  747    HD3  PRO  98          1HD       PRO  98  14.238  -9.303  -5.039
  748    HA   PRO  99           HA       PRO  99  15.294  -3.541  -2.630
  749    HB2  PRO  99          2HB       PRO  99  17.962  -2.859  -1.540
  750    HB3  PRO  99          1HB       PRO  99  16.374  -2.772  -0.770
  751    HG2  PRO  99          2HG       PRO  99  18.130  -4.669  -0.098
  752    HG3  PRO  99          1HG       PRO  99  16.391  -5.011  -0.178
  753    HD2  PRO  99          2HD       PRO  99  18.549  -5.676  -2.143
  754    HD3  PRO  99          1HD       PRO  99  17.164  -6.655  -1.614
  755    H    GLU 100           H        GLU 100  15.125  -1.901  -3.991
  756    HA   GLU 100           HA       GLU 100  17.477  -1.171  -5.602
  757    HB2  GLU 100          2HB       GLU 100  15.693  -0.463  -7.338
  758    HB3  GLU 100          1HB       GLU 100  16.048  -2.172  -7.151
  759    HG2  GLU 100          2HG       GLU 100  14.082  -2.419  -5.736
  760    HG3  GLU 100          1HG       GLU 100  13.694  -0.724  -5.973
  761    H    ILE 101           H        ILE 101  14.555   0.623  -5.969
  762    HA   ILE 101           HA       ILE 101  15.568   2.688  -4.142
  763    HB   ILE 101           HB       ILE 101  13.885   4.189  -5.321
  764   HG12  ILE 101          2HG1      ILE 101  12.872   2.022  -6.460
  765   HG13  ILE 101          1HG1      ILE 101  12.842   3.571  -7.283
  766   HG21  ILE 101          1HG2      ILE 101  16.268   4.409  -5.650
  767   HG22  ILE 101          2HG2      ILE 101  15.422   4.671  -7.175
  768   HG23  ILE 101          3HG2      ILE 101  16.240   3.139  -6.875
  769   HD11  ILE 101          1HD1      ILE 101  14.732   2.907  -8.610
  770   HD12  ILE 101          2HD1      ILE 101  13.465   1.684  -8.697
  771   HD13  ILE 101          3HD1      ILE 101  14.877   1.412  -7.690
  772    H    ASP 102           H        ASP 102  13.041   0.517  -4.930
  773    HA   ASP 102           HA       ASP 102  11.404  -0.425  -3.710
  774    HB2  ASP 102          2HB       ASP 102  12.446   1.056  -1.295
  775    HB3  ASP 102          1HB       ASP 102  11.569  -0.455  -1.332
  776    H    ALA 103           H        ALA 103  11.139   2.147  -4.996
  777    HA   ALA 103           HA       ALA 103   8.642   3.013  -3.881
  778    HB1  ALA 103          1HB       ALA 103   9.449   5.418  -3.633
  779    HB2  ALA 103          2HB       ALA 103  11.085   4.748  -3.620
  780    HB3  ALA 103          3HB       ALA 103   9.933   4.282  -2.371
  781    H    LEU 104           H        LEU 104   7.405   3.614  -5.511
  782    HA   LEU 104           HA       LEU 104   6.642   4.828  -7.260
  783    HB2  LEU 104          2HB       LEU 104   9.430   5.943  -7.269
  784    HB3  LEU 104          1HB       LEU 104   8.118   6.564  -8.251
  785    HG   LEU 104           HG       LEU 104   7.778   6.417  -5.284
  786   HD11  LEU 104          1HD1      LEU 104   8.703   8.734  -5.153
  787   HD12  LEU 104          2HD1      LEU 104   9.379   8.489  -6.765
  788   HD13  LEU 104          3HD1      LEU 104   9.899   7.466  -5.423
  789   HD21  LEU 104          1HD2      LEU 104   6.827   8.378  -7.366
  790   HD22  LEU 104          2HD2      LEU 104   6.360   8.346  -5.666
  791   HD23  LEU 104          3HD2      LEU 104   5.889   7.026  -6.736
  792    H    GLU 105           H        GLU 105   8.951   2.481  -7.479
  793    HA   GLU 105           HA       GLU 105   9.548   1.015  -9.094
  794    HB2  GLU 105          2HB       GLU 105   7.239   2.360 -10.463
  795    HB3  GLU 105          1HB       GLU 105   8.219   1.182 -11.320
  796    HG2  GLU 105          2HG       GLU 105   6.293   0.082 -10.453
  797    HG3  GLU 105          1HG       GLU 105   7.696  -0.466  -9.543
  798    H    LEU 106           H        LEU 106   9.953   1.159 -11.764
  799    HA   LEU 106           HA       LEU 106  11.320   1.952 -13.397
  800    HB2  LEU 106          2HB       LEU 106  10.859   4.632 -12.083
  801    HB3  LEU 106          1HB       LEU 106  11.463   4.372 -13.708
  802    HG   LEU 106           HG       LEU 106   8.690   3.735 -12.698
  803   HD11  LEU 106          1HD1      LEU 106   9.051   6.102 -13.038
  804   HD12  LEU 106          2HD1      LEU 106   8.001   5.461 -14.302
  805   HD13  LEU 106          3HD1      LEU 106   9.696   5.796 -14.649
  806   HD21  LEU 106          1HD2      LEU 106   9.885   3.341 -15.435
  807   HD22  LEU 106          2HD2      LEU 106   8.185   3.140 -15.018
  808   HD23  LEU 106          3HD2      LEU 106   9.396   2.071 -14.316
  809    H    LYS 107           H        LYS 107  13.278   3.949 -13.372
  810    HA   LYS 107           HA       LYS 107  14.802   3.842 -10.952
  811    HB2  LYS 107          2HB       LYS 107  16.764   2.718 -11.842
  812    HB3  LYS 107          1HB       LYS 107  15.375   1.646 -11.920
  813    HG2  LYS 107          2HG       LYS 107  15.144   2.050 -14.285
  814    HG3  LYS 107          1HG       LYS 107  16.448   3.239 -14.237
  815    HD2  LYS 107          2HD       LYS 107  18.009   1.485 -13.536
  816    HD3  LYS 107          1HD       LYS 107  16.704   0.299 -13.600
  817    HE2  LYS 107          2HE       LYS 107  16.430   0.767 -15.997
  818    HE3  LYS 107          1HE       LYS 107  17.768   1.909 -15.918
  819    HZ1  LYS 107          1HZ       LYS 107  19.227   0.107 -15.274
  820    HZ2  LYS 107          2HZ       LYS 107  18.474  -0.247 -16.746
  821    HZ3  LYS 107          3HZ       LYS 107  17.943  -0.993 -15.324
  822    H    THR 108           H        THR 108  16.498   5.327 -10.934
  823    HA   THR 108           HA       THR 108  16.302   7.320 -13.056
  824    HB   THR 108           HB       THR 108  16.069   8.089 -10.714
  825    HG1  THR 108          1HG       THR 108  16.845   9.832 -11.603
  826   HG21  THR 108          1HG2      THR 108  17.558   6.525  -9.597
  827   HG22  THR 108          2HG2      THR 108  18.054   8.182  -9.258
  828   HG23  THR 108          3HG2      THR 108  18.946   7.217 -10.433
  829    H    GLN 109           H        GLN 109  17.961   7.813 -14.400
  830    HA   GLN 109           HA       GLN 109  20.440   6.264 -14.069
  831    HB2  GLN 109          2HB       GLN 109  19.037   7.015 -16.641
  832    HB3  GLN 109          1HB       GLN 109  20.599   6.215 -16.542
  833    HG2  GLN 109          2HG       GLN 109  19.575   4.292 -15.481
  834    HG3  GLN 109          1HG       GLN 109  18.008   5.099 -15.490
  835   HE21  GLN 109          1HE2      GLN 109  20.431   3.515 -17.407
  836   HE22  GLN 109          2HE2      GLN 109  19.459   3.298 -18.819
  837    H    LYS 110           H        LYS 110  22.343   7.279 -15.126
  838    HA   LYS 110           HA       LYS 110  22.165  10.173 -15.409
  839    HB2  LYS 110          2HB       LYS 110  24.110  10.464 -13.844
  840    HB3  LYS 110          1HB       LYS 110  22.603   9.999 -13.069
  841    HG2  LYS 110          2HG       LYS 110  23.398   7.662 -13.007
  842    HG3  LYS 110          1HG       LYS 110  24.934   8.199 -13.684
  843    HD2  LYS 110          2HD       LYS 110  23.754   9.186 -11.091
  844    HD3  LYS 110          1HD       LYS 110  24.987   7.931 -11.222
  845    HE2  LYS 110          2HE       LYS 110  26.501   9.526 -12.281
  846    HE3  LYS 110          1HE       LYS 110  25.266  10.779 -12.176
  847    HZ1  LYS 110          1HZ       LYS 110  26.851  10.999 -10.390
  848    HZ2  LYS 110          2HZ       LYS 110  26.563   9.411  -9.885
  849    HZ3  LYS 110          3HZ       LYS 110  25.339  10.571  -9.760
  850    H    GLY 111           H        GLY 111  23.793  11.072 -16.644
  851    HA2  GLY 111          2HA       GLY 111  25.204   9.151 -18.317
  852    HA3  GLY 111          1HA       GLY 111  25.019  10.870 -18.628
  853    H    PHE 112           H        PHE 112  26.461   8.847 -16.075
  854    HA   PHE 112           HA       PHE 112  28.991  10.262 -16.487
  855    HB2  PHE 112          2HB       PHE 112  27.736  11.325 -14.581
  856    HB3  PHE 112          1HB       PHE 112  27.809   9.780 -13.744
  857    HD1  PHE 112          1HD       PHE 112  29.748   9.112 -12.576
  858    HD2  PHE 112          2HD       PHE 112  29.845  12.550 -15.080
  859    HE1  PHE 112          1HE       PHE 112  31.943   9.716 -11.649
  860    HE2  PHE 112          2HE       PHE 112  32.043  13.162 -14.159
  861    HZ   PHE 112           HZ       PHE 112  33.096  11.744 -12.442
  Start of MODEL    4
    1    H1   GLY   1          1HT       GLY   1  -1.876  24.789 -14.829
    2    H2   GLY   1          2HT       GLY   1  -2.970  23.759 -14.060
    3    H    GLY   1           H        GLY   1  -2.189  24.290 -14.098
    4    H3   GLY   1          3HT       GLY   1  -3.417  24.556 -15.481
    5    HA2  GLY   1          1HA       GLY   1  -2.918  22.246 -15.932
    6    HA3  GLY   1          2HA       GLY   1  -1.784  23.320 -16.738
    7    H    SER   2           H        SER   2   0.130  22.337 -16.750
    8    HA   SER   2           HA       SER   2   0.968  20.837 -14.386
    9    HB2  SER   2          2HB       SER   2   2.854  20.088 -15.929
   10    HB3  SER   2          1HB       SER   2   1.233  19.559 -16.375
   11    HG   SER   2           HG       SER   2   1.165  21.227 -17.914
   12    H    ALA   3           H        ALA   3   1.986  22.014 -12.900
   13    HA   ALA   3           HA       ALA   3   3.908  24.049 -13.824
   14    HB1  ALA   3          1HB       ALA   3   3.512  25.245 -11.727
   15    HB2  ALA   3          2HB       ALA   3   2.329  24.028 -11.254
   16    HB3  ALA   3          3HB       ALA   3   2.023  25.058 -12.652
   17    H    MET   4           H        MET   4   3.379  22.573 -10.649
   18    HA   MET   4           HA       MET   4   5.681  20.915 -10.730
   19    HB2  MET   4          2HB       MET   4   7.078  22.123  -9.121
   20    HB3  MET   4          1HB       MET   4   6.851  23.072 -10.582
   21    HG2  MET   4          2HG       MET   4   5.198  24.445  -9.468
   22    HG3  MET   4          1HG       MET   4   5.330  23.458  -8.014
   23    HE1  MET   4          1HE       MET   4   8.454  22.921  -7.801
   24    HE2  MET   4          2HE       MET   4   7.430  23.391  -6.444
   25    HE3  MET   4          3HE       MET   4   8.930  24.261  -6.758
   26    H    GLY   5           H        GLY   5   6.249  20.315  -8.303
   27    HA2  GLY   5          2HA       GLY   5   5.015  20.475  -6.059
   28    HA3  GLY   5          1HA       GLY   5   3.653  19.871  -6.992
   29    H    HIS   6           H        HIS   6   3.489  17.990  -5.774
   30    HA   HIS   6           HA       HIS   6   5.596  16.018  -6.332
   31    HB2  HIS   6          2HB       HIS   6   4.091  16.316  -3.719
   32    HB3  HIS   6          1HB       HIS   6   5.213  15.016  -4.101
   33    HD1  HIS   6          1HD       HIS   6   7.759  15.647  -4.200
   34    HD2  HIS   6          2HD       HIS   6   5.243  18.680  -2.881
   35    HE1  HIS   6          1HE       HIS   6   9.265  17.371  -3.162
   36    HE2  HIS   6          2HE       HIS   6   7.698  19.079  -2.178
   37    H    MET   7           H        MET   7   4.767  13.751  -6.113
   38    HA   MET   7           HA       MET   7   2.484  13.283  -7.629
   39    HB2  MET   7          2HB       MET   7   4.350  11.658  -7.201
   40    HB3  MET   7          1HB       MET   7   3.674  11.403  -5.600
   41    HG2  MET   7          2HG       MET   7   2.978   9.618  -7.023
   42    HG3  MET   7          1HG       MET   7   1.579  10.623  -6.652
   43    HE1  MET   7          1HE       MET   7   4.250   9.639  -9.333
   44    HE2  MET   7          2HE       MET   7   4.493  11.381  -9.218
   45    HE3  MET   7          3HE       MET   7   3.819  10.682 -10.688
   46    H    VAL   8           H        VAL   8   2.833  12.370  -4.318
   47    HA   VAL   8           HA       VAL   8   0.377  13.754  -3.561
   48    HB   VAL   8           HB       VAL   8   0.860  11.067  -2.326
   49   HG11  VAL   8          1HG1      VAL   8  -1.586  11.114  -2.039
   50   HG12  VAL   8          2HG1      VAL   8  -1.634  12.672  -2.859
   51   HG13  VAL   8          3HG1      VAL   8  -0.793  12.516  -1.314
   52   HG21  VAL   8          1HG2      VAL   8  -0.639   9.970  -3.938
   53   HG22  VAL   8          2HG2      VAL   8   0.872  10.504  -4.672
   54   HG23  VAL   8          3HG2      VAL   8  -0.609  11.427  -4.933
   55    H    LYS   9           H        LYS   9   0.792  12.272  -0.943
   56    HA   LYS   9           HA       LYS   9   2.934  13.875   0.127
   57    HB2  LYS   9          2HB       LYS   9   1.134  11.769   1.381
   58    HB3  LYS   9          1HB       LYS   9   2.287  12.778   2.266
   59    HG2  LYS   9          2HG       LYS   9   0.091  13.920   0.574
   60    HG3  LYS   9          1HG       LYS   9  -0.108  13.546   2.281
   61    HD2  LYS   9          2HD       LYS   9   1.670  15.086   2.860
   62    HD3  LYS   9          1HD       LYS   9   1.993  15.390   1.152
   63    HE2  LYS   9          2HE       LYS   9  -0.621  15.978   2.522
   64    HE3  LYS   9          1HE       LYS   9   0.656  17.168   2.272
   65    HZ1  LYS   9          1HZ       LYS   9   0.440  16.830  -0.117
   66    HZ2  LYS   9          2HZ       LYS   9  -1.031  17.318   0.559
   67    HZ3  LYS   9          3HZ       LYS   9  -0.795  15.702   0.133
   68    H    ILE  10           H        ILE  10   3.804  12.208  -1.899
   69    HA   ILE  10           HA       ILE  10   5.118   9.986  -0.540
   70    HB   ILE  10           HB       ILE  10   4.205  10.086  -3.416
   71   HG12  ILE  10          2HG1      ILE  10   3.130   8.460  -1.102
   72   HG13  ILE  10          1HG1      ILE  10   2.330   9.852  -1.820
   73   HG21  ILE  10          1HG2      ILE  10   6.277   8.772  -2.981
   74   HG22  ILE  10          2HG2      ILE  10   4.928   7.816  -3.589
   75   HG23  ILE  10          3HG2      ILE  10   5.343   7.760  -1.877
   76   HD11  ILE  10          1HD1      ILE  10   2.940   7.252  -3.207
   77   HD12  ILE  10          2HD1      ILE  10   2.143   8.645  -3.937
   78   HD13  ILE  10          3HD1      ILE  10   1.364   7.775  -2.615
   79    H    SER  11           H        SER  11   7.108  10.947  -0.192
   80    HA   SER  11           HA       SER  11   8.647  11.805  -2.512
   81    HB2  SER  11          2HB       SER  11   9.473  11.310   0.368
   82    HB3  SER  11          1HB       SER  11  10.485  12.050  -0.874
   83    HG   SER  11           HG       SER  11   8.073  13.275  -0.680
   84    H    HIS  12           H        HIS  12  11.052  10.534  -2.298
   85    HA   HIS  12           HA       HIS  12  10.640   7.950  -3.306
   86    HB2  HIS  12          2HB       HIS  12  13.070   8.987  -1.831
   87    HB3  HIS  12          1HB       HIS  12  13.031   7.536  -2.823
   88    HD1  HIS  12          1HD       HIS  12  12.410   8.059  -5.470
   89    HD2  HIS  12          2HD       HIS  12  13.881  11.194  -3.174
   90    HE1  HIS  12          1HE       HIS  12  13.228   9.772  -7.115
   91    HE2  HIS  12          2HE       HIS  12  14.252  11.592  -5.703
   92    H    GLU  13           H        GLU  13  11.407   9.117  -0.101
   93    HA   GLU  13           HA       GLU  13  11.616   6.627   1.179
   94    HB2  GLU  13          2HB       GLU  13  11.537   7.893   3.239
   95    HB3  GLU  13          1HB       GLU  13  12.519   8.748   2.053
   96    HG2  GLU  13          2HG       GLU  13  10.693  10.271   1.597
   97    HG3  GLU  13          1HG       GLU  13   9.653   9.396   2.718
   98    H    ASP  14           H        ASP  14   8.840   8.660   0.406
   99    HA   ASP  14           HA       ASP  14   7.175   7.437   2.356
  100    HB2  ASP  14          2HB       ASP  14   6.578   9.223   0.037
  101    HB3  ASP  14          1HB       ASP  14   5.340   8.634   1.146
  102    H    THR  15           H        THR  15   7.557   7.039  -1.151
  103    HA   THR  15           HA       THR  15   5.513   5.133  -1.442
  104    HB   THR  15           HB       THR  15   7.634   4.417  -3.170
  105    HG1  THR  15          1HG       THR  15   7.241   7.169  -3.481
  106   HG21  THR  15          1HG2      THR  15   5.420   4.275  -3.927
  107   HG22  THR  15          2HG2      THR  15   6.133   5.596  -4.859
  108   HG23  THR  15          3HG2      THR  15   5.074   5.946  -3.488
  109    H    GLN  16           H        GLN  16   8.891   4.866  -0.445
  110    HA   GLN  16           HA       GLN  16   9.111   2.092  -0.475
  111    HB2  GLN  16          2HB       GLN  16  10.464   4.181   1.225
  112    HB3  GLN  16          1HB       GLN  16  10.874   2.474   1.323
  113    HG2  GLN  16          2HG       GLN  16  11.506   2.459  -1.013
  114    HG3  GLN  16          1HG       GLN  16  11.017   4.140  -1.178
  115   HE21  GLN  16          1HE2      GLN  16  12.317   5.745  -0.396
  116   HE22  GLN  16          2HE2      GLN  16  13.939   5.472   0.134
  117    H    ARG  17           H        ARG  17   7.944   4.232   2.160
  118    HA   ARG  17           HA       ARG  17   7.670   2.102   3.995
  119    HB2  ARG  17          2HB       ARG  17   6.177   3.598   5.302
  120    HB3  ARG  17          1HB       ARG  17   7.735   4.260   4.932
  121    HG2  ARG  17          2HG       ARG  17   6.061   5.114   2.889
  122    HG3  ARG  17          1HG       ARG  17   5.183   5.335   4.407
  123    HD2  ARG  17          2HD       ARG  17   7.906   6.392   3.676
  124    HD3  ARG  17          1HD       ARG  17   6.444   7.318   4.027
  125    HE   ARG  17           HE       ARG  17   7.094   5.762   6.272
  126   HH11  ARG  17          1HH1      ARG  17   8.253   8.516   4.465
  127   HH12  ARG  17          2HH1      ARG  17   9.026   9.259   5.827
  128   HH21  ARG  17          1HH2      ARG  17   8.036   6.786   8.106
  129   HH22  ARG  17          2HH2      ARG  17   8.900   8.273   7.900
  130    H    ILE  18           H        ILE  18   5.260   3.703   1.927
  131    HA   ILE  18           HA       ILE  18   3.022   2.368   2.867
  132    HB   ILE  18           HB       ILE  18   3.502   3.174   0.003
  133   HG12  ILE  18          2HG1      ILE  18   1.753   4.812   1.685
  134   HG13  ILE  18          1HG1      ILE  18   3.427   4.789   2.236
  135   HG21  ILE  18          1HG2      ILE  18   0.991   2.485   1.526
  136   HG22  ILE  18          2HG2      ILE  18   1.674   1.643   0.133
  137   HG23  ILE  18          3HG2      ILE  18   1.006   3.264  -0.059
  138   HD11  ILE  18          1HD1      ILE  18   2.913   6.626   0.676
  139   HD12  ILE  18          2HD1      ILE  18   2.580   5.428  -0.574
  140   HD13  ILE  18          3HD1      ILE  18   4.200   5.552   0.127
  141    H    LYS  19           H        LYS  19   5.122   1.317   0.161
  142    HA   LYS  19           HA       LYS  19   3.573  -1.018  -0.369
  143    HB2  LYS  19          2HB       LYS  19   6.508  -0.836  -0.942
  144    HB3  LYS  19          1HB       LYS  19   5.241  -1.618  -1.890
  145    HG2  LYS  19          2HG       LYS  19   4.331   0.523  -2.556
  146    HG3  LYS  19          1HG       LYS  19   5.530   1.366  -1.576
  147    HD2  LYS  19          2HD       LYS  19   6.388   1.478  -3.738
  148    HD3  LYS  19          1HD       LYS  19   7.255   0.123  -3.013
  149    HE2  LYS  19          2HE       LYS  19   5.694  -1.426  -4.051
  150    HE3  LYS  19          1HE       LYS  19   4.844  -0.078  -4.801
  151    HZ1  LYS  19          1HZ       LYS  19   6.427  -1.138  -6.316
  152    HZ2  LYS  19          2HZ       LYS  19   7.697  -0.760  -5.263
  153    HZ3  LYS  19          3HZ       LYS  19   6.830   0.479  -6.023
  154    H    THR  20           H        THR  20   6.510  -0.350   1.447
  155    HA   THR  20           HA       THR  20   7.200  -3.014   1.796
  156    HB   THR  20           HB       THR  20   8.745  -1.012   2.067
  157    HG1  THR  20          1HG       THR  20   8.662  -3.268   3.753
  158   HG21  THR  20          1HG2      THR  20   8.940   0.023   4.227
  159   HG22  THR  20          2HG2      THR  20   7.720  -1.052   4.907
  160   HG23  THR  20          3HG2      THR  20   7.251   0.163   3.721
  161    H    ALA  21           H        ALA  21   5.254  -0.825   3.727
  162    HA   ALA  21           HA       ALA  21   5.194  -2.546   5.986
  163    HB1  ALA  21          1HB       ALA  21   3.476  -1.021   6.839
  164    HB2  ALA  21          2HB       ALA  21   3.387  -0.247   5.254
  165    HB3  ALA  21          3HB       ALA  21   4.866  -0.137   6.210
  166    H    PHE  22           H        PHE  22   2.778  -1.611   3.594
  167    HA   PHE  22           HA       PHE  22   0.649  -3.154   4.194
  168    HB2  PHE  22          2HB       PHE  22   0.217  -1.897   2.414
  169    HB3  PHE  22          1HB       PHE  22   1.873  -1.934   1.856
  170    HD1  PHE  22          1HD       PHE  22  -1.302  -3.792   1.804
  171    HD2  PHE  22          2HD       PHE  22   2.453  -3.127  -0.026
  172    HE1  PHE  22          1HE       PHE  22  -2.058  -5.070  -0.169
  173    HE2  PHE  22          2HE       PHE  22   1.742  -4.425  -1.980
  174    HZ   PHE  22           HZ       PHE  22  -0.518  -5.394  -2.060
  175    H    LEU  23           H        LEU  23   3.294  -4.375   2.077
  176    HA   LEU  23           HA       LEU  23   2.277  -6.994   1.859
  177    HB2  LEU  23          2HB       LEU  23   5.155  -6.121   1.708
  178    HB3  LEU  23          1HB       LEU  23   4.459  -7.559   0.991
  179    HG   LEU  23           HG       LEU  23   3.451  -4.865   0.188
  180   HD11  LEU  23          1HD1      LEU  23   5.899  -6.227  -0.919
  181   HD12  LEU  23          2HD1      LEU  23   5.876  -4.732   0.019
  182   HD13  LEU  23          3HD1      LEU  23   5.126  -4.786  -1.578
  183   HD21  LEU  23          1HD2      LEU  23   2.184  -6.724  -0.586
  184   HD22  LEU  23          2HD2      LEU  23   3.642  -7.571  -1.115
  185   HD23  LEU  23          3HD2      LEU  23   3.119  -6.108  -1.952
  186    H    SER  24           H        SER  24   4.996  -5.788   3.805
  187    HA   SER  24           HA       SER  24   5.709  -8.244   4.922
  188    HB2  SER  24          2HB       SER  24   7.324  -6.608   4.854
  189    HB3  SER  24          1HB       SER  24   6.317  -5.413   5.669
  190    HG   SER  24           HG       SER  24   7.333  -7.804   6.830
  191    H    TYR  25           H        TYR  25   3.394  -5.878   5.862
  192    HA   TYR  25           HA       TYR  25   3.189  -6.657   8.585
  193    HB2  TYR  25          2HB       TYR  25   1.743  -4.812   6.766
  194    HB3  TYR  25          1HB       TYR  25   0.837  -5.415   8.159
  195    HD1  TYR  25          1HD       TYR  25   4.050  -3.793   7.247
  196    HD2  TYR  25          2HD       TYR  25   1.143  -4.443  10.274
  197    HE1  TYR  25          1HE       TYR  25   5.194  -2.169   8.662
  198    HE2  TYR  25          2HE       TYR  25   2.279  -2.810  11.720
  199    HH   TYR  25           HH       TYR  25   4.620  -1.863  11.946
  200    H    ALA  26           H        ALA  26   1.228  -7.350   5.683
  201    HA   ALA  26           HA       ALA  26  -0.691  -8.773   7.232
  202    HB1  ALA  26          1HB       ALA  26  -1.693  -9.376   5.166
  203    HB2  ALA  26          2HB       ALA  26  -0.204  -9.044   4.279
  204    HB3  ALA  26          3HB       ALA  26  -1.107  -7.720   5.017
  205    H    GLN  27           H        GLN  27   1.398 -10.126   4.655
  206    HA   GLN  27           HA       GLN  27   1.605 -12.505   6.369
  207    HB2  GLN  27          2HB       GLN  27   2.002 -12.814   3.447
  208    HB3  GLN  27          1HB       GLN  27   1.377 -13.966   4.620
  209    HG2  GLN  27          2HG       GLN  27  -0.501 -13.514   3.391
  210    HG3  GLN  27          1HG       GLN  27  -0.678 -12.319   4.684
  211   HE21  GLN  27          1HE2      GLN  27  -1.717 -12.237   1.953
  212   HE22  GLN  27          2HE2      GLN  27  -1.042 -10.800   1.246
  213    H    GLY  28           H        GLY  28   3.263 -10.132   4.521
  214    HA2  GLY  28          2HA       GLY  28   5.615  -9.954   4.251
  215    HA3  GLY  28          1HA       GLY  28   5.772 -11.649   4.688
  216    H    GLN  29           H        GLN  29   3.298 -11.997   2.812
  217    HA   GLN  29           HA       GLN  29   4.747 -12.698   0.456
  218    HB2  GLN  29          2HB       GLN  29   1.761 -12.535   0.867
  219    HB3  GLN  29          1HB       GLN  29   2.600 -13.427  -0.395
  220    HG2  GLN  29          2HG       GLN  29   3.592 -14.886   1.266
  221    HG3  GLN  29          1HG       GLN  29   2.805 -13.966   2.550
  222   HE21  GLN  29          1HE2      GLN  29   0.353 -13.634   0.956
  223   HE22  GLN  29          2HE2      GLN  29  -0.455 -15.161   1.017
  224    H    ASP  30           H        ASP  30   2.880 -12.044  -1.554
  225    HA   ASP  30           HA       ASP  30   3.877  -9.347  -2.091
  226    HB2  ASP  30          2HB       ASP  30   3.778 -11.727  -3.580
  227    HB3  ASP  30          1HB       ASP  30   2.637 -10.630  -4.353
  228    H    LYS  31           H        LYS  31   1.147 -10.533  -0.853
  229    HA   LYS  31           HA       LYS  31  -0.443  -8.323  -1.910
  230    HB2  LYS  31          2HB       LYS  31  -1.469 -11.159  -1.589
  231    HB3  LYS  31          1HB       LYS  31  -2.482  -9.756  -1.905
  232    HG2  LYS  31          2HG       LYS  31  -0.814  -9.515  -3.960
  233    HG3  LYS  31          1HG       LYS  31  -0.685 -11.248  -3.724
  234    HD2  LYS  31          2HD       LYS  31  -3.220  -9.680  -4.165
  235    HD3  LYS  31          1HD       LYS  31  -2.446 -10.757  -5.332
  236    HE2  LYS  31          2HE       LYS  31  -2.815 -12.592  -3.643
  237    HE3  LYS  31          1HE       LYS  31  -3.767 -11.411  -2.744
  238    HZ1  LYS  31          1HZ       LYS  31  -5.157 -12.817  -4.149
  239    HZ2  LYS  31          2HZ       LYS  31  -4.339 -12.262  -5.522
  240    HZ3  LYS  31          3HZ       LYS  31  -5.257 -11.190  -4.593
  241    H    VAL  32           H        VAL  32  -2.642  -8.516  -0.289
  242    HA   VAL  32           HA       VAL  32  -1.545  -9.000   2.388
  243    HB   VAL  32           HB       VAL  32  -2.690  -6.454   1.365
  244   HG11  VAL  32          1HG1      VAL  32  -2.730  -7.342   4.242
  245   HG12  VAL  32          2HG1      VAL  32  -4.128  -6.953   3.248
  246   HG13  VAL  32          3HG1      VAL  32  -2.984  -5.688   3.692
  247   HG21  VAL  32          1HG2      VAL  32  -0.415  -7.197   3.172
  248   HG22  VAL  32          2HG2      VAL  32  -0.851  -5.556   2.698
  249   HG23  VAL  32          3HG2      VAL  32  -0.310  -6.711   1.480
  250    H    THR  33           H        THR  33  -2.831  -9.765   3.881
  251    HA   THR  33           HA       THR  33  -5.372 -10.828   3.176
  252    HB   THR  33           HB       THR  33  -5.425 -11.558   5.580
  253    HG1  THR  33          1HG       THR  33  -3.327 -11.284   6.668
  254   HG21  THR  33          1HG2      THR  33  -3.575 -13.158   5.353
  255   HG22  THR  33          2HG2      THR  33  -2.922 -12.203   4.023
  256   HG23  THR  33          3HG2      THR  33  -4.486 -12.999   3.850
  257    H    GLU  34           H        GLU  34  -7.104 -10.545   5.086
  258    HA   GLU  34           HA       GLU  34  -8.304  -8.135   4.418
  259    HB2  GLU  34          2HB       GLU  34  -9.722  -9.833   4.984
  260    HB3  GLU  34          1HB       GLU  34  -8.876 -10.211   6.487
  261    HG2  GLU  34          2HG       GLU  34  -9.722  -7.725   7.043
  262    HG3  GLU  34          1HG       GLU  34 -10.982  -8.226   5.916
  263    H    ALA  35           H        ALA  35  -6.123  -8.684   7.088
  264    HA   ALA  35           HA       ALA  35  -7.367  -6.844   8.882
  265    HB1  ALA  35          1HB       ALA  35  -4.565  -7.921   9.057
  266    HB2  ALA  35          2HB       ALA  35  -5.993  -8.789   9.615
  267    HB3  ALA  35          3HB       ALA  35  -5.543  -7.257  10.363
  268    H    MET  36           H        MET  36  -4.286  -6.780   7.129
  269    HA   MET  36           HA       MET  36  -3.724  -4.082   7.720
  270    HB2  MET  36          2HB       MET  36  -2.673  -6.132   5.840
  271    HB3  MET  36          1HB       MET  36  -2.177  -4.465   5.635
  272    HG2  MET  36          2HG       MET  36  -1.881  -6.072   8.156
  273    HG3  MET  36          1HG       MET  36  -0.598  -5.771   6.982
  274    HE1  MET  36          1HE       MET  36  -1.609  -2.719   6.203
  275    HE2  MET  36          2HE       MET  36   0.068  -3.260   6.268
  276    HE3  MET  36          3HE       MET  36  -0.429  -1.820   7.160
  277    H    ILE  37           H        ILE  37  -5.635  -5.686   5.317
  278    HA   ILE  37           HA       ILE  37  -5.740  -3.469   3.495
  279    HB   ILE  37           HB       ILE  37  -7.125  -6.051   3.767
  280   HG12  ILE  37          2HG1      ILE  37  -5.589  -6.416   2.173
  281   HG13  ILE  37          1HG1      ILE  37  -6.543  -5.375   1.151
  282   HG21  ILE  37          1HG2      ILE  37  -8.192  -3.801   2.078
  283   HG22  ILE  37          2HG2      ILE  37  -8.985  -4.509   3.483
  284   HG23  ILE  37          3HG2      ILE  37  -8.731  -5.479   2.034
  285   HD11  ILE  37          1HD1      ILE  37  -5.237  -3.463   1.734
  286   HD12  ILE  37          2HD1      ILE  37  -4.197  -4.755   1.144
  287   HD13  ILE  37          3HD1      ILE  37  -4.295  -4.428   2.871
  288    H    ASP  38           H        ASP  38  -7.667  -4.635   6.186
  289    HA   ASP  38           HA       ASP  38  -9.713  -2.706   6.088
  290    HB2  ASP  38          2HB       ASP  38  -9.095  -4.987   7.499
  291    HB3  ASP  38          1HB       ASP  38  -8.990  -3.729   8.726
  292    H    GLN  39           H        GLN  39  -6.502  -2.783   7.511
  293    HA   GLN  39           HA       GLN  39  -6.600  -0.548   9.173
  294    HB2  GLN  39          2HB       GLN  39  -4.663  -1.988   9.176
  295    HB3  GLN  39          1HB       GLN  39  -4.363  -1.682   7.475
  296    HG2  GLN  39          2HG       GLN  39  -4.303   0.679   9.248
  297    HG3  GLN  39          1HG       GLN  39  -3.022  -0.507   9.473
  298   HE21  GLN  39          1HE2      GLN  39  -4.399   1.837   7.293
  299   HE22  GLN  39          2HE2      GLN  39  -3.069   1.874   6.183
  300    H    LEU  40           H        LEU  40  -5.747  -0.824   5.770
  301    HA   LEU  40           HA       LEU  40  -5.455   1.960   5.334
  302    HB2  LEU  40          2HB       LEU  40  -4.411   0.242   3.944
  303    HB3  LEU  40          1HB       LEU  40  -6.004  -0.266   3.377
  304    HG   LEU  40           HG       LEU  40  -6.035   2.360   2.711
  305   HD11  LEU  40          1HD1      LEU  40  -3.224   1.426   2.908
  306   HD12  LEU  40          2HD1      LEU  40  -3.916   2.993   3.340
  307   HD13  LEU  40          3HD1      LEU  40  -3.676   2.568   1.645
  308   HD21  LEU  40          1HD2      LEU  40  -4.897   0.065   1.115
  309   HD22  LEU  40          2HD2      LEU  40  -5.386   1.615   0.437
  310   HD23  LEU  40          3HD2      LEU  40  -6.587   0.564   1.185
  311    H    ILE  41           H        ILE  41  -8.090  -0.298   4.459
  312    HA   ILE  41           HA       ILE  41  -9.601   1.731   3.217
  313    HB   ILE  41           HB       ILE  41 -10.419  -0.971   4.255
  314   HG12  ILE  41          2HG1      ILE  41  -8.828  -0.768   2.310
  315   HG13  ILE  41          1HG1      ILE  41 -10.311  -1.637   1.952
  316   HG21  ILE  41          1HG2      ILE  41 -12.496  -0.686   2.971
  317   HG22  ILE  41          2HG2      ILE  41 -12.053   0.991   2.647
  318   HG23  ILE  41          3HG2      ILE  41 -12.375   0.466   4.300
  319   HD11  ILE  41          1HD1      ILE  41 -11.204   0.384   0.882
  320   HD12  ILE  41          2HD1      ILE  41  -9.707  -0.167   0.130
  321   HD13  ILE  41          3HD1      ILE  41  -9.686   1.216   1.223
  322    H    CYS  42           H        CYS  42  -9.825   0.409   6.527
  323    HA   CYS  42           HA       CYS  42 -12.088   2.055   7.170
  324    HB2  CYS  42          2HB       CYS  42 -11.657  -0.098   8.317
  325    HB3  CYS  42          1HB       CYS  42 -10.197   0.582   9.021
  326    HG   CYS  42           HG       CYS  42 -11.931   2.705  10.207
  327    H    GLY  43           H        GLY  43  -8.743   2.523   6.937
  328    HA2  GLY  43          2HA       GLY  43  -8.122   4.460   8.797
  329    HA3  GLY  43          1HA       GLY  43  -7.463   4.401   7.169
  330    H    ALA  44           H        ALA  44  -9.479   5.126   5.534
  331    HA   ALA  44           HA       ALA  44  -9.879   7.912   6.348
  332    HB1  ALA  44          1HB       ALA  44 -10.263   8.402   4.019
  333    HB2  ALA  44          2HB       ALA  44 -10.317   6.685   3.625
  334    HB3  ALA  44          3HB       ALA  44  -8.802   7.418   4.154
  335    H    PHE  45           H        PHE  45 -11.744   5.215   4.975
  336    HA   PHE  45           HA       PHE  45 -14.169   6.501   6.034
  337    HB2  PHE  45          2HB       PHE  45 -15.085   4.646   4.266
  338    HB3  PHE  45          1HB       PHE  45 -15.007   6.394   4.019
  339    HD1  PHE  45          1HD       PHE  45 -12.681   3.514   3.872
  340    HD2  PHE  45          2HD       PHE  45 -14.110   7.018   1.955
  341    HE1  PHE  45          1HE       PHE  45 -11.146   3.095   1.988
  342    HE2  PHE  45          2HE       PHE  45 -12.569   6.627   0.073
  343    HZ   PHE  45           HZ       PHE  45 -11.075   4.661   0.092
  344    HA   PRO  46           HA       PRO  46 -14.215   2.686   8.270
  345    HB2  PRO  46          2HB       PRO  46 -15.088   3.708  10.572
  346    HB3  PRO  46          1HB       PRO  46 -13.431   3.939  10.022
  347    HG2  PRO  46          2HG       PRO  46 -15.718   5.848   9.979
  348    HG3  PRO  46          1HG       PRO  46 -13.996   6.170  10.238
  349    HD2  PRO  46          2HD       PRO  46 -15.410   6.471   7.799
  350    HD3  PRO  46          1HD       PRO  46 -13.648   6.494   8.009
  351    H    GLY  47           H        GLY  47 -16.580   4.344   6.806
  352    HA2  GLY  47          2HA       GLY  47 -18.812   3.160   8.294
  353    HA3  GLY  47          1HA       GLY  47 -18.939   4.364   7.023
  354    H    LEU  48           H        LEU  48 -16.876   1.678   6.475
  355    HA   LEU  48           HA       LEU  48 -18.769   0.677   4.483
  356    HB2  LEU  48          2HB       LEU  48 -15.830   0.081   4.830
  357    HB3  LEU  48          1HB       LEU  48 -16.834  -0.472   3.502
  358    HG   LEU  48           HG       LEU  48 -16.024   2.378   4.103
  359   HD11  LEU  48          1HD1      LEU  48 -14.285   1.025   3.072
  360   HD12  LEU  48          2HD1      LEU  48 -14.896   2.239   1.947
  361   HD13  LEU  48          3HD1      LEU  48 -15.398   0.556   1.788
  362   HD21  LEU  48          1HD2      LEU  48 -17.836   1.331   1.935
  363   HD22  LEU  48          2HD2      LEU  48 -17.220   2.979   2.050
  364   HD23  LEU  48          3HD2      LEU  48 -18.311   2.356   3.287
  365    H    SER  49           H        SER  49 -19.921  -1.074   4.936
  366    HA   SER  49           HA       SER  49 -19.176  -2.872   7.066
  367    HB2  SER  49          2HB       SER  49 -21.385  -3.133   5.006
  368    HB3  SER  49          1HB       SER  49 -21.230  -4.067   6.496
  369    HG   SER  49           HG       SER  49 -21.315  -1.932   7.571
  370    H    TRP  50           H        TRP  50 -19.063  -5.327   6.540
  371    HA   TRP  50           HA       TRP  50 -16.829  -5.639   4.895
  372    HB2  TRP  50          2HB       TRP  50 -17.437  -7.202   6.754
  373    HB3  TRP  50          1HB       TRP  50 -18.677  -7.884   5.703
  374    HD1  TRP  50           HD       TRP  50 -14.831  -7.403   5.646
  375    HE1  TRP  50          1HE       TRP  50 -13.848  -9.376   4.315
  376    HE3  TRP  50          3HE       TRP  50 -19.180  -9.704   4.286
  377    HZ2  TRP  50          2HZ       TRP  50 -14.810 -11.598   2.906
  378    HZ3  TRP  50          3HZ       TRP  50 -19.060 -11.755   2.940
  379    HH2  TRP  50           HH       TRP  50 -16.907 -12.691   2.261
  380    H    GLU  51           H        GLU  51 -20.235  -6.085   4.171
  381    HA   GLU  51           HA       GLU  51 -19.949  -7.286   1.647
  382    HB2  GLU  51          2HB       GLU  51 -22.079  -5.463   2.755
  383    HB3  GLU  51          1HB       GLU  51 -22.198  -6.228   1.176
  384    HG2  GLU  51          2HG       GLU  51 -21.904  -7.700   3.778
  385    HG3  GLU  51          1HG       GLU  51 -23.419  -7.430   2.946
  386    H    GLN  52           H        GLN  52 -20.384  -3.842   2.461
  387    HA   GLN  52           HA       GLN  52 -19.984  -2.866  -0.152
  388    HB2  GLN  52          2HB       GLN  52 -21.064  -1.507   1.530
  389    HB3  GLN  52          1HB       GLN  52 -19.633  -1.547   2.545
  390    HG2  GLN  52          2HG       GLN  52 -19.789   0.591   1.491
  391    HG3  GLN  52          1HG       GLN  52 -18.415  -0.283   0.815
  392   HE21  GLN  52          1HE2      GLN  52 -18.481  -0.973  -1.302
  393   HE22  GLN  52          2HE2      GLN  52 -19.652  -0.385  -2.434
  394    H    LEU  53           H        LEU  53 -17.774  -3.700   2.420
  395    HA   LEU  53           HA       LEU  53 -15.553  -2.308   1.260
  396    HB2  LEU  53          2HB       LEU  53 -15.906  -2.741   3.714
  397    HB3  LEU  53          1HB       LEU  53 -15.499  -4.422   3.410
  398    HG   LEU  53           HG       LEU  53 -13.548  -2.327   2.570
  399   HD11  LEU  53          1HD1      LEU  53 -14.149  -1.594   4.791
  400   HD12  LEU  53          2HD1      LEU  53 -12.559  -2.357   4.832
  401   HD13  LEU  53          3HD1      LEU  53 -13.974  -3.233   5.412
  402   HD21  LEU  53          1HD2      LEU  53 -13.167  -4.706   2.080
  403   HD22  LEU  53          2HD2      LEU  53 -13.227  -5.058   3.806
  404   HD23  LEU  53          3HD2      LEU  53 -11.939  -4.040   3.156
  405    H    GLN  54           H        GLN  54 -16.722  -5.650   1.316
  406    HA   GLN  54           HA       GLN  54 -14.448  -6.797   0.131
  407    HB2  GLN  54          2HB       GLN  54 -15.697  -8.743  -0.170
  408    HB3  GLN  54          1HB       GLN  54 -16.389  -7.985   1.242
  409    HG2  GLN  54          2HG       GLN  54 -18.337  -7.391   0.141
  410    HG3  GLN  54          1HG       GLN  54 -17.595  -7.544  -1.451
  411   HE21  GLN  54          1HE2      GLN  54 -19.040  -9.250   1.215
  412   HE22  GLN  54          2HE2      GLN  54 -19.238 -10.754   0.393
  413    H    GLU  55           H        GLU  55 -17.367  -5.355  -1.273
  414    HA   GLU  55           HA       GLU  55 -16.620  -5.904  -3.970
  415    HB2  GLU  55          2HB       GLU  55 -18.438  -4.396  -4.602
  416    HB3  GLU  55          1HB       GLU  55 -18.960  -5.553  -3.391
  417    HG2  GLU  55          2HG       GLU  55 -18.679  -3.801  -1.677
  418    HG3  GLU  55          1HG       GLU  55 -18.281  -2.671  -2.935
  419    H    LYS  56           H        LYS  56 -15.992  -3.330  -1.720
  420    HA   LYS  56           HA       LYS  56 -15.003  -1.275  -3.214
  421    HB2  LYS  56          2HB       LYS  56 -14.463  -2.404  -0.597
  422    HB3  LYS  56          1HB       LYS  56 -13.002  -1.701  -1.287
  423    HG2  LYS  56          2HG       LYS  56 -15.661  -0.325  -0.821
  424    HG3  LYS  56          1HG       LYS  56 -14.182  -0.099   0.113
  425    HD2  LYS  56          2HD       LYS  56 -13.078   0.760  -1.929
  426    HD3  LYS  56          1HD       LYS  56 -14.617   0.625  -2.784
  427    HE2  LYS  56          2HE       LYS  56 -15.629   2.165  -1.146
  428    HE3  LYS  56          1HE       LYS  56 -14.058   2.338  -0.366
  429    HZ1  LYS  56          1HZ       LYS  56 -14.703   3.102  -3.161
  430    HZ2  LYS  56          2HZ       LYS  56 -13.187   3.256  -2.430
  431    HZ3  LYS  56          3HZ       LYS  56 -14.494   4.169  -1.866
  432    H    LYS  57           H        LYS  57 -13.182  -4.147  -2.205
  433    HA   LYS  57           HA       LYS  57 -11.086  -3.386  -4.110
  434    HB2  LYS  57          2HB       LYS  57 -10.466  -5.614  -2.337
  435    HB3  LYS  57          1HB       LYS  57  -9.578  -4.130  -2.636
  436    HG2  LYS  57          2HG       LYS  57 -10.084  -3.764  -0.478
  437    HG3  LYS  57          1HG       LYS  57 -11.574  -3.131  -1.184
  438    HD2  LYS  57          2HD       LYS  57 -12.589  -4.565   0.189
  439    HD3  LYS  57          1HD       LYS  57 -12.141  -5.782  -1.002
  440    HE2  LYS  57          2HE       LYS  57 -10.061  -6.233   0.317
  441    HE3  LYS  57          1HE       LYS  57 -10.643  -5.081   1.513
  442    HZ1  LYS  57          1HZ       LYS  57 -12.053  -7.564   0.705
  443    HZ2  LYS  57          2HZ       LYS  57 -12.598  -6.448   1.858
  444    HZ3  LYS  57          3HZ       LYS  57 -11.192  -7.338   2.142
  445    H    LYS  58           H        LYS  58 -13.725  -5.078  -4.442
  446    HA   LYS  58           HA       LYS  58 -13.019  -7.597  -5.421
  447    HB2  LYS  58          2HB       LYS  58 -15.246  -5.694  -5.975
  448    HB3  LYS  58          1HB       LYS  58 -15.008  -7.021  -7.102
  449    HG2  LYS  58          2HG       LYS  58 -15.311  -7.418  -4.138
  450    HG3  LYS  58          1HG       LYS  58 -16.670  -7.417  -5.263
  451    HD2  LYS  58          2HD       LYS  58 -15.741  -9.300  -6.451
  452    HD3  LYS  58          1HD       LYS  58 -14.287  -9.254  -5.453
  453    HE2  LYS  58          2HE       LYS  58 -15.765 -11.017  -4.693
  454    HE3  LYS  58          1HE       LYS  58 -15.650  -9.754  -3.471
  455    HZ1  LYS  58          1HZ       LYS  58 -17.892 -10.159  -5.377
  456    HZ2  LYS  58          2HZ       LYS  58 -17.775  -8.870  -4.291
  457    HZ3  LYS  58          3HZ       LYS  58 -17.918 -10.451  -3.713
  458    H    GLY  59           H        GLY  59 -12.549  -8.359  -7.504
  459    HA2  GLY  59          2HA       GLY  59 -11.989  -7.985  -9.817
  460    HA3  GLY  59          1HA       GLY  59 -11.513  -6.347  -9.397
  461    H    ARG  60           H        ARG  60  -9.933  -6.671  -7.263
  462    HA   ARG  60           HA       ARG  60  -7.719  -8.129  -8.507
  463    HB2  ARG  60          2HB       ARG  60  -7.659  -5.616  -8.652
  464    HB3  ARG  60          1HB       ARG  60  -7.468  -5.597  -6.903
  465    HG2  ARG  60          2HG       ARG  60  -5.363  -5.422  -8.265
  466    HG3  ARG  60          1HG       ARG  60  -5.385  -6.670  -7.014
  467    HD2  ARG  60          2HD       ARG  60  -5.844  -8.370  -8.632
  468    HD3  ARG  60          1HD       ARG  60  -6.052  -7.158  -9.911
  469    HE   ARG  60           HE       ARG  60  -3.485  -6.887  -8.766
  470   HH11  ARG  60          1HH1      ARG  60  -5.302  -9.085 -10.798
  471   HH12  ARG  60          2HH1      ARG  60  -3.893  -9.765 -11.549
  472   HH21  ARG  60          1HH2      ARG  60  -1.626  -7.785  -9.742
  473   HH22  ARG  60          2HH2      ARG  60  -1.790  -9.031 -10.937
  474    H    ALA  61           H        ALA  61  -9.045  -6.999  -5.422
  475    HA   ALA  61           HA       ALA  61  -7.331  -8.902  -4.011
  476    HB1  ALA  61          1HB       ALA  61  -9.298  -6.859  -2.993
  477    HB2  ALA  61          2HB       ALA  61  -7.542  -6.744  -2.949
  478    HB3  ALA  61          3HB       ALA  61  -8.372  -7.944  -1.962
  479    H    ALA  62           H        ALA  62 -10.243  -8.742  -5.561
  480    HA   ALA  62           HA       ALA  62 -12.098 -10.021  -5.703
  481    HB1  ALA  62          1HB       ALA  62 -10.400 -12.069  -4.283
  482    HB2  ALA  62          2HB       ALA  62 -10.453 -11.801  -6.025
  483    HB3  ALA  62          3HB       ALA  62 -11.886 -12.391  -5.178
  484    H    ALA  63           H        ALA  63 -11.595 -11.895  -2.854
  485    HA   ALA  63           HA       ALA  63 -13.594 -10.337  -1.419
  486    HB1  ALA  63          1HB       ALA  63 -12.112 -12.841  -0.613
  487    HB2  ALA  63          2HB       ALA  63 -13.742 -12.767  -1.282
  488    HB3  ALA  63          3HB       ALA  63 -13.408 -12.078   0.307
  489    H    ASN  64           H        ASN  64 -10.416 -11.672  -0.618
  490    HA   ASN  64           HA       ASN  64  -9.523  -9.049   0.246
  491    HB2  ASN  64          2HB       ASN  64  -9.796 -11.409   2.053
  492    HB3  ASN  64          1HB       ASN  64  -8.438 -10.316   2.282
  493   HD21  ASN  64          1HD2      ASN  64  -8.883  -8.103   2.689
  494   HD22  ASN  64          2HD2      ASN  64 -10.342  -7.667   3.517
  495    H    GLY  65           H        GLY  65  -7.421  -8.705  -0.119
  496    HA2  GLY  65          2HA       GLY  65  -5.204 -10.075  -0.258
  497    HA3  GLY  65          1HA       GLY  65  -6.034 -10.793  -1.632
  498    H    TYR  66           H        TYR  66  -5.675  -7.464  -0.399
  499    HA   TYR  66           HA       TYR  66  -5.491  -6.308  -2.980
  500    HB2  TYR  66          2HB       TYR  66  -5.359  -5.378  -0.270
  501    HB3  TYR  66          1HB       TYR  66  -3.969  -4.729  -1.160
  502    HD1  TYR  66          1HD       TYR  66  -5.168  -2.665  -0.323
  503    HD2  TYR  66          2HD       TYR  66  -6.740  -5.118  -3.401
  504    HE1  TYR  66          1HE       TYR  66  -6.522  -0.767  -1.101
  505    HE2  TYR  66          2HE       TYR  66  -8.104  -3.244  -4.208
  506    HH   TYR  66           HH       TYR  66  -7.610  -0.059  -3.234
  507    H    ASP  67           H        ASP  67  -3.865  -6.150  -4.326
  508    HA   ASP  67           HA       ASP  67  -1.364  -7.337  -3.469
  509    HB2  ASP  67          2HB       ASP  67  -1.128  -8.144  -5.592
  510    HB3  ASP  67          1HB       ASP  67  -2.892  -8.005  -5.528
  511    H    ARG  68           H        ARG  68   0.531  -6.327  -4.658
  512    HA   ARG  68           HA       ARG  68   0.883  -3.845  -3.495
  513    HB2  ARG  68          2HB       ARG  68   2.982  -3.722  -4.851
  514    HB3  ARG  68          1HB       ARG  68   2.781  -5.217  -3.953
  515    HG2  ARG  68          2HG       ARG  68   1.749  -6.071  -6.201
  516    HG3  ARG  68          1HG       ARG  68   2.678  -4.737  -6.887
  517    HD2  ARG  68          2HD       ARG  68   3.738  -7.020  -5.230
  518    HD3  ARG  68          1HD       ARG  68   3.997  -6.758  -6.953
  519    HE   ARG  68           HE       ARG  68   4.993  -4.509  -5.852
  520   HH11  ARG  68          1HH1      ARG  68   5.514  -7.904  -5.166
  521   HH12  ARG  68          2HH1      ARG  68   7.165  -7.668  -4.667
  522   HH21  ARG  68          1HH2      ARG  68   7.152  -4.205  -5.187
  523   HH22  ARG  68          2HH2      ARG  68   8.089  -5.572  -4.673
  524    H    SER  69           H        SER  69  -0.066  -4.610  -6.821
  525    HA   SER  69           HA       SER  69   0.194  -1.909  -7.723
  526    HB2  SER  69          2HB       SER  69   0.317  -3.868  -9.235
  527    HB3  SER  69          1HB       SER  69  -1.397  -4.172  -8.951
  528    HG   SER  69           HG       SER  69  -0.368  -1.732  -9.981
  529    H    ALA  70           H        ALA  70  -2.540  -3.907  -6.631
  530    HA   ALA  70           HA       ALA  70  -4.569  -2.012  -7.177
  531    HB1  ALA  70          1HB       ALA  70  -4.698  -4.034  -4.956
  532    HB2  ALA  70          2HB       ALA  70  -4.835  -4.494  -6.655
  533    HB3  ALA  70          3HB       ALA  70  -6.016  -3.395  -5.943
  534    H    PHE  71           H        PHE  71  -2.919  -2.878  -4.177
  535    HA   PHE  71           HA       PHE  71  -4.339  -1.012  -2.616
  536    HB2  PHE  71          2HB       PHE  71  -3.536  -2.825  -1.433
  537    HB3  PHE  71          1HB       PHE  71  -1.949  -2.772  -2.146
  538    HD1  PHE  71          1HD       PHE  71  -3.886  -2.084   0.678
  539    HD2  PHE  71          2HD       PHE  71  -0.513  -0.642  -1.472
  540    HE1  PHE  71          1HE       PHE  71  -3.110  -0.924   2.689
  541    HE2  PHE  71          2HE       PHE  71   0.264   0.524   0.544
  542    HZ   PHE  71           HZ       PHE  71  -1.034   0.394   2.622
  543    H    PHE  72           H        PHE  72  -1.195  -0.865  -4.257
  544    HA   PHE  72           HA       PHE  72  -0.410   1.608  -3.146
  545    HB2  PHE  72          2HB       PHE  72   1.216   0.201  -4.281
  546    HB3  PHE  72          1HB       PHE  72   0.350   0.391  -5.801
  547    HD1  PHE  72          1HD       PHE  72   1.868   2.519  -3.138
  548    HD2  PHE  72          2HD       PHE  72   1.153   1.935  -7.293
  549    HE1  PHE  72          1HE       PHE  72   3.182   4.533  -3.641
  550    HE2  PHE  72          2HE       PHE  72   2.467   3.952  -7.806
  551    HZ   PHE  72           HZ       PHE  72   3.484   5.253  -5.979
  552    H    SER  73           H        SER  73  -2.227   0.778  -6.010
  553    HA   SER  73           HA       SER  73  -2.348   3.275  -7.232
  554    HB2  SER  73          2HB       SER  73  -3.087   1.136  -8.270
  555    HB3  SER  73          1HB       SER  73  -4.507   1.151  -7.225
  556    HG   SER  73           HG       SER  73  -5.407   2.588  -8.469
  557    H    LEU  74           H        LEU  74  -4.317   1.887  -4.656
  558    HA   LEU  74           HA       LEU  74  -6.140   4.084  -4.560
  559    HB2  LEU  74          2HB       LEU  74  -6.607   1.755  -3.724
  560    HB3  LEU  74          1HB       LEU  74  -5.562   2.108  -2.360
  561    HG   LEU  74           HG       LEU  74  -7.874   3.911  -2.940
  562   HD11  LEU  74          1HD1      LEU  74  -9.327   2.525  -1.592
  563   HD12  LEU  74          2HD1      LEU  74  -8.044   1.330  -1.395
  564   HD13  LEU  74          3HD1      LEU  74  -8.751   1.608  -2.987
  565   HD21  LEU  74          1HD2      LEU  74  -7.813   4.277  -0.577
  566   HD22  LEU  74          2HD2      LEU  74  -6.189   4.484  -1.231
  567   HD23  LEU  74          3HD2      LEU  74  -6.611   3.006  -0.369
  568    H    VAL  75           H        VAL  75  -3.278   3.185  -2.617
  569    HA   VAL  75           HA       VAL  75  -3.528   5.310  -0.776
  570    HB   VAL  75           HB       VAL  75  -0.871   4.125  -1.590
  571   HG11  VAL  75          1HG1      VAL  75  -1.904   5.503   0.830
  572   HG12  VAL  75          2HG1      VAL  75  -0.416   5.779  -0.083
  573   HG13  VAL  75          3HG1      VAL  75  -0.572   4.355   0.953
  574   HG21  VAL  75          1HG2      VAL  75  -3.092   2.882  -0.057
  575   HG22  VAL  75          2HG2      VAL  75  -1.429   2.584   0.457
  576   HG23  VAL  75          3HG2      VAL  75  -1.944   2.146  -1.179
  577    H    ALA  76           H        ALA  76  -2.021   5.076  -3.932
  578    HA   ALA  76           HA       ALA  76  -0.634   7.547  -3.859
  579    HB1  ALA  76          1HB       ALA  76  -0.092   5.772  -5.452
  580    HB2  ALA  76          2HB       ALA  76  -0.441   7.293  -6.275
  581    HB3  ALA  76          3HB       ALA  76  -1.650   6.008  -6.245
  582    H    SER  77           H        SER  77  -3.815   7.122  -3.529
  583    HA   SER  77           HA       SER  77  -4.436   9.664  -4.872
  584    HB2  SER  77          2HB       SER  77  -6.426   7.553  -4.019
  585    HB3  SER  77          1HB       SER  77  -6.726   8.959  -5.041
  586    HG   SER  77           HG       SER  77  -5.219   6.635  -5.641
  587    H    ASP  78           H        ASP  78  -4.137   8.008  -1.868
  588    HA   ASP  78           HA       ASP  78  -5.658  10.127  -0.499
  589    HB2  ASP  78          2HB       ASP  78  -5.439   7.185   0.040
  590    HB3  ASP  78          1HB       ASP  78  -5.870   8.307   1.332
  591    H    GLU  79           H        GLU  79  -4.341  11.500   0.438
  592    HA   GLU  79           HA       GLU  79  -1.695  11.020   1.275
  593    HB2  GLU  79          2HB       GLU  79  -2.047  13.252   1.041
  594    HB3  GLU  79          1HB       GLU  79  -3.711  13.172   1.586
  595    HG2  GLU  79          2HG       GLU  79  -1.534  12.811   3.583
  596    HG3  GLU  79          1HG       GLU  79  -1.846  14.426   2.955
  597    H    GLN  80           H        GLN  80  -4.759  10.802   2.996
  598    HA   GLN  80           HA       GLN  80  -3.779  10.558   5.597
  599    HB2  GLN  80          2HB       GLN  80  -6.131   8.939   4.658
  600    HB3  GLN  80          1HB       GLN  80  -5.886   9.716   6.212
  601    HG2  GLN  80          2HG       GLN  80  -7.456  11.083   5.279
  602    HG3  GLN  80          1HG       GLN  80  -5.972  11.910   4.808
  603   HE21  GLN  80          1HE2      GLN  80  -7.169   8.938   3.360
  604   HE22  GLN  80          2HE2      GLN  80  -7.530   9.617   1.808
  605    H    TYR  81           H        TYR  81  -4.028   8.320   2.991
  606    HA   TYR  81           HA       TYR  81  -3.463   5.982   4.553
  607    HB2  TYR  81          2HB       TYR  81  -3.923   6.467   1.621
  608    HB3  TYR  81          1HB       TYR  81  -3.479   4.888   2.268
  609    HD1  TYR  81          1HD       TYR  81  -5.896   5.000   0.809
  610    HD2  TYR  81          2HD       TYR  81  -5.266   6.046   4.865
  611    HE1  TYR  81          1HE       TYR  81  -8.224   4.406   1.308
  612    HE2  TYR  81          2HE       TYR  81  -7.597   5.517   5.366
  613    HH   TYR  81           HH       TYR  81  -9.551   3.736   3.313
  614    H    VAL  82           H        VAL  82  -1.818   8.026   2.181
  615    HA   VAL  82           HA       VAL  82   0.515   6.506   1.925
  616    HB   VAL  82           HB       VAL  82  -0.137   9.405   1.589
  617   HG11  VAL  82          1HG1      VAL  82   2.059  10.042   1.055
  618   HG12  VAL  82          2HG1      VAL  82   2.640   8.380   1.111
  619   HG13  VAL  82          3HG1      VAL  82   2.178   9.200   2.600
  620   HG21  VAL  82          1HG2      VAL  82   0.893   7.253  -0.257
  621   HG22  VAL  82          2HG2      VAL  82   0.556   8.919  -0.732
  622   HG23  VAL  82          3HG2      VAL  82  -0.756   7.875  -0.177
  623    H    ARG  83           H        ARG  83  -0.248   9.161   4.138
  624    HA   ARG  83           HA       ARG  83   2.129   8.783   5.659
  625    HB2  ARG  83          2HB       ARG  83  -0.303  10.179   6.679
  626    HB3  ARG  83          1HB       ARG  83   1.356  10.424   7.153
  627    HG2  ARG  83          2HG       ARG  83   1.861  11.439   4.996
  628    HG3  ARG  83          1HG       ARG  83   0.190  11.185   4.481
  629    HD2  ARG  83          2HD       ARG  83  -0.609  12.820   5.696
  630    HD3  ARG  83          1HD       ARG  83   0.533  12.601   7.020
  631    HE   ARG  83           HE       ARG  83   1.931  13.610   4.817
  632   HH11  ARG  83          1HH1      ARG  83  -0.593  14.634   7.015
  633   HH12  ARG  83          2HH1      ARG  83  -0.139  16.308   6.959
  634   HH21  ARG  83          1HH2      ARG  83   2.527  15.826   4.733
  635   HH22  ARG  83          2HH2      ARG  83   1.634  16.983   5.671
  636    H    PHE  84           H        PHE  84  -1.080   7.413   5.713
  637    HA   PHE  84           HA       PHE  84  -1.238   6.714   8.424
  638    HB2  PHE  84          2HB       PHE  84  -2.845   6.226   6.305
  639    HB3  PHE  84          1HB       PHE  84  -2.126   4.627   6.514
  640    HD1  PHE  84          1HD       PHE  84  -2.534   3.342   8.523
  641    HD2  PHE  84          2HD       PHE  84  -4.355   7.137   7.932
  642    HE1  PHE  84          1HE       PHE  84  -4.133   2.848  10.331
  643    HE2  PHE  84          2HE       PHE  84  -5.959   6.655   9.735
  644    HZ   PHE  84           HZ       PHE  84  -5.850   4.508  10.937
  645    H    ILE  85           H        ILE  85   0.299   5.036   5.728
  646    HA   ILE  85           HA       ILE  85   1.280   2.945   7.456
  647    HB   ILE  85           HB       ILE  85   1.700   3.552   4.558
  648   HG12  ILE  85          2HG1      ILE  85   0.777   1.154   6.157
  649   HG13  ILE  85          1HG1      ILE  85  -0.229   2.227   5.196
  650   HG21  ILE  85          1HG2      ILE  85   3.938   3.084   5.217
  651   HG22  ILE  85          2HG2      ILE  85   3.301   1.590   4.519
  652   HG23  ILE  85          3HG2      ILE  85   3.415   1.767   6.267
  653   HD11  ILE  85          1HD1      ILE  85   0.829   1.412   3.161
  654   HD12  ILE  85          2HD1      ILE  85   0.133   0.091   4.099
  655   HD13  ILE  85          3HD1      ILE  85   1.878   0.350   4.114
  656    H    ALA  86           H        ALA  86   2.736   5.717   5.795
  657    HA   ALA  86           HA       ALA  86   5.333   5.536   6.628
  658    HB1  ALA  86          1HB       ALA  86   4.365   7.244   5.109
  659    HB2  ALA  86          2HB       ALA  86   5.506   7.884   6.291
  660    HB3  ALA  86          3HB       ALA  86   3.770   8.106   6.531
  661    H    GLN  87           H        GLN  87   2.581   6.625   8.499
  662    HA   GLN  87           HA       GLN  87   4.162   7.565  10.681
  663    HB2  GLN  87          2HB       GLN  87   1.203   7.129  10.353
  664    HB3  GLN  87          1HB       GLN  87   1.928   7.729  11.840
  665    HG2  GLN  87          2HG       GLN  87   2.841   9.643  10.620
  666    HG3  GLN  87          1HG       GLN  87   2.094   9.046   9.139
  667   HE21  GLN  87          1HE2      GLN  87   1.551  10.492  12.244
  668   HE22  GLN  87          2HE2      GLN  87  -0.085  10.982  11.958
  669    H    HIS  88           H        HIS  88   2.264   4.656   9.960
  670    HA   HIS  88           HA       HIS  88   2.795   3.627  12.613
  671    HB2  HIS  88          2HB       HIS  88   1.198   1.994  12.247
  672    HB3  HIS  88          1HB       HIS  88   0.602   3.314  11.264
  673    HD1  HIS  88          1HD       HIS  88   2.818   0.258  10.626
  674    HD2  HIS  88          2HD       HIS  88  -0.359   2.355   8.925
  675    HE1  HIS  88          1HE       HIS  88   2.170  -1.025   8.565
  676    HE2  HIS  88          2HE       HIS  88   0.084   0.117   7.734
  677    H    PHE  89           H        PHE  89   4.394   3.625   9.666
  678    HA   PHE  89           HA       PHE  89   6.440   1.913  10.748
  679    HB2  PHE  89          2HB       PHE  89   4.832   0.333   9.617
  680    HB3  PHE  89          1HB       PHE  89   5.209   1.143   8.101
  681    HD1  PHE  89          1HD       PHE  89   6.912   0.293   6.786
  682    HD2  PHE  89          2HD       PHE  89   6.901  -0.539  10.959
  683    HE1  PHE  89          1HE       PHE  89   8.850  -1.199   6.495
  684    HE2  PHE  89          2HE       PHE  89   8.836  -2.026  10.674
  685    HZ   PHE  89           HZ       PHE  89   9.813  -2.358   8.440
  686    HA   PRO  90           HA       PRO  90   8.495   5.250   8.480
  687    HB2  PRO  90          2HB       PRO  90  10.852   3.962   9.703
  688    HB3  PRO  90          1HB       PRO  90  10.319   5.642   9.789
  689    HG2  PRO  90          2HG       PRO  90  10.103   3.998  11.889
  690    HG3  PRO  90          1HG       PRO  90   8.879   5.234  11.545
  691    HD2  PRO  90          2HD       PRO  90   8.790   2.288  11.039
  692    HD3  PRO  90          1HD       PRO  90   7.506   3.378  11.602
  693    H    CYS  91           H        CYS  91   9.795   5.329   6.686
  694    HA   CYS  91           HA       CYS  91   9.932   3.030   5.026
  695    HB2  CYS  91          2HB       CYS  91  11.303   4.579   3.556
  696    HB3  CYS  91          1HB       CYS  91   9.698   5.164   3.990
  697    HG   CYS  91           HG       CYS  91  12.656   6.191   5.382
  698    H    ALA  92           H        ALA  92  11.525   1.728   4.523
  699    HA   ALA  92           HA       ALA  92  13.622   1.444   6.460
  700    HB1  ALA  92          1HB       ALA  92  14.256  -0.553   5.292
  701    HB2  ALA  92          2HB       ALA  92  13.247  -0.116   3.909
  702    HB3  ALA  92          3HB       ALA  92  12.498  -0.512   5.457
  703    HA   PRO  93           HA       PRO  93  16.746   3.783   4.492
  704    HB2  PRO  93          2HB       PRO  93  18.915   2.644   5.647
  705    HB3  PRO  93          1HB       PRO  93  17.831   3.727   6.510
  706    HG2  PRO  93          2HG       PRO  93  17.963   0.744   6.557
  707    HG3  PRO  93          1HG       PRO  93  17.677   1.875   7.891
  708    HD2  PRO  93          2HD       PRO  93  15.686   0.474   6.641
  709    HD3  PRO  93          1HD       PRO  93  15.441   2.055   7.420
  710    H    GLU  94           H        GLU  94  17.600   0.367   4.728
  711    HA   GLU  94           HA       GLU  94  18.671  -1.073   3.335
  712    HB2  GLU  94          2HB       GLU  94  17.040   0.505   1.350
  713    HB3  GLU  94          1HB       GLU  94  17.860  -1.004   0.970
  714    HG2  GLU  94          2HG       GLU  94  15.727  -0.672   3.070
  715    HG3  GLU  94          1HG       GLU  94  15.464  -1.298   1.442
  716    H    GLU  95           H        GLU  95  20.519   0.474   4.069
  717    HA   GLU  95           HA       GLU  95  22.498   1.474   3.667
  718    HB2  GLU  95          2HB       GLU  95  22.054   0.484   0.852
  719    HB3  GLU  95          1HB       GLU  95  23.582   1.056   1.499
  720    HG2  GLU  95          2HG       GLU  95  22.057  -1.375   2.366
  721    HG3  GLU  95          1HG       GLU  95  23.574  -1.307   1.485
  722    H    GLU  96           H        GLU  96  23.590   3.298   2.520
  723    HA   GLU  96           HA       GLU  96  21.528   5.213   1.649
  724    HB2  GLU  96          2HB       GLU  96  22.964   6.985   2.581
  725    HB3  GLU  96          1HB       GLU  96  22.442   5.828   3.794
  726    HG2  GLU  96          2HG       GLU  96  24.619   4.734   3.690
  727    HG3  GLU  96          1HG       GLU  96  25.143   5.896   2.472
  728    H    LYS  97           H        LYS  97  22.984   3.436  -0.096
  729    HA   LYS  97           HA       LYS  97  24.110   5.494  -1.831
  730    HB2  LYS  97          2HB       LYS  97  26.034   4.357  -0.863
  731    HB3  LYS  97          1HB       LYS  97  25.399   2.799  -1.374
  732    HG2  LYS  97          2HG       LYS  97  25.706   3.345  -3.678
  733    HG3  LYS  97          1HG       LYS  97  26.112   5.014  -3.281
  734    HD2  LYS  97          2HD       LYS  97  28.127   3.800  -3.796
  735    HD3  LYS  97          1HD       LYS  97  28.116   4.201  -2.082
  736    HE2  LYS  97          2HE       LYS  97  27.373   1.934  -1.557
  737    HE3  LYS  97          1HE       LYS  97  27.366   1.534  -3.273
  738    HZ1  LYS  97          1HZ       LYS  97  29.746   1.956  -3.338
  739    HZ2  LYS  97          2HZ       LYS  97  29.379   0.756  -2.206
  740    HZ3  LYS  97          3HZ       LYS  97  29.749   2.321  -1.687
  741    HA   PRO  98           HA       PRO  98  22.600   1.964  -4.733
  742    HB2  PRO  98          2HB       PRO  98  21.149  -0.076  -3.672
  743    HB3  PRO  98          1HB       PRO  98  22.904  -0.138  -3.877
  744    HG2  PRO  98          2HG       PRO  98  21.303   0.489  -1.427
  745    HG3  PRO  98          1HG       PRO  98  22.740  -0.536  -1.593
  746    HD2  PRO  98          2HD       PRO  98  22.882   1.977  -0.650
  747    HD3  PRO  98          1HD       PRO  98  24.180   1.266  -1.624
  748    HA   PRO  99           HA       PRO  99  18.417   3.617  -4.703
  749    HB2  PRO  99          2HB       PRO  99  18.139   3.787  -7.350
  750    HB3  PRO  99          1HB       PRO  99  19.232   4.876  -6.486
  751    HG2  PRO  99          2HG       PRO  99  19.861   2.462  -8.121
  752    HG3  PRO  99          1HG       PRO  99  20.746   3.991  -7.989
  753    HD2  PRO  99          2HD       PRO  99  21.356   1.619  -6.639
  754    HD3  PRO  99          1HD       PRO  99  21.965   3.235  -6.232
  755    H    GLU 100           H        GLU 100  16.635   2.917  -6.686
  756    HA   GLU 100           HA       GLU 100  14.932   1.431  -6.930
  757    HB2  GLU 100          2HB       GLU 100  15.555  -0.603  -8.177
  758    HB3  GLU 100          1HB       GLU 100  16.226   0.863  -8.865
  759    HG2  GLU 100          2HG       GLU 100  18.381   0.305  -7.809
  760    HG3  GLU 100          1HG       GLU 100  17.654  -1.184  -7.207
  761    H    ILE 101           H        ILE 101  14.589   1.358  -4.673
  762    HA   ILE 101           HA       ILE 101  15.668  -0.943  -3.237
  763    HB   ILE 101           HB       ILE 101  14.185   1.487  -2.224
  764   HG12  ILE 101          2HG1      ILE 101  16.390   2.070  -3.011
  765   HG13  ILE 101          1HG1      ILE 101  16.423   2.060  -1.253
  766   HG21  ILE 101          1HG2      ILE 101  13.782  -0.447  -0.799
  767   HG22  ILE 101          2HG2      ILE 101  14.834   0.710   0.014
  768   HG23  ILE 101          3HG2      ILE 101  15.515  -0.755  -0.695
  769   HD11  ILE 101          1HD1      ILE 101  17.503   0.007  -3.141
  770   HD12  ILE 101          2HD1      ILE 101  17.424  -0.211  -1.390
  771   HD13  ILE 101          3HD1      ILE 101  18.408   1.080  -2.083
  772    H    ASP 102           H        ASP 102  12.533   0.743  -3.491
  773    HA   ASP 102           HA       ASP 102  11.105  -1.759  -3.540
  774    HB2  ASP 102          2HB       ASP 102  11.767  -1.292  -1.086
  775    HB3  ASP 102          1HB       ASP 102  10.593   0.006  -1.146
  776    H    ALA 103           H        ALA 103  10.825   1.664  -2.723
  777    HA   ALA 103           HA       ALA 103   8.284   2.241  -3.568
  778    HB1  ALA 103          1HB       ALA 103   9.508   3.908  -2.428
  779    HB2  ALA 103          2HB       ALA 103   9.243   4.557  -4.047
  780    HB3  ALA 103          3HB       ALA 103  10.812   3.872  -3.614
  781    H    LEU 104           H        LEU 104  10.960   3.380  -5.541
  782    HA   LEU 104           HA       LEU 104   9.780   2.275  -7.951
  783    HB2  LEU 104          2HB       LEU 104  10.101   4.691  -8.927
  784    HB3  LEU 104          1HB       LEU 104   8.629   4.238  -8.094
  785    HG   LEU 104           HG       LEU 104  10.638   5.358  -6.289
  786   HD11  LEU 104          1HD1      LEU 104  11.201   6.704  -8.234
  787   HD12  LEU 104          2HD1      LEU 104  10.318   7.673  -7.054
  788   HD13  LEU 104          3HD1      LEU 104   9.496   7.074  -8.495
  789   HD21  LEU 104          1HD2      LEU 104   8.260   4.921  -5.751
  790   HD22  LEU 104          2HD2      LEU 104   7.796   6.157  -6.919
  791   HD23  LEU 104          3HD2      LEU 104   8.730   6.600  -5.491
  792    H    GLU 105           H        GLU 105  12.154   4.803  -7.173
  793    HA   GLU 105           HA       GLU 105  14.440   3.273  -7.746
  794    HB2  GLU 105          2HB       GLU 105  13.302   3.530 -10.057
  795    HB3  GLU 105          1HB       GLU 105  13.786   5.215  -9.959
  796    HG2  GLU 105          2HG       GLU 105  16.116   4.568  -9.826
  797    HG3  GLU 105          1HG       GLU 105  15.663   2.865  -9.834
  798    H    LEU 106           H        LEU 106  16.353   4.882  -8.172
  799    HA   LEU 106           HA       LEU 106  17.649   6.551  -7.382
  800    HB2  LEU 106          2HB       LEU 106  15.024   8.027  -7.383
  801    HB3  LEU 106          1HB       LEU 106  16.519   8.780  -6.873
  802    HG   LEU 106           HG       LEU 106  16.208   9.474  -9.089
  803   HD11  LEU 106          1HD1      LEU 106  18.484   8.693  -8.612
  804   HD12  LEU 106          2HD1      LEU 106  18.055   8.528 -10.313
  805   HD13  LEU 106          3HD1      LEU 106  18.063   7.110  -9.266
  806   HD21  LEU 106          1HD2      LEU 106  15.620   6.614  -9.831
  807   HD22  LEU 106          2HD2      LEU 106  15.716   7.970 -10.954
  808   HD23  LEU 106          3HD2      LEU 106  14.450   7.928  -9.726
  809    H    LYS 107           H        LYS 107  17.936   8.095  -5.463
  810    HA   LYS 107           HA       LYS 107  16.425   7.674  -3.095
  811    HB2  LYS 107          2HB       LYS 107  17.573   5.539  -3.013
  812    HB3  LYS 107          1HB       LYS 107  19.125   6.319  -3.289
  813    HG2  LYS 107          2HG       LYS 107  18.983   7.424  -1.135
  814    HG3  LYS 107          1HG       LYS 107  17.390   6.720  -0.861
  815    HD2  LYS 107          2HD       LYS 107  19.859   5.060  -1.321
  816    HD3  LYS 107          1HD       LYS 107  19.329   5.567   0.283
  817    HE2  LYS 107          2HE       LYS 107  17.206   4.424  -0.039
  818    HE3  LYS 107          1HE       LYS 107  17.690   3.957  -1.668
  819    HZ1  LYS 107          1HZ       LYS 107  19.429   2.604  -0.775
  820    HZ2  LYS 107          2HZ       LYS 107  17.989   2.184  -0.001
  821    HZ3  LYS 107          3HZ       LYS 107  19.126   3.141   0.801
  822    H    THR 108           H        THR 108  16.606   9.506  -1.991
  823    HA   THR 108           HA       THR 108  18.726  11.359  -2.656
  824    HB   THR 108           HB       THR 108  17.456  12.874  -1.053
  825    HG1  THR 108          1HG       THR 108  15.907  11.984   0.064
  826   HG21  THR 108          1HG2      THR 108  15.605  13.253  -2.653
  827   HG22  THR 108          2HG2      THR 108  16.017  11.735  -3.449
  828   HG23  THR 108          3HG2      THR 108  17.167  13.072  -3.447
  829    H    GLN 109           H        GLN 109  20.381   9.970  -1.765
  830    HA   GLN 109           HA       GLN 109  21.950   9.455  -0.224
  831    HB2  GLN 109          2HB       GLN 109  20.445  11.383   1.525
  832    HB3  GLN 109          1HB       GLN 109  21.955  10.612   1.986
  833    HG2  GLN 109          2HG       GLN 109  23.115  11.705   0.183
  834    HG3  GLN 109          1HG       GLN 109  21.604  12.388  -0.416
  835   HE21  GLN 109          1HE2      GLN 109  20.659  14.093   0.673
  836   HE22  GLN 109          2HE2      GLN 109  21.502  15.018   1.864
  837    H    LYS 110           H        LYS 110  19.268   9.882   1.961
  838    HA   LYS 110           HA       LYS 110  18.648   7.108   2.148
  839    HB2  LYS 110          2HB       LYS 110  19.385   6.766   4.473
  840    HB3  LYS 110          1HB       LYS 110  20.743   7.057   3.397
  841    HG2  LYS 110          2HG       LYS 110  20.595   9.493   4.156
  842    HG3  LYS 110          1HG       LYS 110  19.559   8.893   5.451
  843    HD2  LYS 110          2HD       LYS 110  22.392   8.019   4.881
  844    HD3  LYS 110          1HD       LYS 110  21.873   9.069   6.198
  845    HE2  LYS 110          2HE       LYS 110  20.536   7.244   7.126
  846    HE3  LYS 110          1HE       LYS 110  21.050   6.195   5.806
  847    HZ1  LYS 110          1HZ       LYS 110  22.377   5.764   7.741
  848    HZ2  LYS 110          2HZ       LYS 110  22.792   7.392   7.888
  849    HZ3  LYS 110          3HZ       LYS 110  23.360   6.494   6.569
  850    H    GLY 111           H        GLY 111  16.745   6.757   3.296
  851    HA2  GLY 111          2HA       GLY 111  15.426   9.201   4.293
  852    HA3  GLY 111          1HA       GLY 111  14.579   7.822   3.600
  853    H    PHE 112           H        PHE 112  16.784   8.634   6.264
  854    HA   PHE 112           HA       PHE 112  15.286   6.803   7.986
  855    HB2  PHE 112          2HB       PHE 112  17.235   5.585   7.003
  856    HB3  PHE 112          1HB       PHE 112  18.303   6.774   7.737
  857    HD1  PHE 112          1HD       PHE 112  15.784   4.171   8.517
  858    HD2  PHE 112          2HD       PHE 112  19.025   6.531   9.940
  859    HE1  PHE 112          1HE       PHE 112  15.864   2.816  10.567
  860    HE2  PHE 112          2HE       PHE 112  19.108   5.181  11.991
  861    HZ   PHE 112           HZ       PHE 112  17.529   3.321  12.309
  Start of MODEL    5
    1    H1   GLY   1          1HT       GLY   1   5.396  20.754 -14.618
    2    H2   GLY   1          2HT       GLY   1   4.910  19.140 -14.727
    3    H    GLY   1           H        GLY   1   4.574  19.274 -13.819
    4    H3   GLY   1          3HT       GLY   1   4.454  20.069 -13.390
    5    HA2  GLY   1          1HA       GLY   1   3.137  21.511 -14.834
    6    HA3  GLY   1          2HA       GLY   1   3.577  20.486 -16.193
    7    H    SER   2           H        SER   2   1.225  20.258 -16.419
    8    HA   SER   2           HA       SER   2   0.061  18.425 -14.438
    9    HB2  SER   2          2HB       SER   2  -2.138  19.188 -15.475
   10    HB3  SER   2          1HB       SER   2  -1.249  20.401 -14.554
   11    HG   SER   2           HG       SER   2  -0.863  20.148 -17.338
   12    H    ALA   3           H        ALA   3   1.717  17.156 -16.116
   13    HA   ALA   3           HA       ALA   3   0.091  15.986 -18.241
   14    HB1  ALA   3          1HB       ALA   3   2.094  14.718 -18.816
   15    HB2  ALA   3          2HB       ALA   3   2.916  15.343 -17.387
   16    HB3  ALA   3          3HB       ALA   3   2.462  16.437 -18.694
   17    H    MET   4           H        MET   4   1.845  14.993 -15.351
   18    HA   MET   4           HA       MET   4  -0.370  13.370 -14.521
   19    HB2  MET   4          2HB       MET   4   0.802  11.735 -15.895
   20    HB3  MET   4          1HB       MET   4   2.315  12.089 -15.075
   21    HG2  MET   4          2HG       MET   4   1.213   9.982 -14.349
   22    HG3  MET   4          1HG       MET   4   1.537  11.122 -13.046
   23    HE1  MET   4          1HE       MET   4  -1.400  11.422 -15.687
   24    HE2  MET   4          2HE       MET   4  -2.647  10.465 -14.888
   25    HE3  MET   4          3HE       MET   4  -1.176   9.686 -15.471
   26    H    GLY   5           H        GLY   5   3.081  13.216 -13.681
   27    HA2  GLY   5          2HA       GLY   5   4.142  13.574 -11.675
   28    HA3  GLY   5          1HA       GLY   5   3.224  15.073 -11.670
   29    H    HIS   6           H        HIS   6   2.423  11.639 -11.209
   30    HA   HIS   6           HA       HIS   6   0.359  12.298  -9.343
   31    HB2  HIS   6          2HB       HIS   6   0.316  10.331 -10.925
   32    HB3  HIS   6          1HB       HIS   6   1.528   9.566  -9.903
   33    HD1  HIS   6          1HD       HIS   6  -2.091  10.421 -10.051
   34    HD2  HIS   6          2HD       HIS   6   0.582   8.646  -7.417
   35    HE1  HIS   6          1HE       HIS   6  -3.508   9.328  -8.292
   36    HE2  HIS   6          2HE       HIS   6  -1.852   8.556  -6.564
   37    H    MET   7           H        MET   7   1.530  13.450  -7.782
   38    HA   MET   7           HA       MET   7   2.857  11.759  -5.806
   39    HB2  MET   7          2HB       MET   7   4.645  12.726  -7.203
   40    HB3  MET   7          1HB       MET   7   4.024  14.337  -6.880
   41    HG2  MET   7          2HG       MET   7   4.516  14.043  -4.501
   42    HG3  MET   7          1HG       MET   7   5.162  12.438  -4.841
   43    HE1  MET   7          1HE       MET   7   7.341  11.980  -6.237
   44    HE2  MET   7          2HE       MET   7   8.319  13.240  -6.989
   45    HE3  MET   7          3HE       MET   7   6.703  12.897  -7.601
   46    H    VAL   8           H        VAL   8   2.445  12.368  -3.740
   47    HA   VAL   8           HA       VAL   8   1.109  14.903  -3.237
   48    HB   VAL   8           HB       VAL   8  -0.697  13.331  -3.689
   49   HG11  VAL   8          1HG1      VAL   8   0.321  11.229  -3.180
   50   HG12  VAL   8          2HG1      VAL   8  -1.143  11.413  -2.215
   51   HG13  VAL   8          3HG1      VAL   8   0.438  11.647  -1.472
   52   HG21  VAL   8          1HG2      VAL   8  -0.483  14.136  -0.799
   53   HG22  VAL   8          2HG2      VAL   8  -1.961  13.557  -1.564
   54   HG23  VAL   8          3HG2      VAL   8  -1.204  15.048  -2.122
   55    H    LYS   9           H        LYS   9   0.685  13.033  -0.596
   56    HA   LYS   9           HA       LYS   9   3.162  13.840   0.627
   57    HB2  LYS   9          2HB       LYS   9   0.863  12.162   1.691
   58    HB3  LYS   9          1HB       LYS   9   2.296  12.601   2.631
   59    HG2  LYS   9          2HG       LYS   9   0.291  14.493   1.444
   60    HG3  LYS   9          1HG       LYS   9   0.477  14.094   3.149
   61    HD2  LYS   9          2HD       LYS   9   2.654  15.120   3.210
   62    HD3  LYS   9          1HD       LYS   9   2.624  15.385   1.468
   63    HE2  LYS   9          2HE       LYS   9   2.131  17.450   2.606
   64    HE3  LYS   9          1HE       LYS   9   0.699  16.887   1.751
   65    HZ1  LYS   9          1HZ       LYS   9   0.102  17.662   3.920
   66    HZ2  LYS   9          2HZ       LYS   9   1.222  16.637   4.657
   67    HZ3  LYS   9          3HZ       LYS   9  -0.121  15.990   3.864
   68    H    ILE  10           H        ILE  10   3.841  12.449  -1.492
   69    HA   ILE  10           HA       ILE  10   4.849   9.947  -0.380
   70    HB   ILE  10           HB       ILE  10   4.010  10.391  -3.250
   71   HG12  ILE  10          2HG1      ILE  10   2.827   8.530  -1.182
   72   HG13  ILE  10          1HG1      ILE  10   2.113  10.069  -1.652
   73   HG21  ILE  10          1HG2      ILE  10   5.084   7.909  -1.912
   74   HG22  ILE  10          2HG2      ILE  10   5.988   8.950  -3.012
   75   HG23  ILE  10          3HG2      ILE  10   4.586   8.058  -3.596
   76   HD11  ILE  10          1HD1      ILE  10   2.558   7.694  -3.446
   77   HD12  ILE  10          2HD1      ILE  10   1.868   9.241  -3.941
   78   HD13  ILE  10          3HD1      ILE  10   1.020   8.231  -2.773
   79    H    SER  11           H        SER  11   6.867  10.774   0.118
   80    HA   SER  11           HA       SER  11   8.484  11.732  -2.115
   81    HB2  SER  11          2HB       SER  11   9.249  11.188   0.772
   82    HB3  SER  11          1HB       SER  11  10.264  11.978  -0.436
   83    HG   SER  11           HG       SER  11   8.116  13.362  -0.501
   84    H    HIS  12           H        HIS  12  10.845  10.491  -1.909
   85    HA   HIS  12           HA       HIS  12  10.540   7.942  -2.978
   86    HB2  HIS  12          2HB       HIS  12  12.850   8.901  -1.286
   87    HB3  HIS  12          1HB       HIS  12  12.901   7.588  -2.456
   88    HD1  HIS  12          1HD       HIS  12  13.484  11.156  -2.129
   89    HD2  HIS  12          2HD       HIS  12  12.532   8.540  -5.217
   90    HE1  HIS  12          1HE       HIS  12  14.031  12.385  -4.246
   91    HE2  HIS  12          2HE       HIS  12  13.277  10.855  -6.100
   92    H    GLU  13           H        GLU  13  11.140   9.000   0.293
   93    HA   GLU  13           HA       GLU  13  11.320   6.482   1.499
   94    HB2  GLU  13          2HB       GLU  13  10.945   7.741   3.607
   95    HB3  GLU  13          1HB       GLU  13  12.183   8.445   2.568
   96    HG2  GLU  13          2HG       GLU  13  10.595  10.118   1.787
   97    HG3  GLU  13          1HG       GLU  13   9.346   9.422   2.817
   98    H    ASP  14           H        ASP  14   8.520   8.572   0.829
   99    HA   ASP  14           HA       ASP  14   6.800   7.142   2.582
  100    HB2  ASP  14          2HB       ASP  14   6.191   9.031   0.328
  101    HB3  ASP  14          1HB       ASP  14   4.974   8.366   1.419
  102    H    THR  15           H        THR  15   7.336   7.020  -0.939
  103    HA   THR  15           HA       THR  15   5.349   5.092  -1.443
  104    HB   THR  15           HB       THR  15   7.528   4.637  -3.202
  105    HG1  THR  15          1HG       THR  15   6.984   7.344  -3.376
  106   HG21  THR  15          1HG2      THR  15   4.920   6.115  -3.459
  107   HG22  THR  15          2HG2      THR  15   5.251   4.437  -3.889
  108   HG23  THR  15          3HG2      THR  15   5.976   5.747  -4.820
  109    H    GLN  16           H        GLN  16   8.771   4.799  -0.567
  110    HA   GLN  16           HA       GLN  16   8.963   2.004  -0.579
  111    HB2  GLN  16          2HB       GLN  16  10.324   4.063   1.166
  112    HB3  GLN  16          1HB       GLN  16  10.744   2.357   1.178
  113    HG2  GLN  16          2HG       GLN  16  11.424   2.479  -1.139
  114    HG3  GLN  16          1HG       GLN  16  10.914   4.163  -1.216
  115   HE21  GLN  16          1HE2      GLN  16  12.132   5.734  -0.248
  116   HE22  GLN  16          2HE2      GLN  16  13.752   5.468   0.296
  117    H    ARG  17           H        ARG  17   7.842   4.291   1.839
  118    HA   ARG  17           HA       ARG  17   7.515   2.551   4.002
  119    HB2  ARG  17          2HB       ARG  17   6.347   5.182   3.211
  120    HB3  ARG  17          1HB       ARG  17   5.616   4.312   4.550
  121    HG2  ARG  17          2HG       ARG  17   7.315   4.772   5.936
  122    HG3  ARG  17          1HG       ARG  17   8.534   4.565   4.680
  123    HD2  ARG  17          2HD       ARG  17   8.214   6.742   3.858
  124    HD3  ARG  17          1HD       ARG  17   6.708   6.952   4.767
  125    HE   ARG  17           HE       ARG  17   9.122   6.550   6.338
  126   HH11  ARG  17          1HH1      ARG  17   6.899   8.891   4.946
  127   HH12  ARG  17          2HH1      ARG  17   7.326  10.129   6.084
  128   HH21  ARG  17          1HH2      ARG  17   9.661   8.196   7.820
  129   HH22  ARG  17          2HH2      ARG  17   8.877   9.738   7.710
  130    H    ILE  18           H        ILE  18   5.124   3.660   1.578
  131    HA   ILE  18           HA       ILE  18   2.948   2.348   2.723
  132    HB   ILE  18           HB       ILE  18   3.359   3.050  -0.179
  133   HG12  ILE  18          2HG1      ILE  18   1.556   4.666   1.455
  134   HG13  ILE  18          1HG1      ILE  18   3.222   4.719   2.025
  135   HG21  ILE  18          1HG2      ILE  18   0.881   3.015  -0.238
  136   HG22  ILE  18          2HG2      ILE  18   0.887   2.353   1.402
  137   HG23  ILE  18          3HG2      ILE  18   1.598   1.434   0.072
  138   HD11  ILE  18          1HD1      ILE  18   2.680   6.504   0.431
  139   HD12  ILE  18          2HD1      ILE  18   2.361   5.275  -0.796
  140   HD13  ILE  18          3HD1      ILE  18   3.981   5.446  -0.113
  141    H    LYS  19           H        LYS  19   5.043   1.232   0.036
  142    HA   LYS  19           HA       LYS  19   3.574  -1.189  -0.255
  143    HB2  LYS  19          2HB       LYS  19   6.336  -0.418  -1.189
  144    HB3  LYS  19          1HB       LYS  19   5.521  -1.910  -1.639
  145    HG2  LYS  19          2HG       LYS  19   3.843  -0.771  -2.841
  146    HG3  LYS  19          1HG       LYS  19   4.304   0.787  -2.155
  147    HD2  LYS  19          2HD       LYS  19   6.358   0.782  -3.382
  148    HD3  LYS  19          1HD       LYS  19   6.076  -0.863  -3.951
  149    HE2  LYS  19          2HE       LYS  19   4.263   1.447  -4.552
  150    HE3  LYS  19          1HE       LYS  19   5.606   0.992  -5.591
  151    HZ1  LYS  19          1HZ       LYS  19   3.566   0.017  -6.386
  152    HZ2  LYS  19          2HZ       LYS  19   3.293  -0.732  -4.896
  153    HZ3  LYS  19          3HZ       LYS  19   4.612  -1.201  -5.848
  154    H    THR  20           H        THR  20   6.584  -0.330   1.415
  155    HA   THR  20           HA       THR  20   7.351  -2.949   1.982
  156    HB   THR  20           HB       THR  20   8.820  -0.889   2.183
  157    HG1  THR  20          1HG       THR  20   9.896  -2.557   2.949
  158   HG21  THR  20          1HG2      THR  20   8.927   0.224   4.343
  159   HG22  THR  20          2HG2      THR  20   7.591  -0.756   4.941
  160   HG23  THR  20          3HG2      THR  20   7.311   0.419   3.657
  161    H    ALA  21           H        ALA  21   5.301  -0.723   3.811
  162    HA   ALA  21           HA       ALA  21   5.226  -2.416   6.090
  163    HB1  ALA  21          1HB       ALA  21   3.358  -0.193   5.268
  164    HB2  ALA  21          2HB       ALA  21   4.801  -0.021   6.274
  165    HB3  ALA  21          3HB       ALA  21   3.419  -0.945   6.864
  166    H    PHE  22           H        PHE  22   2.811  -1.584   3.660
  167    HA   PHE  22           HA       PHE  22   0.741  -3.233   4.183
  168    HB2  PHE  22          2HB       PHE  22   0.375  -1.932   2.392
  169    HB3  PHE  22          1HB       PHE  22   2.030  -2.024   1.837
  170    HD1  PHE  22          1HD       PHE  22  -1.141  -3.871   1.887
  171    HD2  PHE  22          2HD       PHE  22   2.550  -3.238  -0.057
  172    HE1  PHE  22          1HE       PHE  22  -1.959  -5.200  -0.046
  173    HE2  PHE  22          2HE       PHE  22   1.794  -4.599  -1.954
  174    HZ   PHE  22           HZ       PHE  22  -0.459  -5.582  -1.937
  175    H    LEU  23           H        LEU  23   3.553  -4.277   2.207
  176    HA   LEU  23           HA       LEU  23   2.658  -6.913   1.825
  177    HB2  LEU  23          2HB       LEU  23   5.501  -5.921   1.916
  178    HB3  LEU  23          1HB       LEU  23   4.919  -7.357   1.093
  179    HG   LEU  23           HG       LEU  23   3.891  -4.633   0.366
  180   HD11  LEU  23          1HD1      LEU  23   6.333  -6.025  -0.746
  181   HD12  LEU  23          2HD1      LEU  23   6.328  -4.541   0.208
  182   HD13  LEU  23          3HD1      LEU  23   5.595  -4.561  -1.397
  183   HD21  LEU  23          1HD2      LEU  23   3.663  -5.861  -1.842
  184   HD22  LEU  23          2HD2      LEU  23   2.580  -6.337  -0.533
  185   HD23  LEU  23          3HD2      LEU  23   3.984  -7.334  -0.925
  186    H    SER  24           H        SER  24   5.201  -5.731   4.041
  187    HA   SER  24           HA       SER  24   5.765  -8.255   5.130
  188    HB2  SER  24          2HB       SER  24   7.008  -7.003   6.872
  189    HB3  SER  24          1HB       SER  24   7.426  -6.622   5.209
  190    HG   SER  24           HG       SER  24   6.219  -4.716   5.373
  191    H    TYR  25           H        TYR  25   3.429  -5.869   5.908
  192    HA   TYR  25           HA       TYR  25   3.025  -6.591   8.609
  193    HB2  TYR  25          2HB       TYR  25   1.593  -4.863   6.625
  194    HB3  TYR  25          1HB       TYR  25   0.694  -5.427   8.046
  195    HD1  TYR  25          1HD       TYR  25   4.174  -4.169   7.461
  196    HD2  TYR  25          2HD       TYR  25   0.611  -3.869   9.761
  197    HE1  TYR  25          1HE       TYR  25   5.225  -2.438   8.835
  198    HE2  TYR  25          2HE       TYR  25   1.652  -2.125  11.149
  199    HH   TYR  25           HH       TYR  25   3.931  -1.404  11.793
  200    H    ALA  26           H        ALA  26   1.166  -7.339   5.635
  201    HA   ALA  26           HA       ALA  26  -0.608  -8.994   7.166
  202    HB1  ALA  26          1HB       ALA  26  -1.608  -9.591   5.057
  203    HB2  ALA  26          2HB       ALA  26  -0.245  -8.888   4.184
  204    HB3  ALA  26          3HB       ALA  26  -1.320  -7.853   5.126
  205    H    GLN  27           H        GLN  27   1.498 -10.004   4.410
  206    HA   GLN  27           HA       GLN  27   1.819 -12.534   5.884
  207    HB2  GLN  27          2HB       GLN  27   2.240 -12.562   2.956
  208    HB3  GLN  27          1HB       GLN  27   1.608 -13.820   4.012
  209    HG2  GLN  27          2HG       GLN  27  -0.256 -13.300   2.802
  210    HG3  GLN  27          1HG       GLN  27  -0.468 -12.189   4.165
  211   HE21  GLN  27          1HE2      GLN  27  -1.357 -12.027   1.334
  212   HE22  GLN  27          2HE2      GLN  27  -0.733 -10.507   0.774
  213    H    GLY  28           H        GLY  28   3.389  -9.977   4.181
  214    HA2  GLY  28          2HA       GLY  28   5.750  -9.707   4.003
  215    HA3  GLY  28          1HA       GLY  28   5.944 -11.434   4.264
  216    H    GLN  29           H        GLN  29   3.550 -11.724   2.265
  217    HA   GLN  29           HA       GLN  29   5.168 -12.093  -0.068
  218    HB2  GLN  29          2HB       GLN  29   2.157 -12.106   0.054
  219    HB3  GLN  29          1HB       GLN  29   3.187 -12.927  -1.107
  220    HG2  GLN  29          2HG       GLN  29   4.042 -14.349   0.714
  221    HG3  GLN  29          1HG       GLN  29   2.903 -13.564   1.810
  222   HE21  GLN  29          1HE2      GLN  29   0.643 -13.866   1.420
  223   HE22  GLN  29          2HE2      GLN  29   0.074 -15.265   0.581
  224    H    ASP  30           H        ASP  30   3.578 -11.344  -2.177
  225    HA   ASP  30           HA       ASP  30   4.134  -8.503  -2.325
  226    HB2  ASP  30          2HB       ASP  30   3.229 -10.524  -4.363
  227    HB3  ASP  30          1HB       ASP  30   3.348  -8.805  -4.724
  228    H    LYS  31           H        LYS  31   1.735  -9.765  -0.839
  229    HA   LYS  31           HA       LYS  31  -0.265  -7.957  -1.932
  230    HB2  LYS  31          2HB       LYS  31  -0.722 -10.903  -1.407
  231    HB3  LYS  31          1HB       LYS  31  -2.011  -9.737  -1.683
  232    HG2  LYS  31          2HG       LYS  31  -0.477  -9.291  -3.856
  233    HG3  LYS  31          1HG       LYS  31  -0.163 -10.997  -3.597
  234    HD2  LYS  31          2HD       LYS  31  -2.877  -9.704  -3.872
  235    HD3  LYS  31          1HD       LYS  31  -2.071 -10.672  -5.110
  236    HE2  LYS  31          2HE       LYS  31  -3.143 -11.503  -2.458
  237    HE3  LYS  31          1HE       LYS  31  -3.719 -12.002  -4.039
  238    HZ1  LYS  31          1HZ       LYS  31  -1.096 -12.720  -2.845
  239    HZ2  LYS  31          2HZ       LYS  31  -1.613 -13.151  -4.396
  240    HZ3  LYS  31          3HZ       LYS  31  -2.419 -13.756  -3.042
  241    H    VAL  32           H        VAL  32  -2.325  -8.337  -0.309
  242    HA   VAL  32           HA       VAL  32  -1.279  -8.685   2.405
  243    HB   VAL  32           HB       VAL  32  -2.621  -6.288   1.320
  244   HG11  VAL  32          1HG1      VAL  32  -3.258  -7.384   4.035
  245   HG12  VAL  32          2HG1      VAL  32  -4.393  -7.018   2.738
  246   HG13  VAL  32          3HG1      VAL  32  -3.523  -5.714   3.544
  247   HG21  VAL  32          1HG2      VAL  32  -1.352  -5.321   3.242
  248   HG22  VAL  32          2HG2      VAL  32  -0.389  -6.098   1.984
  249   HG23  VAL  32          3HG2      VAL  32  -0.695  -6.935   3.511
  250    H    THR  33           H        THR  33  -2.458  -9.968   3.674
  251    HA   THR  33           HA       THR  33  -5.015 -10.938   2.846
  252    HB   THR  33           HB       THR  33  -5.080 -11.913   5.155
  253    HG1  THR  33          1HG       THR  33  -3.146 -11.648   6.415
  254   HG21  THR  33          1HG2      THR  33  -4.044 -13.163   3.335
  255   HG22  THR  33          2HG2      THR  33  -3.169 -13.433   4.842
  256   HG23  THR  33          3HG2      THR  33  -2.513 -12.339   3.626
  257    H    GLU  34           H        GLU  34  -6.974 -10.500   4.218
  258    HA   GLU  34           HA       GLU  34  -7.385  -7.820   3.594
  259    HB2  GLU  34          2HB       GLU  34  -9.122  -9.282   3.215
  260    HB3  GLU  34          1HB       GLU  34  -9.175  -9.822   4.898
  261    HG2  GLU  34          2HG       GLU  34 -10.131  -7.774   5.612
  262    HG3  GLU  34          1HG       GLU  34  -9.789  -7.001   4.064
  263    H    ALA  35           H        ALA  35  -6.618  -9.149   6.685
  264    HA   ALA  35           HA       ALA  35  -7.634  -7.326   8.476
  265    HB1  ALA  35          1HB       ALA  35  -6.344  -9.325   9.107
  266    HB2  ALA  35          2HB       ALA  35  -5.772  -7.872   9.927
  267    HB3  ALA  35          3HB       ALA  35  -4.870  -8.525   8.559
  268    H    MET  36           H        MET  36  -4.502  -7.083   6.760
  269    HA   MET  36           HA       MET  36  -3.935  -4.488   7.740
  270    HB2  MET  36          2HB       MET  36  -2.798  -6.259   5.640
  271    HB3  MET  36          1HB       MET  36  -2.356  -4.566   5.628
  272    HG2  MET  36          2HG       MET  36  -2.018  -6.452   7.939
  273    HG3  MET  36          1HG       MET  36  -0.737  -5.898   6.859
  274    HE1  MET  36          1HE       MET  36  -0.929  -1.992   7.575
  275    HE2  MET  36          2HE       MET  36  -2.043  -2.834   6.496
  276    HE3  MET  36          3HE       MET  36  -0.324  -3.234   6.477
  277    H    ILE  37           H        ILE  37  -5.836  -5.704   5.145
  278    HA   ILE  37           HA       ILE  37  -5.843  -3.331   3.561
  279    HB   ILE  37           HB       ILE  37  -7.258  -5.886   3.555
  280   HG12  ILE  37          2HG1      ILE  37  -5.777  -6.075   1.900
  281   HG13  ILE  37          1HG1      ILE  37  -6.678  -4.855   1.035
  282   HG21  ILE  37          1HG2      ILE  37  -9.160  -4.402   3.447
  283   HG22  ILE  37          2HG2      ILE  37  -8.855  -5.105   1.860
  284   HG23  ILE  37          3HG2      ILE  37  -8.374  -3.442   2.194
  285   HD11  ILE  37          1HD1      ILE  37  -5.299  -3.109   1.852
  286   HD12  ILE  37          2HD1      ILE  37  -4.284  -4.376   1.167
  287   HD13  ILE  37          3HD1      ILE  37  -4.442  -4.228   2.912
  288    H    ASP  38           H        ASP  38  -7.796  -4.610   6.202
  289    HA   ASP  38           HA       ASP  38  -9.896  -2.753   6.166
  290    HB2  ASP  38          2HB       ASP  38 -10.207  -4.669   7.431
  291    HB3  ASP  38          1HB       ASP  38  -8.611  -4.571   8.145
  292    H    GLN  39           H        GLN  39  -6.741  -2.798   7.719
  293    HA   GLN  39           HA       GLN  39  -7.055  -0.509   9.298
  294    HB2  GLN  39          2HB       GLN  39  -4.876  -0.810   9.884
  295    HB3  GLN  39          1HB       GLN  39  -5.032  -2.315   8.997
  296    HG2  GLN  39          2HG       GLN  39  -3.042  -1.431   8.197
  297    HG3  GLN  39          1HG       GLN  39  -4.200  -0.956   6.965
  298   HE21  GLN  39          1HE2      GLN  39  -2.985   0.752   6.243
  299   HE22  GLN  39          2HE2      GLN  39  -2.750   2.190   7.168
  300    H    LEU  40           H        LEU  40  -5.919  -0.939   5.989
  301    HA   LEU  40           HA       LEU  40  -5.317   1.768   5.522
  302    HB2  LEU  40          2HB       LEU  40  -4.466   0.018   4.081
  303    HB3  LEU  40          1HB       LEU  40  -6.094  -0.396   3.543
  304    HG   LEU  40           HG       LEU  40  -6.015   2.211   2.868
  305   HD11  LEU  40          1HD1      LEU  40  -3.433   1.659   3.704
  306   HD12  LEU  40          2HD1      LEU  40  -3.971   3.079   2.795
  307   HD13  LEU  40          3HD1      LEU  40  -3.338   1.666   1.942
  308   HD21  LEU  40          1HD2      LEU  40  -5.421   1.469   0.600
  309   HD22  LEU  40          2HD2      LEU  40  -6.585   0.383   1.363
  310   HD23  LEU  40          3HD2      LEU  40  -4.885  -0.080   1.255
  311    H    ILE  41           H        ILE  41  -8.199  -0.151   4.691
  312    HA   ILE  41           HA       ILE  41  -9.531   1.957   3.394
  313    HB   ILE  41           HB       ILE  41 -10.595  -0.555   4.671
  314   HG12  ILE  41          2HG1      ILE  41  -8.995  -0.623   2.690
  315   HG13  ILE  41          1HG1      ILE  41 -10.519  -1.471   2.480
  316   HG21  ILE  41          1HG2      ILE  41 -12.392   1.087   4.587
  317   HG22  ILE  41          2HG2      ILE  41 -12.655  -0.186   3.394
  318   HG23  ILE  41          3HG2      ILE  41 -12.052   1.391   2.883
  319   HD11  ILE  41          1HD1      ILE  41 -11.367   0.431   1.194
  320   HD12  ILE  41          2HD1      ILE  41  -9.904  -0.255   0.485
  321   HD13  ILE  41          3HD1      ILE  41  -9.816   1.246   1.404
  322    H    CYS  42           H        CYS  42  -9.730   0.880   6.780
  323    HA   CYS  42           HA       CYS  42 -11.745   2.801   7.469
  324    HB2  CYS  42          2HB       CYS  42 -11.445   0.710   8.689
  325    HB3  CYS  42          1HB       CYS  42  -9.864   1.232   9.236
  326    HG   CYS  42           HG       CYS  42 -11.422   3.638  10.319
  327    H    GLY  43           H        GLY  43  -8.435   2.870   6.991
  328    HA2  GLY  43          2HA       GLY  43  -7.523   4.964   8.564
  329    HA3  GLY  43          1HA       GLY  43  -6.964   4.634   6.932
  330    H    ALA  44           H        ALA  44  -9.095   5.253   5.354
  331    HA   ALA  44           HA       ALA  44  -9.236   8.152   5.698
  332    HB1  ALA  44          1HB       ALA  44  -9.986   8.252   3.426
  333    HB2  ALA  44          2HB       ALA  44 -10.279   6.512   3.391
  334    HB3  ALA  44          3HB       ALA  44  -8.624   7.125   3.488
  335    H    PHE  45           H        PHE  45 -11.505   5.606   4.775
  336    HA   PHE  45           HA       PHE  45 -13.759   7.185   5.706
  337    HB2  PHE  45          2HB       PHE  45 -14.363   4.504   4.851
  338    HB3  PHE  45          1HB       PHE  45 -14.966   6.044   4.245
  339    HD1  PHE  45          1HD       PHE  45 -12.723   3.302   3.620
  340    HD2  PHE  45          2HD       PHE  45 -13.634   7.303   2.512
  341    HE1  PHE  45          1HE       PHE  45 -11.408   3.021   1.573
  342    HE2  PHE  45          2HE       PHE  45 -12.303   7.033   0.457
  343    HZ   PHE  45           HZ       PHE  45 -11.171   4.884  -0.007
  344    HA   PRO  46           HA       PRO  46 -14.206   4.988   9.434
  345    HB2  PRO  46          2HB       PRO  46 -16.810   4.627   9.823
  346    HB3  PRO  46          1HB       PRO  46 -16.116   6.242   9.700
  347    HG2  PRO  46          2HG       PRO  46 -17.366   4.579   7.533
  348    HG3  PRO  46          1HG       PRO  46 -17.809   6.234   8.026
  349    HD2  PRO  46          2HD       PRO  46 -16.170   5.787   5.956
  350    HD3  PRO  46          1HD       PRO  46 -15.886   7.147   7.066
  351    H    GLY  47           H        GLY  47 -15.966   3.076  10.379
  352    HA2  GLY  47          2HA       GLY  47 -14.940   0.660   9.309
  353    HA3  GLY  47          1HA       GLY  47 -16.175   0.808  10.551
  354    H    LEU  48           H        LEU  48 -15.576   0.872   7.122
  355    HA   LEU  48           HA       LEU  48 -18.181   0.867   6.133
  356    HB2  LEU  48          2HB       LEU  48 -15.655  -0.424   5.147
  357    HB3  LEU  48          1HB       LEU  48 -17.167  -0.668   4.303
  358    HG   LEU  48           HG       LEU  48 -17.289   1.854   4.057
  359   HD11  LEU  48          1HD1      LEU  48 -15.055   2.944   4.112
  360   HD12  LEU  48          2HD1      LEU  48 -14.494   1.582   5.078
  361   HD13  LEU  48          3HD1      LEU  48 -15.786   2.622   5.682
  362   HD21  LEU  48          1HD2      LEU  48 -16.695   0.413   2.215
  363   HD22  LEU  48          2HD2      LEU  48 -15.024   0.352   2.776
  364   HD23  LEU  48          3HD2      LEU  48 -15.703   1.873   2.196
  365    H    SER  49           H        SER  49 -19.749  -0.663   5.889
  366    HA   SER  49           HA       SER  49 -19.602  -3.180   7.191
  367    HB2  SER  49          2HB       SER  49 -21.748  -2.012   6.571
  368    HB3  SER  49          1HB       SER  49 -21.397  -2.367   4.878
  369    HG   SER  49           HG       SER  49 -22.454  -3.961   6.803
  370    H    TRP  50           H        TRP  50 -19.268  -5.229   6.225
  371    HA   TRP  50           HA       TRP  50 -17.007  -5.243   4.596
  372    HB2  TRP  50          2HB       TRP  50 -17.755  -7.056   6.234
  373    HB3  TRP  50          1HB       TRP  50 -18.781  -7.647   4.930
  374    HD1  TRP  50           HD       TRP  50 -15.029  -6.972   5.560
  375    HE1  TRP  50          1HE       TRP  50 -13.699  -8.642   4.112
  376    HE3  TRP  50          3HE       TRP  50 -18.927  -9.177   3.127
  377    HZ2  TRP  50          2HZ       TRP  50 -14.274 -10.620   2.206
  378    HZ3  TRP  50          3HZ       TRP  50 -18.454 -10.949   1.493
  379    HH2  TRP  50           HH       TRP  50 -16.161 -11.665   1.041
  380    H    GLU  51           H        GLU  51 -20.389  -5.482   3.774
  381    HA   GLU  51           HA       GLU  51 -20.212  -6.336   1.124
  382    HB2  GLU  51          2HB       GLU  51 -22.043  -4.224   2.279
  383    HB3  GLU  51          1HB       GLU  51 -22.288  -5.070   0.761
  384    HG2  GLU  51          2HG       GLU  51 -22.525  -7.170   1.966
  385    HG3  GLU  51          1HG       GLU  51 -22.263  -6.336   3.482
  386    H    GLN  52           H        GLN  52 -20.203  -3.009   2.373
  387    HA   GLN  52           HA       GLN  52 -19.707  -1.785  -0.129
  388    HB2  GLN  52          2HB       GLN  52 -20.547  -0.896   2.292
  389    HB3  GLN  52          1HB       GLN  52 -18.870  -0.365   2.339
  390    HG2  GLN  52          2HG       GLN  52 -20.813   0.308   0.139
  391    HG3  GLN  52          1HG       GLN  52 -20.448   1.346   1.514
  392   HE21  GLN  52          1HE2      GLN  52 -19.297   0.050  -1.495
  393   HE22  GLN  52          2HE2      GLN  52 -17.893   1.053  -1.619
  394    H    LEU  53           H        LEU  53 -17.663  -3.100   2.372
  395    HA   LEU  53           HA       LEU  53 -15.330  -1.715   1.451
  396    HB2  LEU  53          2HB       LEU  53 -15.598  -2.396   3.809
  397    HB3  LEU  53          1HB       LEU  53 -15.547  -4.079   3.320
  398    HG   LEU  53           HG       LEU  53 -13.238  -2.419   2.491
  399   HD11  LEU  53          1HD1      LEU  53 -13.671  -3.254   5.368
  400   HD12  LEU  53          2HD1      LEU  53 -13.647  -1.596   4.769
  401   HD13  LEU  53          3HD1      LEU  53 -12.186  -2.581   4.697
  402   HD21  LEU  53          1HD2      LEU  53 -13.459  -5.152   3.773
  403   HD22  LEU  53          2HD2      LEU  53 -12.018  -4.449   3.036
  404   HD23  LEU  53          3HD2      LEU  53 -13.415  -4.845   2.037
  405    H    GLN  54           H        GLN  54 -16.625  -5.003   1.150
  406    HA   GLN  54           HA       GLN  54 -14.430  -6.160  -0.112
  407    HB2  GLN  54          2HB       GLN  54 -15.835  -7.950  -0.705
  408    HB3  GLN  54          1HB       GLN  54 -16.442  -7.334   0.812
  409    HG2  GLN  54          2HG       GLN  54 -18.309  -6.343  -0.203
  410    HG3  GLN  54          1HG       GLN  54 -17.624  -6.525  -1.816
  411   HE21  GLN  54          1HE2      GLN  54 -19.174  -8.173   0.842
  412   HE22  GLN  54          2HE2      GLN  54 -19.623  -9.582  -0.048
  413    H    GLU  55           H        GLU  55 -17.139  -4.321  -1.448
  414    HA   GLU  55           HA       GLU  55 -16.275  -4.670  -4.151
  415    HB2  GLU  55          2HB       GLU  55 -17.943  -2.863  -4.645
  416    HB3  GLU  55          1HB       GLU  55 -18.583  -4.288  -3.845
  417    HG2  GLU  55          2HG       GLU  55 -18.579  -3.109  -1.728
  418    HG3  GLU  55          1HG       GLU  55 -17.904  -1.703  -2.493
  419    H    LYS  56           H        LYS  56 -15.611  -2.328  -1.629
  420    HA   LYS  56           HA       LYS  56 -14.570  -0.184  -3.017
  421    HB2  LYS  56          2HB       LYS  56 -14.608  -0.613  -0.424
  422    HB3  LYS  56          1HB       LYS  56 -13.040  -1.368  -0.702
  423    HG2  LYS  56          2HG       LYS  56 -12.710   0.903  -0.006
  424    HG3  LYS  56          1HG       LYS  56 -12.219   0.735  -1.688
  425    HD2  LYS  56          2HD       LYS  56 -13.414   2.785  -1.504
  426    HD3  LYS  56          1HD       LYS  56 -14.482   1.647  -2.323
  427    HE2  LYS  56          2HE       LYS  56 -15.653   1.221  -0.228
  428    HE3  LYS  56          1HE       LYS  56 -14.560   2.316   0.616
  429    HZ1  LYS  56          1HZ       LYS  56 -16.437   3.087  -1.552
  430    HZ2  LYS  56          2HZ       LYS  56 -15.402   4.136  -0.730
  431    HZ3  LYS  56          3HZ       LYS  56 -16.665   3.378   0.099
  432    H    LYS  57           H        LYS  57 -12.913  -3.151  -2.067
  433    HA   LYS  57           HA       LYS  57 -10.653  -2.424  -3.776
  434    HB2  LYS  57          2HB       LYS  57 -10.068  -4.693  -2.194
  435    HB3  LYS  57          1HB       LYS  57  -9.384  -3.080  -2.071
  436    HG2  LYS  57          2HG       LYS  57 -10.204  -3.375   0.037
  437    HG3  LYS  57          1HG       LYS  57 -11.583  -2.599  -0.736
  438    HD2  LYS  57          2HD       LYS  57 -12.607  -4.363   0.297
  439    HD3  LYS  57          1HD       LYS  57 -12.277  -5.055  -1.289
  440    HE2  LYS  57          2HE       LYS  57 -10.228  -6.087  -0.376
  441    HE3  LYS  57          1HE       LYS  57 -10.637  -5.446   1.206
  442    HZ1  LYS  57          1HZ       LYS  57 -12.865  -6.685   0.772
  443    HZ2  LYS  57          2HZ       LYS  57 -11.529  -7.531   1.350
  444    HZ3  LYS  57          3HZ       LYS  57 -11.935  -7.610  -0.298
  445    H    LYS  58           H        LYS  58 -13.350  -3.906  -4.336
  446    HA   LYS  58           HA       LYS  58 -13.050  -6.469  -5.177
  447    HB2  LYS  58          2HB       LYS  58 -14.708  -4.230  -5.906
  448    HB3  LYS  58          1HB       LYS  58 -14.318  -5.180  -7.333
  449    HG2  LYS  58          2HG       LYS  58 -15.398  -6.399  -4.815
  450    HG3  LYS  58          1HG       LYS  58 -16.433  -5.801  -6.113
  451    HD2  LYS  58          2HD       LYS  58 -15.295  -7.330  -7.682
  452    HD3  LYS  58          1HD       LYS  58 -14.336  -7.960  -6.343
  453    HE2  LYS  58          2HE       LYS  58 -16.200  -9.440  -6.815
  454    HE3  LYS  58          1HE       LYS  58 -16.396  -8.697  -5.231
  455    HZ1  LYS  58          1HZ       LYS  58 -18.467  -8.725  -6.484
  456    HZ2  LYS  58          2HZ       LYS  58 -17.759  -7.811  -7.719
  457    HZ3  LYS  58          3HZ       LYS  58 -17.967  -7.137  -6.181
  458    H    GLY  59           H        GLY  59 -11.970  -7.564  -6.676
  459    HA2  GLY  59          2HA       GLY  59 -10.976  -7.287  -9.037
  460    HA3  GLY  59          1HA       GLY  59  -9.973  -6.082  -8.236
  461    H    ARG  60           H        ARG  60  -8.282  -6.699  -7.016
  462    HA   ARG  60           HA       ARG  60  -7.464  -9.470  -7.210
  463    HB2  ARG  60          2HB       ARG  60  -6.009  -7.293  -5.717
  464    HB3  ARG  60          1HB       ARG  60  -5.342  -8.752  -6.432
  465    HG2  ARG  60          2HG       ARG  60  -6.314  -6.284  -7.841
  466    HG3  ARG  60          1HG       ARG  60  -4.681  -6.948  -7.801
  467    HD2  ARG  60          2HD       ARG  60  -5.517  -8.939  -9.012
  468    HD3  ARG  60          1HD       ARG  60  -7.094  -8.170  -9.122
  469    HE   ARG  60           HE       ARG  60  -4.880  -6.639 -10.194
  470   HH11  ARG  60          1HH1      ARG  60  -7.490  -8.881 -10.839
  471   HH12  ARG  60          2HH1      ARG  60  -7.556  -8.516 -12.534
  472   HH21  ARG  60          1HH2      ARG  60  -4.950  -6.165 -12.433
  473   HH22  ARG  60          2HH2      ARG  60  -6.113  -6.968 -13.440
  474    H    ALA  61           H        ALA  61  -8.850  -7.309  -4.929
  475    HA   ALA  61           HA       ALA  61  -8.449  -9.223  -2.732
  476    HB1  ALA  61          1HB       ALA  61  -7.538  -7.028  -2.225
  477    HB2  ALA  61          2HB       ALA  61  -8.950  -7.341  -1.220
  478    HB3  ALA  61          3HB       ALA  61  -9.082  -6.274  -2.617
  479    H    ALA  62           H        ALA  62 -10.365  -8.987  -5.012
  480    HA   ALA  62           HA       ALA  62 -12.966  -8.458  -4.344
  481    HB1  ALA  62          1HB       ALA  62 -12.219  -9.249  -6.533
  482    HB2  ALA  62          2HB       ALA  62 -13.592 -10.184  -5.939
  483    HB3  ALA  62          3HB       ALA  62 -11.962 -10.855  -5.858
  484    H    ALA  63           H        ALA  63 -11.369 -11.615  -3.891
  485    HA   ALA  63           HA       ALA  63 -13.370 -12.401  -1.951
  486    HB1  ALA  63          1HB       ALA  63 -12.455 -14.097  -3.453
  487    HB2  ALA  63          2HB       ALA  63 -12.086 -14.477  -1.771
  488    HB3  ALA  63          3HB       ALA  63 -10.839 -13.799  -2.814
  489    H    ASN  64           H        ASN  64  -9.834 -12.583  -1.738
  490    HA   ASN  64           HA       ASN  64  -9.658 -10.607   0.295
  491    HB2  ASN  64          2HB       ASN  64  -9.706 -13.473   1.089
  492    HB3  ASN  64          1HB       ASN  64  -8.507 -12.449   1.864
  493   HD21  ASN  64          1HD2      ASN  64 -10.240 -10.087   1.699
  494   HD22  ASN  64          2HD2      ASN  64 -11.452 -10.296   2.913
  495    H    GLY  65           H        GLY  65  -8.045  -9.632  -0.789
  496    HA2  GLY  65          2HA       GLY  65  -5.438 -10.257  -0.214
  497    HA3  GLY  65          1HA       GLY  65  -5.750 -11.135  -1.693
  498    H    TYR  66           H        TYR  66  -5.886  -7.825  -0.301
  499    HA   TYR  66           HA       TYR  66  -5.648  -6.518  -2.816
  500    HB2  TYR  66          2HB       TYR  66  -5.550  -5.666  -0.115
  501    HB3  TYR  66          1HB       TYR  66  -4.064  -5.129  -0.882
  502    HD1  TYR  66          1HD       TYR  66  -5.062  -2.898  -0.184
  503    HD2  TYR  66          2HD       TYR  66  -6.761  -5.269  -3.266
  504    HE1  TYR  66          1HE       TYR  66  -6.169  -0.904  -1.079
  505    HE2  TYR  66          2HE       TYR  66  -7.881  -3.287  -4.175
  506    HH   TYR  66           HH       TYR  66  -8.637  -1.074  -3.394
  507    H    ASP  67           H        ASP  67  -3.777  -5.706  -3.894
  508    HA   ASP  67           HA       ASP  67  -1.386  -7.243  -3.248
  509    HB2  ASP  67          2HB       ASP  67  -1.204  -8.101  -5.351
  510    HB3  ASP  67          1HB       ASP  67  -2.961  -7.946  -5.269
  511    H    ARG  68           H        ARG  68   0.539  -6.271  -4.494
  512    HA   ARG  68           HA       ARG  68   0.819  -3.730  -3.387
  513    HB2  ARG  68          2HB       ARG  68   2.999  -3.618  -4.513
  514    HB3  ARG  68          1HB       ARG  68   2.740  -5.163  -3.725
  515    HG2  ARG  68          2HG       ARG  68   2.085  -6.074  -5.979
  516    HG3  ARG  68          1HG       ARG  68   2.669  -4.555  -6.666
  517    HD2  ARG  68          2HD       ARG  68   4.254  -6.571  -5.079
  518    HD3  ARG  68          1HD       ARG  68   4.433  -6.184  -6.789
  519    HE   ARG  68           HE       ARG  68   5.097  -3.884  -5.958
  520   HH11  ARG  68          1HH1      ARG  68   5.727  -6.825  -4.132
  521   HH12  ARG  68          2HH1      ARG  68   7.028  -6.119  -3.225
  522   HH21  ARG  68          1HH2      ARG  68   6.812  -2.981  -4.796
  523   HH22  ARG  68          2HH2      ARG  68   7.660  -3.928  -3.592
  524    H    SER  69           H        SER  69  -0.114  -4.648  -6.641
  525    HA   SER  69           HA       SER  69   0.129  -2.018  -7.724
  526    HB2  SER  69          2HB       SER  69   0.147  -3.982  -9.177
  527    HB3  SER  69          1HB       SER  69  -1.489  -4.395  -8.665
  528    HG   SER  69           HG       SER  69  -2.268  -2.606  -9.705
  529    H    ALA  70           H        ALA  70  -2.625  -3.939  -6.528
  530    HA   ALA  70           HA       ALA  70  -4.593  -1.959  -7.000
  531    HB1  ALA  70          1HB       ALA  70  -4.700  -4.153  -4.934
  532    HB2  ALA  70          2HB       ALA  70  -5.036  -4.397  -6.653
  533    HB3  ALA  70          3HB       ALA  70  -6.061  -3.328  -5.694
  534    H    PHE  71           H        PHE  71  -2.781  -2.907  -4.136
  535    HA   PHE  71           HA       PHE  71  -3.978  -1.187  -2.295
  536    HB2  PHE  71          2HB       PHE  71  -2.474  -3.075  -1.701
  537    HB3  PHE  71          1HB       PHE  71  -1.114  -2.170  -2.355
  538    HD1  PHE  71          1HD       PHE  71  -3.584  -2.295   0.353
  539    HD2  PHE  71          2HD       PHE  71  -0.074  -0.427  -1.114
  540    HE1  PHE  71          1HE       PHE  71  -3.254  -1.249   2.540
  541    HE2  PHE  71          2HE       PHE  71   0.269   0.616   1.080
  542    HZ   PHE  71           HZ       PHE  71  -1.317   0.221   2.903
  543    H    PHE  72           H        PHE  72  -1.155  -0.741  -4.401
  544    HA   PHE  72           HA       PHE  72  -0.508   1.817  -3.381
  545    HB2  PHE  72          2HB       PHE  72   1.116   0.395  -4.570
  546    HB3  PHE  72          1HB       PHE  72   0.223   0.654  -6.066
  547    HD1  PHE  72          1HD       PHE  72   1.795   2.612  -3.318
  548    HD2  PHE  72          2HD       PHE  72   0.950   2.320  -7.478
  549    HE1  PHE  72          1HE       PHE  72   3.093   4.659  -3.718
  550    HE2  PHE  72          2HE       PHE  72   2.250   4.369  -7.890
  551    HZ   PHE  72           HZ       PHE  72   3.323   5.542  -6.008
  552    H    SER  73           H        SER  73  -2.572   0.707  -5.943
  553    HA   SER  73           HA       SER  73  -2.988   3.098  -7.317
  554    HB2  SER  73          2HB       SER  73  -3.756   0.871  -8.102
  555    HB3  SER  73          1HB       SER  73  -4.990   0.871  -6.844
  556    HG   SER  73           HG       SER  73  -6.050   1.664  -8.547
  557    H    LEU  74           H        LEU  74  -4.578   1.782  -4.446
  558    HA   LEU  74           HA       LEU  74  -6.433   3.949  -4.208
  559    HB2  LEU  74          2HB       LEU  74  -6.873   1.677  -3.336
  560    HB3  LEU  74          1HB       LEU  74  -5.590   1.897  -2.166
  561    HG   LEU  74           HG       LEU  74  -6.842   3.590  -1.011
  562   HD11  LEU  74          1HD1      LEU  74  -8.883   3.301  -3.211
  563   HD12  LEU  74          2HD1      LEU  74  -7.868   4.709  -2.907
  564   HD13  LEU  74          3HD1      LEU  74  -9.096   4.240  -1.735
  565   HD21  LEU  74          1HD2      LEU  74  -7.369   1.357  -0.373
  566   HD22  LEU  74          2HD2      LEU  74  -8.454   1.167  -1.748
  567   HD23  LEU  74          3HD2      LEU  74  -8.882   2.264  -0.432
  568    H    VAL  75           H        VAL  75  -3.485   3.027  -2.422
  569    HA   VAL  75           HA       VAL  75  -3.600   5.130  -0.553
  570    HB   VAL  75           HB       VAL  75  -1.064   3.793  -1.501
  571   HG11  VAL  75          1HG1      VAL  75  -0.298   5.354  -0.084
  572   HG12  VAL  75          2HG1      VAL  75  -0.683   4.074   1.075
  573   HG13  VAL  75          3HG1      VAL  75  -1.798   5.422   0.838
  574   HG21  VAL  75          1HG2      VAL  75  -2.426   1.968  -0.967
  575   HG22  VAL  75          2HG2      VAL  75  -3.179   2.823   0.379
  576   HG23  VAL  75          3HG2      VAL  75  -1.504   2.285   0.508
  577    H    ALA  76           H        ALA  76  -1.981   4.899  -3.695
  578    HA   ALA  76           HA       ALA  76  -0.425   7.226  -3.417
  579    HB1  ALA  76          1HB       ALA  76   0.052   5.492  -5.074
  580    HB2  ALA  76          2HB       ALA  76  -0.069   7.089  -5.812
  581    HB3  ALA  76          3HB       ALA  76  -1.403   5.946  -5.961
  582    H    SER  77           H        SER  77  -3.759   6.907  -3.817
  583    HA   SER  77           HA       SER  77  -3.982   9.593  -4.983
  584    HB2  SER  77          2HB       SER  77  -5.246   7.802  -6.112
  585    HB3  SER  77          1HB       SER  77  -6.093   7.452  -4.608
  586    HG   SER  77           HG       SER  77  -6.985   9.546  -4.695
  587    H    ASP  78           H        ASP  78  -3.933   8.033  -2.038
  588    HA   ASP  78           HA       ASP  78  -5.612  10.100  -0.782
  589    HB2  ASP  78          2HB       ASP  78  -5.486   7.145  -0.259
  590    HB3  ASP  78          1HB       ASP  78  -5.979   8.261   1.016
  591    H    GLU  79           H        GLU  79  -4.292  11.450   0.202
  592    HA   GLU  79           HA       GLU  79  -1.696  10.874   1.142
  593    HB2  GLU  79          2HB       GLU  79  -2.023  13.106   0.719
  594    HB3  GLU  79          1HB       GLU  79  -3.633  13.136   1.411
  595    HG2  GLU  79          2HG       GLU  79  -1.330  12.726   3.235
  596    HG3  GLU  79          1HG       GLU  79  -1.562  14.327   2.539
  597    H    GLN  80           H        GLN  80  -4.834  10.683   2.704
  598    HA   GLN  80           HA       GLN  80  -3.947  10.404   5.356
  599    HB2  GLN  80          2HB       GLN  80  -6.266   8.829   4.251
  600    HB3  GLN  80          1HB       GLN  80  -6.072   9.507   5.860
  601    HG2  GLN  80          2HG       GLN  80  -7.237  11.272   5.233
  602    HG3  GLN  80          1HG       GLN  80  -5.979  11.666   4.064
  603   HE21  GLN  80          1HE2      GLN  80  -6.531   9.104   2.616
  604   HE22  GLN  80          2HE2      GLN  80  -7.947   9.432   1.681
  605    H    TYR  81           H        TYR  81  -3.805   8.304   2.641
  606    HA   TYR  81           HA       TYR  81  -3.591   5.886   4.205
  607    HB2  TYR  81          2HB       TYR  81  -3.857   6.444   1.263
  608    HB3  TYR  81          1HB       TYR  81  -3.384   4.851   1.853
  609    HD1  TYR  81          1HD       TYR  81  -5.780   4.930   0.276
  610    HD2  TYR  81          2HD       TYR  81  -5.316   5.812   4.403
  611    HE1  TYR  81          1HE       TYR  81  -8.136   4.260   0.697
  612    HE2  TYR  81          2HE       TYR  81  -7.620   5.176   4.799
  613    HH   TYR  81           HH       TYR  81  -9.684   4.865   3.663
  614    H    VAL  82           H        VAL  82  -1.627   7.876   2.024
  615    HA   VAL  82           HA       VAL  82   0.601   6.215   2.038
  616    HB   VAL  82           HB       VAL  82   1.757   8.222   1.344
  617   HG11  VAL  82          1HG1      VAL  82  -0.859   7.855  -0.032
  618   HG12  VAL  82          2HG1      VAL  82   0.607   6.923  -0.337
  619   HG13  VAL  82          3HG1      VAL  82   0.555   8.644  -0.738
  620   HG21  VAL  82          1HG2      VAL  82   0.398  10.289   0.883
  621   HG22  VAL  82          2HG2      VAL  82   0.973   9.997   2.524
  622   HG23  VAL  82          3HG2      VAL  82  -0.703   9.632   2.098
  623    H    ARG  83           H        ARG  83  -0.252   9.014   3.921
  624    HA   ARG  83           HA       ARG  83   1.892   8.948   5.709
  625    HB2  ARG  83          2HB       ARG  83  -0.861  10.143   5.927
  626    HB3  ARG  83          1HB       ARG  83   0.421  10.438   7.067
  627    HG2  ARG  83          2HG       ARG  83   1.761  11.457   5.256
  628    HG3  ARG  83          1HG       ARG  83   0.371  11.225   4.185
  629    HD2  ARG  83          2HD       ARG  83   0.566  13.487   5.219
  630    HD3  ARG  83          1HD       ARG  83  -0.956  12.626   5.366
  631    HE   ARG  83           HE       ARG  83   1.013  12.757   7.551
  632   HH11  ARG  83          1HH1      ARG  83  -2.306  12.936   6.391
  633   HH12  ARG  83          2HH1      ARG  83  -2.969  13.118   7.988
  634   HH21  ARG  83          1HH2      ARG  83   0.119  12.994   9.631
  635   HH22  ARG  83          2HH2      ARG  83  -1.598  13.158   9.817
  636    H    PHE  84           H        PHE  84  -1.222   7.335   5.671
  637    HA   PHE  84           HA       PHE  84  -1.363   6.648   8.390
  638    HB2  PHE  84          2HB       PHE  84  -2.826   5.962   6.125
  639    HB3  PHE  84          1HB       PHE  84  -2.164   4.415   6.682
  640    HD1  PHE  84          1HD       PHE  84  -3.030   3.357   8.599
  641    HD2  PHE  84          2HD       PHE  84  -4.168   7.357   7.709
  642    HE1  PHE  84          1HE       PHE  84  -4.755   3.252  10.349
  643    HE2  PHE  84          2HE       PHE  84  -5.897   7.258   9.455
  644    HZ   PHE  84           HZ       PHE  84  -6.192   5.204  10.779
  645    H    ILE  85           H        ILE  85   0.227   5.021   5.710
  646    HA   ILE  85           HA       ILE  85   1.273   2.963   7.438
  647    HB   ILE  85           HB       ILE  85   1.550   3.525   4.522
  648   HG12  ILE  85          2HG1      ILE  85   0.769   1.146   6.221
  649   HG13  ILE  85          1HG1      ILE  85  -0.301   2.155   5.255
  650   HG21  ILE  85          1HG2      ILE  85   3.191   1.620   4.415
  651   HG22  ILE  85          2HG2      ILE  85   3.391   1.799   6.158
  652   HG23  ILE  85          3HG2      ILE  85   3.821   3.126   5.081
  653   HD11  ILE  85          1HD1      ILE  85   0.091   0.008   4.202
  654   HD12  ILE  85          2HD1      ILE  85   1.830   0.302   4.180
  655   HD13  ILE  85          3HD1      ILE  85   0.744   1.315   3.218
  656    H    ALA  86           H        ALA  86   2.643   5.746   5.719
  657    HA   ALA  86           HA       ALA  86   5.272   5.607   6.445
  658    HB1  ALA  86          1HB       ALA  86   4.304   7.322   4.968
  659    HB2  ALA  86          2HB       ALA  86   5.359   8.019   6.199
  660    HB3  ALA  86          3HB       ALA  86   3.607   8.123   6.377
  661    H    GLN  87           H        GLN  87   2.579   6.663   8.480
  662    HA   GLN  87           HA       GLN  87   4.308   7.431  10.648
  663    HB2  GLN  87          2HB       GLN  87   2.073   8.451  10.317
  664    HB3  GLN  87          1HB       GLN  87   1.331   6.897  10.672
  665    HG2  GLN  87          2HG       GLN  87   2.195   6.948  12.921
  666    HG3  GLN  87          1HG       GLN  87   3.069   8.440  12.583
  667   HE21  GLN  87          1HE2      GLN  87   1.922  10.368  12.385
  668   HE22  GLN  87          2HE2      GLN  87   0.302  10.532  12.962
  669    H    HIS  88           H        HIS  88   2.287   4.629   9.867
  670    HA   HIS  88           HA       HIS  88   2.687   3.188  12.244
  671    HB2  HIS  88          2HB       HIS  88   2.057   2.311   9.435
  672    HB3  HIS  88          1HB       HIS  88   2.302   1.137  10.720
  673    HD1  HIS  88          1HD       HIS  88   0.740   2.709  12.955
  674    HD2  HIS  88          2HD       HIS  88  -0.637   1.957   9.105
  675    HE1  HIS  88          1HE       HIS  88  -1.766   2.811  13.102
  676    HE2  HIS  88          2HE       HIS  88  -2.573   2.128  10.814
  677    H    PHE  89           H        PHE  89   4.561   3.308   9.254
  678    HA   PHE  89           HA       PHE  89   6.845   2.155  10.627
  679    HB2  PHE  89          2HB       PHE  89   5.597   0.207   9.780
  680    HB3  PHE  89          1HB       PHE  89   5.643   0.885   8.158
  681    HD1  PHE  89          1HD       PHE  89   7.211   0.040   6.729
  682    HD2  PHE  89          2HD       PHE  89   8.024   0.031  10.903
  683    HE1  PHE  89          1HE       PHE  89   9.320  -1.143   6.312
  684    HE2  PHE  89          2HE       PHE  89  10.150  -1.138  10.492
  685    HZ   PHE  89           HZ       PHE  89  10.800  -1.728   8.192
  686    HA   PRO  90           HA       PRO  90   8.761   5.225   7.954
  687    HB2  PRO  90          2HB       PRO  90  11.319   4.611   8.702
  688    HB3  PRO  90          1HB       PRO  90  10.245   5.645   9.650
  689    HG2  PRO  90          2HG       PRO  90  10.887   2.747  10.007
  690    HG3  PRO  90          1HG       PRO  90  10.733   4.020  11.233
  691    HD2  PRO  90          2HD       PRO  90   8.762   2.250  10.760
  692    HD3  PRO  90          1HD       PRO  90   8.422   3.930  11.219
  693    H    CYS  91           H        CYS  91  10.493   5.147   6.259
  694    HA   CYS  91           HA       CYS  91   9.837   2.995   4.514
  695    HB2  CYS  91          2HB       CYS  91  11.311   4.160   2.900
  696    HB3  CYS  91          1HB       CYS  91  10.189   5.289   3.690
  697    HG   CYS  91           HG       CYS  91  13.459   4.886   4.647
  698    H    ALA  92           H        ALA  92  10.715   1.150   4.332
  699    HA   ALA  92           HA       ALA  92  12.746   0.300   6.112
  700    HB1  ALA  92          1HB       ALA  92  12.532  -1.871   5.078
  701    HB2  ALA  92          2HB       ALA  92  11.650  -1.168   3.721
  702    HB3  ALA  92          3HB       ALA  92  10.936  -1.166   5.332
  703    HA   PRO  93           HA       PRO  93  16.384   0.824   3.630
  704    HB2  PRO  93          2HB       PRO  93  18.035  -0.877   4.862
  705    HB3  PRO  93          1HB       PRO  93  17.457   0.572   5.682
  706    HG2  PRO  93          2HG       PRO  93  16.467  -2.244   5.902
  707    HG3  PRO  93          1HG       PRO  93  16.806  -1.081   7.200
  708    HD2  PRO  93          2HD       PRO  93  14.294  -1.551   6.231
  709    HD3  PRO  93          1HD       PRO  93  14.803   0.011   6.911
  710    H    GLU  94           H        GLU  94  17.560  -0.221   2.002
  711    HA   GLU  94           HA       GLU  94  16.418  -2.791   1.155
  712    HB2  GLU  94          2HB       GLU  94  16.311  -0.624  -0.296
  713    HB3  GLU  94          1HB       GLU  94  18.000  -0.967  -0.632
  714    HG2  GLU  94          2HG       GLU  94  15.796  -2.943  -1.125
  715    HG3  GLU  94          1HG       GLU  94  16.341  -1.784  -2.331
  716    H    GLU  95           H        GLU  95  17.783  -4.001   2.516
  717    HA   GLU  95           HA       GLU  95  20.645  -3.761   2.267
  718    HB2  GLU  95          2HB       GLU  95  18.937  -5.796   3.707
  719    HB3  GLU  95          1HB       GLU  95  20.686  -5.711   3.802
  720    HG2  GLU  95          2HG       GLU  95  18.821  -3.511   4.627
  721    HG3  GLU  95          1HG       GLU  95  19.510  -4.713   5.715
  722    H    GLU  96           H        GLU  96  18.562  -6.619   1.915
  723    HA   GLU  96           HA       GLU  96  19.376  -7.172  -0.741
  724    HB2  GLU  96          2HB       GLU  96  21.465  -7.788   0.453
  725    HB3  GLU  96          1HB       GLU  96  20.552  -8.956   1.398
  726    HG2  GLU  96          2HG       GLU  96  20.037 -10.223  -0.593
  727    HG3  GLU  96          1HG       GLU  96  20.844  -9.020  -1.597
  728    H    LYS  97           H        LYS  97  16.994  -7.053  -0.453
  729    HA   LYS  97           HA       LYS  97  15.922  -9.683  -0.530
  730    HB2  LYS  97          2HB       LYS  97  15.954  -9.349   1.917
  731    HB3  LYS  97          1HB       LYS  97  14.944  -7.927   1.726
  732    HG2  LYS  97          2HG       LYS  97  13.145  -9.287   0.838
  733    HG3  LYS  97          1HG       LYS  97  14.160 -10.725   0.954
  734    HD2  LYS  97          2HD       LYS  97  14.319 -10.362   3.396
  735    HD3  LYS  97          1HD       LYS  97  13.205  -9.005   3.238
  736    HE2  LYS  97          2HE       LYS  97  12.599 -11.854   2.464
  737    HE3  LYS  97          1HE       LYS  97  12.092 -11.084   3.964
  738    HZ1  LYS  97          1HZ       LYS  97  11.277 -10.302   1.218
  739    HZ2  LYS  97          2HZ       LYS  97  10.854  -9.461   2.622
  740    HZ3  LYS  97          3HZ       LYS  97  10.306 -11.043   2.387
  741    HA   PRO  98           HA       PRO  98  12.428  -6.373  -1.451
  742    HB2  PRO  98          2HB       PRO  98  14.136  -3.975  -1.843
  743    HB3  PRO  98          1HB       PRO  98  12.528  -4.106  -1.124
  744    HG2  PRO  98          2HG       PRO  98  14.645  -3.715   0.421
  745    HG3  PRO  98          1HG       PRO  98  13.359  -4.829   0.925
  746    HD2  PRO  98          2HD       PRO  98  16.041  -5.447  -0.263
  747    HD3  PRO  98          1HD       PRO  98  15.197  -6.238   1.081
  748    HA   PRO  99           HA       PRO  99  13.031  -6.996  -5.787
  749    HB2  PRO  99          2HB       PRO  99  11.421  -4.510  -6.146
  750    HB3  PRO  99          1HB       PRO  99  11.198  -6.108  -6.867
  751    HG2  PRO  99          2HG       PRO  99   9.630  -5.283  -4.881
  752    HG3  PRO  99          1HG       PRO  99  10.178  -6.967  -4.973
  753    HD2  PRO  99          2HD       PRO  99  11.097  -4.770  -3.183
  754    HD3  PRO  99          1HD       PRO  99  10.961  -6.509  -2.861
  755    H    GLU 100           H        GLU 100  13.073  -3.560  -4.874
  756    HA   GLU 100           HA       GLU 100  15.714  -3.204  -5.906
  757    HB2  GLU 100          2HB       GLU 100  15.004  -1.390  -7.528
  758    HB3  GLU 100          1HB       GLU 100  14.682  -3.038  -8.035
  759    HG2  GLU 100          2HG       GLU 100  12.334  -2.694  -7.181
  760    HG3  GLU 100          1HG       GLU 100  12.760  -0.992  -7.005
  761    H    ILE 101           H        ILE 101  12.768  -1.334  -5.183
  762    HA   ILE 101           HA       ILE 101  14.251   0.125  -3.114
  763    HB   ILE 101           HB       ILE 101  12.521   1.445  -5.219
  764   HG12  ILE 101          2HG1      ILE 101  14.809   0.833  -5.998
  765   HG13  ILE 101          1HG1      ILE 101  14.523   2.562  -5.977
  766   HG21  ILE 101          1HG2      ILE 101  13.958   2.651  -2.862
  767   HG22  ILE 101          2HG2      ILE 101  12.213   2.514  -3.074
  768   HG23  ILE 101          3HG2      ILE 101  13.150   3.562  -4.138
  769   HD11  ILE 101          1HD1      ILE 101  16.062   1.023  -3.935
  770   HD12  ILE 101          2HD1      ILE 101  15.732   2.756  -3.904
  771   HD13  ILE 101          3HD1      ILE 101  16.710   2.072  -5.195
  772    H    ASP 102           H        ASP 102  11.231  -0.882  -4.537
  773    HA   ASP 102           HA       ASP 102   9.190  -1.371  -3.724
  774    HB2  ASP 102          2HB       ASP 102  10.619  -1.099  -1.112
  775    HB3  ASP 102          1HB       ASP 102   8.868  -1.138  -1.128
  776    H    ALA 103           H        ALA 103  10.221   1.353  -4.333
  777    HA   ALA 103           HA       ALA 103   7.938   2.813  -3.196
  778    HB1  ALA 103          1HB       ALA 103   9.139   4.861  -4.127
  779    HB2  ALA 103          2HB       ALA 103  10.537   3.804  -4.360
  780    HB3  ALA 103          3HB       ALA 103   9.894   4.069  -2.740
  781    H    LEU 104           H        LEU 104   9.859   2.845  -6.167
  782    HA   LEU 104           HA       LEU 104   7.361   2.906  -7.722
  783    HB2  LEU 104          2HB       LEU 104   9.908   4.168  -8.694
  784    HB3  LEU 104          1HB       LEU 104   8.264   4.488  -9.201
  785    HG   LEU 104           HG       LEU 104   9.533   5.377  -6.610
  786   HD11  LEU 104          1HD1      LEU 104  10.311   6.626  -8.534
  787   HD12  LEU 104          2HD1      LEU 104   9.255   7.622  -7.534
  788   HD13  LEU 104          3HD1      LEU 104   8.648   6.925  -9.035
  789   HD21  LEU 104          1HD2      LEU 104   7.434   6.676  -6.316
  790   HD22  LEU 104          2HD2      LEU 104   7.231   4.931  -6.176
  791   HD23  LEU 104          3HD2      LEU 104   6.733   5.760  -7.654
  792    H    GLU 105           H        GLU 105   8.104   0.499  -7.288
  793    HA   GLU 105           HA       GLU 105  10.391  -0.430  -8.717
  794    HB2  GLU 105          2HB       GLU 105   9.849  -2.595  -7.984
  795    HB3  GLU 105          1HB       GLU 105   9.330  -1.541  -6.676
  796    HG2  GLU 105          2HG       GLU 105   7.470  -2.603  -8.787
  797    HG3  GLU 105          1HG       GLU 105   7.779  -3.425  -7.262
  798    H    LEU 106           H        LEU 106  10.284  -2.108 -10.425
  799    HA   LEU 106           HA       LEU 106   8.820  -1.220 -12.649
  800    HB2  LEU 106          2HB       LEU 106  10.905  -2.503 -12.816
  801    HB3  LEU 106          1HB       LEU 106  10.097  -3.912 -12.161
  802    HG   LEU 106           HG       LEU 106   8.639  -3.988 -14.153
  803   HD11  LEU 106          1HD1      LEU 106   8.646  -1.629 -14.729
  804   HD12  LEU 106          2HD1      LEU 106   9.188  -2.600 -16.097
  805   HD13  LEU 106          3HD1      LEU 106  10.362  -1.712 -15.124
  806   HD21  LEU 106          1HD2      LEU 106  10.343  -4.741 -15.728
  807   HD22  LEU 106          2HD2      LEU 106  10.703  -5.292 -14.091
  808   HD23  LEU 106          3HD2      LEU 106  11.589  -3.930 -14.778
  809    H    LYS 107           H        LYS 107   8.444  -4.347 -10.986
  810    HA   LYS 107           HA       LYS 107   5.609  -4.089 -10.796
  811    HB2  LYS 107          2HB       LYS 107   5.836  -4.658 -13.198
  812    HB3  LYS 107          1HB       LYS 107   6.689  -6.127 -12.756
  813    HG2  LYS 107          2HG       LYS 107   4.691  -6.937 -11.601
  814    HG3  LYS 107          1HG       LYS 107   3.836  -5.461 -12.056
  815    HD2  LYS 107          2HD       LYS 107   4.135  -6.018 -14.420
  816    HD3  LYS 107          1HD       LYS 107   4.998  -7.487 -13.968
  817    HE2  LYS 107          2HE       LYS 107   2.695  -7.996 -14.543
  818    HE3  LYS 107          1HE       LYS 107   2.991  -8.316 -12.836
  819    HZ1  LYS 107          1HZ       LYS 107   1.892  -6.291 -12.256
  820    HZ2  LYS 107          2HZ       LYS 107   0.872  -7.162 -13.279
  821    HZ3  LYS 107          3HZ       LYS 107   1.733  -5.836 -13.874
  822    H    THR 108           H        THR 108   7.485  -7.034 -11.386
  823    HA   THR 108           HA       THR 108   7.594  -7.572  -8.517
  824    HB   THR 108           HB       THR 108   6.573  -9.694 -10.405
  825    HG1  THR 108          1HG       THR 108   5.239  -7.545  -9.268
  826   HG21  THR 108          1HG2      THR 108   6.364  -9.391  -7.403
  827   HG22  THR 108          2HG2      THR 108   7.527 -10.420  -8.238
  828   HG23  THR 108          3HG2      THR 108   5.801 -10.764  -8.357
  829    H    GLN 109           H        GLN 109   9.644  -6.773 -10.109
  830    HA   GLN 109           HA       GLN 109  11.175  -9.224 -10.652
  831    HB2  GLN 109          2HB       GLN 109  11.513  -6.453 -11.820
  832    HB3  GLN 109          1HB       GLN 109  12.572  -7.818 -12.148
  833    HG2  GLN 109          2HG       GLN 109   9.642  -7.672 -12.820
  834    HG3  GLN 109          1HG       GLN 109  10.972  -7.442 -13.953
  835   HE21  GLN 109          1HE2      GLN 109  12.181  -9.208 -14.612
  836   HE22  GLN 109          2HE2      GLN 109  11.655 -10.836 -14.355
  837    H    LYS 110           H        LYS 110  12.998  -9.561  -9.537
  838    HA   LYS 110           HA       LYS 110  13.990  -7.347  -7.867
  839    HB2  LYS 110          2HB       LYS 110  12.957  -9.260  -6.605
  840    HB3  LYS 110          1HB       LYS 110  14.211 -10.302  -7.255
  841    HG2  LYS 110          2HG       LYS 110  15.008  -7.846  -5.776
  842    HG3  LYS 110          1HG       LYS 110  14.435  -9.248  -4.873
  843    HD2  LYS 110          2HD       LYS 110  16.163 -10.625  -5.799
  844    HD3  LYS 110          1HD       LYS 110  16.664  -9.340  -6.902
  845    HE2  LYS 110          2HE       LYS 110  18.161  -9.551  -4.961
  846    HE3  LYS 110          1HE       LYS 110  17.378  -7.974  -5.040
  847    HZ1  LYS 110          1HZ       LYS 110  15.773  -8.763  -3.390
  848    HZ2  LYS 110          2HZ       LYS 110  17.354  -8.805  -2.801
  849    HZ3  LYS 110          3HZ       LYS 110  16.596 -10.238  -3.285
  850    H    GLY 111           H        GLY 111  14.817 -10.120  -9.874
  851    HA2  GLY 111          2HA       GLY 111  16.603 -10.358 -11.312
  852    HA3  GLY 111          1HA       GLY 111  17.132  -8.749 -10.854
  853    H    PHE 112           H        PHE 112  16.810 -11.956  -9.342
  854    HA   PHE 112           HA       PHE 112  19.416 -11.484  -8.068
  855    HB2  PHE 112          2HB       PHE 112  17.441 -11.923  -6.572
  856    HB3  PHE 112          1HB       PHE 112  17.336 -13.532  -7.276
  857    HD1  PHE 112          1HD       PHE 112  19.753 -11.281  -5.563
  858    HD2  PHE 112          2HD       PHE 112  18.458 -15.270  -6.270
  859    HE1  PHE 112          1HE       PHE 112  21.381 -12.096  -3.911
  860    HE2  PHE 112          2HE       PHE 112  20.082 -16.094  -4.618
  861    HZ   PHE 112           HZ       PHE 112  21.547 -14.508  -3.436
  Start of MODEL    6
    1    H1   GLY   1          1HT       GLY   1   9.193  10.531 -14.437
    2    H2   GLY   1          2HT       GLY   1  10.652  11.006 -13.737
    3    H    GLY   1           H        GLY   1   9.544  10.860 -15.232
    4    H3   GLY   1          3HT       GLY   1  10.308  11.422 -15.337
    5    HA2  GLY   1          1HA       GLY   1   8.865  12.397 -12.938
    6    HA3  GLY   1          2HA       GLY   1  10.010  13.326 -13.895
    7    H    SER   2           H        SER   2   8.324  14.873 -14.247
    8    HA   SER   2           HA       SER   2   6.664  15.878 -15.421
    9    HB2  SER   2          2HB       SER   2   7.148  13.671 -17.435
   10    HB3  SER   2          1HB       SER   2   6.394  15.233 -17.748
   11    HG   SER   2           HG       SER   2   8.642  15.871 -16.681
   12    H    ALA   3           H        ALA   3   5.106  15.339 -13.831
   13    HA   ALA   3           HA       ALA   3   3.077  14.629 -13.129
   14    HB1  ALA   3          1HB       ALA   3   2.345  15.165 -15.408
   15    HB2  ALA   3          2HB       ALA   3   1.463  13.795 -14.735
   16    HB3  ALA   3          3HB       ALA   3   2.745  13.523 -15.914
   17    H    MET   4           H        MET   4   3.689  13.215 -11.589
   18    HA   MET   4           HA       MET   4   4.744  10.629 -12.168
   19    HB2  MET   4          2HB       MET   4   3.715  11.775  -9.568
   20    HB3  MET   4          1HB       MET   4   4.606  10.269  -9.726
   21    HG2  MET   4          2HG       MET   4   5.654  12.996 -10.450
   22    HG3  MET   4          1HG       MET   4   6.012  12.124  -8.962
   23    HE1  MET   4          1HE       MET   4   8.137   9.114 -10.202
   24    HE2  MET   4          2HE       MET   4   6.413   9.161  -9.840
   25    HE3  MET   4          3HE       MET   4   7.556  10.012  -8.801
   26    H    GLY   5           H        GLY   5   1.612  11.854 -11.109
   27    HA2  GLY   5          2HA       GLY   5  -0.490  10.961 -11.386
   28    HA3  GLY   5          1HA       GLY   5   0.233   9.657 -12.316
   29    H    HIS   6           H        HIS   6   1.865   9.805  -9.479
   30    HA   HIS   6           HA       HIS   6   0.061   8.008  -8.034
   31    HB2  HIS   6          2HB       HIS   6   2.908   7.315  -8.804
   32    HB3  HIS   6          1HB       HIS   6   1.925   6.391  -7.683
   33    HD1  HIS   6          1HD       HIS   6   2.492   7.000 -11.309
   34    HD2  HIS   6          2HD       HIS   6  -0.086   4.815  -8.889
   35    HE1  HIS   6          1HE       HIS   6   1.371   5.346 -12.834
   36    HE2  HIS   6          2HE       HIS   6  -0.192   4.042 -11.354
   37    H    MET   7           H        MET   7   1.168  10.767  -7.668
   38    HA   MET   7           HA       MET   7   2.562  10.312  -5.127
   39    HB2  MET   7          2HB       MET   7   4.264  10.776  -6.811
   40    HB3  MET   7          1HB       MET   7   3.425  12.245  -7.282
   41    HG2  MET   7          2HG       MET   7   3.893  13.261  -5.165
   42    HG3  MET   7          1HG       MET   7   4.579  11.759  -4.549
   43    HE1  MET   7          1HE       MET   7   6.293  10.695  -6.989
   44    HE2  MET   7          2HE       MET   7   6.868  10.740  -5.323
   45    HE3  MET   7          3HE       MET   7   7.863  11.408  -6.616
   46    H    VAL   8           H        VAL   8   1.944  11.567  -3.503
   47    HA   VAL   8           HA       VAL   8   0.677  14.114  -3.980
   48    HB   VAL   8           HB       VAL   8  -1.346  13.006  -3.824
   49   HG11  VAL   8          1HG1      VAL   8  -1.844  11.101  -2.454
   50   HG12  VAL   8          2HG1      VAL   8  -0.290  11.224  -1.638
   51   HG13  VAL   8          3HG1      VAL   8  -0.354  10.781  -3.343
   52   HG21  VAL   8          1HG2      VAL   8  -2.303  13.473  -1.634
   53   HG22  VAL   8          2HG2      VAL   8  -1.208  14.772  -2.108
   54   HG23  VAL   8          3HG2      VAL   8  -0.688  13.569  -0.919
   55    H    LYS   9           H        LYS   9   1.151  11.907  -1.410
   56    HA   LYS   9           HA       LYS   9   2.698  13.888   0.068
   57    HB2  LYS   9          2HB       LYS   9   0.339  13.031   0.769
   58    HB3  LYS   9          1HB       LYS   9   1.189  11.597   1.306
   59    HG2  LYS   9          2HG       LYS   9   0.630  13.500   2.875
   60    HG3  LYS   9          1HG       LYS   9   2.180  12.683   3.044
   61    HD2  LYS   9          2HD       LYS   9   2.553  15.044   3.245
   62    HD3  LYS   9          1HD       LYS   9   3.161  14.555   1.666
   63    HE2  LYS   9          2HE       LYS   9   1.962  16.446   1.126
   64    HE3  LYS   9          1HE       LYS   9   0.763  15.176   0.876
   65    HZ1  LYS   9          1HZ       LYS   9  -0.232  15.659   2.967
   66    HZ2  LYS   9          2HZ       LYS   9  -0.077  17.117   2.120
   67    HZ3  LYS   9          3HZ       LYS   9   0.997  16.752   3.373
   68    H    ILE  10           H        ILE  10   3.811  12.230  -1.861
   69    HA   ILE  10           HA       ILE  10   5.014  10.017  -0.402
   70    HB   ILE  10           HB       ILE  10   4.215  10.111  -3.311
   71   HG12  ILE  10          2HG1      ILE  10   3.127   8.467  -1.019
   72   HG13  ILE  10          1HG1      ILE  10   2.307   9.820  -1.790
   73   HG21  ILE  10          1HG2      ILE  10   5.420   7.834  -1.756
   74   HG22  ILE  10          2HG2      ILE  10   6.300   8.864  -2.885
   75   HG23  ILE  10          3HG2      ILE  10   4.986   7.844  -3.464
   76   HD11  ILE  10          1HD1      ILE  10   1.434   7.692  -2.564
   77   HD12  ILE  10          2HD1      ILE  10   3.044   7.217  -3.110
   78   HD13  ILE  10          3HD1      ILE  10   2.213   8.569  -3.880
   79    H    SER  11           H        SER  11   6.986  10.904   0.049
   80    HA   SER  11           HA       SER  11   8.625  11.784  -2.208
   81    HB2  SER  11          2HB       SER  11   8.746  12.921   0.057
   82    HB3  SER  11          1HB       SER  11   9.435  11.427   0.696
   83    HG   SER  11           HG       SER  11  11.242  12.330   0.101
   84    H    HIS  12           H        HIS  12  11.043  10.632  -1.715
   85    HA   HIS  12           HA       HIS  12  10.892   8.057  -2.740
   86    HB2  HIS  12          2HB       HIS  12  13.014   9.243  -0.937
   87    HB3  HIS  12          1HB       HIS  12  13.189   7.712  -1.785
   88    HD1  HIS  12          1HD       HIS  12  13.572  11.343  -2.240
   89    HD2  HIS  12          2HD       HIS  12  13.347   7.950  -4.632
   90    HE1  HIS  12          1HE       HIS  12  14.406  12.056  -4.499
   91    HE2  HIS  12          2HE       HIS  12  14.297   9.985  -5.932
   92    H    GLU  13           H        GLU  13  11.235   9.121   0.581
   93    HA   GLU  13           HA       GLU  13  11.408   6.576   1.731
   94    HB2  GLU  13          2HB       GLU  13  11.038   7.742   3.860
   95    HB3  GLU  13          1HB       GLU  13  12.208   8.581   2.837
   96    HG2  GLU  13          2HG       GLU  13  10.294  10.065   2.100
   97    HG3  GLU  13          1HG       GLU  13   9.371   9.358   3.425
   98    H    ASP  14           H        ASP  14   8.592   8.549   0.858
   99    HA   ASP  14           HA       ASP  14   6.894   7.163   2.691
  100    HB2  ASP  14          2HB       ASP  14   6.197   8.966   0.391
  101    HB3  ASP  14          1HB       ASP  14   5.083   8.408   1.635
  102    H    THR  15           H        THR  15   7.416   6.978  -0.843
  103    HA   THR  15           HA       THR  15   5.450   5.000  -1.285
  104    HB   THR  15           HB       THR  15   7.598   4.493  -3.042
  105    HG1  THR  15          1HG       THR  15   7.147   7.175  -3.392
  106   HG21  THR  15          1HG2      THR  15   6.054   5.642  -4.681
  107   HG22  THR  15          2HG2      THR  15   4.986   5.954  -3.311
  108   HG23  THR  15          3HG2      THR  15   5.364   4.297  -3.773
  109    H    GLN  16           H        GLN  16   8.878   4.808  -0.425
  110    HA   GLN  16           HA       GLN  16   9.160   2.023  -0.443
  111    HB2  GLN  16          2HB       GLN  16  10.477   4.072   1.364
  112    HB3  GLN  16          1HB       GLN  16  10.999   2.398   1.193
  113    HG2  GLN  16          2HG       GLN  16  11.557   2.748  -1.114
  114    HG3  GLN  16          1HG       GLN  16  10.882   4.371  -1.070
  115   HE21  GLN  16          1HE2      GLN  16  12.822   3.006   1.496
  116   HE22  GLN  16          2HE2      GLN  16  14.192   4.031   1.259
  117    H    ARG  17           H        ARG  17   7.944   4.259   1.967
  118    HA   ARG  17           HA       ARG  17   7.582   2.481   4.098
  119    HB2  ARG  17          2HB       ARG  17   6.388   5.099   3.306
  120    HB3  ARG  17          1HB       ARG  17   5.658   4.200   4.627
  121    HG2  ARG  17          2HG       ARG  17   7.429   4.523   6.010
  122    HG3  ARG  17          1HG       ARG  17   8.583   4.613   4.683
  123    HD2  ARG  17          2HD       ARG  17   8.132   6.822   4.247
  124    HD3  ARG  17          1HD       ARG  17   6.537   6.754   5.007
  125    HE   ARG  17           HE       ARG  17   8.322   6.286   7.035
  126   HH11  ARG  17          1HH1      ARG  17   7.655   8.892   4.791
  127   HH12  ARG  17          2HH1      ARG  17   8.360  10.106   5.809
  128   HH21  ARG  17          1HH2      ARG  17   9.196   7.899   8.396
  129   HH22  ARG  17          2HH2      ARG  17   9.213   9.548   7.859
  130    H    ILE  18           H        ILE  18   5.240   3.581   1.623
  131    HA   ILE  18           HA       ILE  18   3.078   2.154   2.661
  132    HB   ILE  18           HB       ILE  18   3.543   2.983  -0.197
  133   HG12  ILE  18          2HG1      ILE  18   1.628   4.477   1.424
  134   HG13  ILE  18          1HG1      ILE  18   3.267   4.554   2.067
  135   HG21  ILE  18          1HG2      ILE  18   1.063   2.873  -0.329
  136   HG22  ILE  18          2HG2      ILE  18   1.056   2.119   1.269
  137   HG23  ILE  18          3HG2      ILE  18   1.835   1.306  -0.090
  138   HD11  ILE  18          1HD1      ILE  18   2.690   6.380   0.500
  139   HD12  ILE  18          2HD1      ILE  18   2.552   5.174  -0.781
  140   HD13  ILE  18          3HD1      ILE  18   4.099   5.429   0.034
  141    H    LYS  19           H        LYS  19   5.319   1.206   0.031
  142    HA   LYS  19           HA       LYS  19   4.059  -1.261  -0.529
  143    HB2  LYS  19          2HB       LYS  19   7.032  -0.818  -0.707
  144    HB3  LYS  19          1HB       LYS  19   6.027  -1.876  -1.692
  145    HG2  LYS  19          2HG       LYS  19   5.009  -0.040  -2.825
  146    HG3  LYS  19          1HG       LYS  19   5.782   1.121  -1.750
  147    HD2  LYS  19          2HD       LYS  19   6.947   1.135  -3.827
  148    HD3  LYS  19          1HD       LYS  19   7.990   0.365  -2.637
  149    HE2  LYS  19          2HE       LYS  19   6.230  -1.160  -4.522
  150    HE3  LYS  19          1HE       LYS  19   7.866  -0.678  -4.949
  151    HZ1  LYS  19          1HZ       LYS  19   8.534  -1.873  -2.809
  152    HZ2  LYS  19          2HZ       LYS  19   8.105  -2.822  -4.147
  153    HZ3  LYS  19          3HZ       LYS  19   7.003  -2.604  -2.886
  154    H    THR  20           H        THR  20   6.755  -0.380   1.565
  155    HA   THR  20           HA       THR  20   7.520  -2.994   2.068
  156    HB   THR  20           HB       THR  20   8.967  -0.955   2.390
  157    HG1  THR  20          1HG       THR  20  10.142  -2.390   3.367
  158   HG21  THR  20          1HG2      THR  20   7.545  -0.796   5.052
  159   HG22  THR  20          2HG2      THR  20   7.384   0.370   3.742
  160   HG23  THR  20          3HG2      THR  20   8.937   0.167   4.555
  161    H    ALA  21           H        ALA  21   5.381  -0.813   3.819
  162    HA   ALA  21           HA       ALA  21   5.205  -2.514   6.082
  163    HB1  ALA  21          1HB       ALA  21   3.460  -0.223   5.203
  164    HB2  ALA  21          2HB       ALA  21   4.830  -0.137   6.313
  165    HB3  ALA  21          3HB       ALA  21   3.372  -1.013   6.777
  166    H    PHE  22           H        PHE  22   2.833  -1.605   3.621
  167    HA   PHE  22           HA       PHE  22   0.727  -3.196   4.248
  168    HB2  PHE  22          2HB       PHE  22   0.221  -1.895   2.523
  169    HB3  PHE  22          1HB       PHE  22   1.860  -1.874   1.921
  170    HD1  PHE  22          1HD       PHE  22  -1.247  -3.846   1.915
  171    HD2  PHE  22          2HD       PHE  22   2.400  -2.953  -0.035
  172    HE1  PHE  22          1HE       PHE  22  -2.042  -5.074  -0.111
  173    HE2  PHE  22          2HE       PHE  22   1.669  -4.193  -2.014
  174    HZ   PHE  22           HZ       PHE  22  -0.556  -5.245  -2.063
  175    H    LEU  23           H        LEU  23   3.325  -4.320   2.005
  176    HA   LEU  23           HA       LEU  23   2.293  -6.921   1.705
  177    HB2  LEU  23          2HB       LEU  23   5.186  -6.086   1.537
  178    HB3  LEU  23          1HB       LEU  23   4.449  -7.485   0.777
  179    HG   LEU  23           HG       LEU  23   3.465  -4.750   0.092
  180   HD11  LEU  23          1HD1      LEU  23   5.126  -4.667  -1.719
  181   HD12  LEU  23          2HD1      LEU  23   5.915  -6.092  -1.040
  182   HD13  LEU  23          3HD1      LEU  23   5.867  -4.586  -0.118
  183   HD21  LEU  23          1HD2      LEU  23   3.092  -5.903  -2.091
  184   HD22  LEU  23          2HD2      LEU  23   2.173  -6.571  -0.739
  185   HD23  LEU  23          3HD2      LEU  23   3.619  -7.405  -1.325
  186    H    SER  24           H        SER  24   5.027  -5.798   3.722
  187    HA   SER  24           HA       SER  24   5.647  -8.359   4.704
  188    HB2  SER  24          2HB       SER  24   7.335  -6.780   4.606
  189    HB3  SER  24          1HB       SER  24   6.447  -5.624   5.594
  190    HG   SER  24           HG       SER  24   8.213  -7.055   6.550
  191    H    TYR  25           H        TYR  25   3.490  -5.909   5.746
  192    HA   TYR  25           HA       TYR  25   3.261  -6.667   8.454
  193    HB2  TYR  25          2HB       TYR  25   1.734  -4.893   6.591
  194    HB3  TYR  25          1HB       TYR  25   0.891  -5.500   8.028
  195    HD1  TYR  25          1HD       TYR  25   4.279  -4.116   7.267
  196    HD2  TYR  25          2HD       TYR  25   0.927  -4.127   9.872
  197    HE1  TYR  25          1HE       TYR  25   5.369  -2.417   8.641
  198    HE2  TYR  25          2HE       TYR  25   2.006  -2.423  11.275
  199    HH   TYR  25           HH       TYR  25   4.198  -1.543  11.757
  200    H    ALA  26           H        ALA  26   1.269  -7.393   5.589
  201    HA   ALA  26           HA       ALA  26  -0.588  -8.882   7.156
  202    HB1  ALA  26          1HB       ALA  26  -1.650  -9.417   5.121
  203    HB2  ALA  26          2HB       ALA  26  -0.180  -9.118   4.194
  204    HB3  ALA  26          3HB       ALA  26  -1.032  -7.774   4.955
  205    H    GLN  27           H        GLN  27   1.460 -10.140   4.487
  206    HA   GLN  27           HA       GLN  27   1.793 -12.536   6.159
  207    HB2  GLN  27          2HB       GLN  27   2.140 -12.816   3.234
  208    HB3  GLN  27          1HB       GLN  27   1.528 -13.977   4.409
  209    HG2  GLN  27          2HG       GLN  27  -0.358 -13.532   3.189
  210    HG3  GLN  27          1HG       GLN  27  -0.537 -12.342   4.485
  211   HE21  GLN  27          1HE2      GLN  27  -1.558 -12.293   1.736
  212   HE22  GLN  27          2HE2      GLN  27  -0.919 -10.840   1.038
  213    H    GLY  28           H        GLY  28   3.343 -10.111   4.250
  214    HA2  GLY  28          2HA       GLY  28   5.708  -9.918   3.951
  215    HA3  GLY  28          1HA       GLY  28   5.864 -11.628   4.315
  216    H    GLN  29           H        GLN  29   3.357 -11.932   2.495
  217    HA   GLN  29           HA       GLN  29   4.823 -12.602   0.126
  218    HB2  GLN  29          2HB       GLN  29   1.836 -12.588   0.550
  219    HB3  GLN  29          1HB       GLN  29   2.729 -13.486  -0.673
  220    HG2  GLN  29          2HG       GLN  29   3.777 -14.835   1.025
  221    HG3  GLN  29          1HG       GLN  29   2.998 -13.885   2.290
  222   HE21  GLN  29          1HE2      GLN  29   0.491 -13.729   0.723
  223   HE22  GLN  29          2HE2      GLN  29  -0.250 -15.280   0.899
  224    H    ASP  30           H        ASP  30   3.007 -12.072  -1.912
  225    HA   ASP  30           HA       ASP  30   3.858  -9.353  -2.483
  226    HB2  ASP  30          2HB       ASP  30   3.759 -11.673  -3.968
  227    HB3  ASP  30          1HB       ASP  30   2.384 -10.752  -4.583
  228    H    LYS  31           H        LYS  31   1.156 -10.651  -1.164
  229    HA   LYS  31           HA       LYS  31  -0.479  -8.383  -2.055
  230    HB2  LYS  31          2HB       LYS  31  -1.399 -11.236  -1.647
  231    HB3  LYS  31          1HB       LYS  31  -2.499  -9.872  -1.665
  232    HG2  LYS  31          2HG       LYS  31  -1.306  -9.420  -3.977
  233    HG3  LYS  31          1HG       LYS  31  -1.030 -11.150  -3.895
  234    HD2  LYS  31          2HD       LYS  31  -3.694  -9.728  -3.704
  235    HD3  LYS  31          1HD       LYS  31  -3.125 -10.708  -5.066
  236    HE2  LYS  31          2HE       LYS  31  -2.999 -12.602  -3.345
  237    HE3  LYS  31          1HE       LYS  31  -3.932 -11.511  -2.318
  238    HZ1  LYS  31          1HZ       LYS  31  -5.639 -11.423  -4.040
  239    HZ2  LYS  31          2HZ       LYS  31  -5.407 -12.996  -3.467
  240    HZ3  LYS  31          3HZ       LYS  31  -4.769 -12.539  -4.966
  241    H    VAL  32           H        VAL  32  -2.523  -8.557  -0.324
  242    HA   VAL  32           HA       VAL  32  -1.301  -9.014   2.294
  243    HB   VAL  32           HB       VAL  32  -2.521  -6.483   1.311
  244   HG11  VAL  32          1HG1      VAL  32  -2.631  -7.499   4.126
  245   HG12  VAL  32          2HG1      VAL  32  -3.937  -6.831   3.152
  246   HG13  VAL  32          3HG1      VAL  32  -2.644  -5.783   3.733
  247   HG21  VAL  32          1HG2      VAL  32  -0.670  -5.574   2.597
  248   HG22  VAL  32          2HG2      VAL  32  -0.133  -6.744   1.390
  249   HG23  VAL  32          3HG2      VAL  32  -0.222  -7.205   3.093
  250    H    THR  33           H        THR  33  -2.485 -10.024   3.713
  251    HA   THR  33           HA       THR  33  -5.093 -10.940   3.105
  252    HB   THR  33           HB       THR  33  -5.089 -11.659   5.525
  253    HG1  THR  33          1HG       THR  33  -3.630 -10.811   6.798
  254   HG21  THR  33          1HG2      THR  33  -4.274 -13.133   3.744
  255   HG22  THR  33          2HG2      THR  33  -3.357 -13.359   5.232
  256   HG23  THR  33          3HG2      THR  33  -2.664 -12.434   3.902
  257    H    GLU  34           H        GLU  34  -6.958 -10.415   4.576
  258    HA   GLU  34           HA       GLU  34  -7.391  -7.759   3.840
  259    HB2  GLU  34          2HB       GLU  34  -9.683  -8.153   5.029
  260    HB3  GLU  34          1HB       GLU  34  -9.249  -8.853   3.465
  261    HG2  GLU  34          2HG       GLU  34 -10.326 -10.532   4.758
  262    HG3  GLU  34          1HG       GLU  34  -8.621 -10.936   4.655
  263    H    ALA  35           H        ALA  35  -6.334  -8.888   6.857
  264    HA   ALA  35           HA       ALA  35  -7.533  -7.034   8.604
  265    HB1  ALA  35          1HB       ALA  35  -5.751  -7.590  10.163
  266    HB2  ALA  35          2HB       ALA  35  -4.842  -8.370   8.868
  267    HB3  ALA  35          3HB       ALA  35  -6.384  -9.050   9.399
  268    H    MET  36           H        MET  36  -4.365  -7.005   6.973
  269    HA   MET  36           HA       MET  36  -3.706  -4.383   7.819
  270    HB2  MET  36          2HB       MET  36  -2.667  -6.305   5.794
  271    HB3  MET  36          1HB       MET  36  -2.157  -4.631   5.700
  272    HG2  MET  36          2HG       MET  36  -1.866  -6.427   8.090
  273    HG3  MET  36          1HG       MET  36  -0.580  -5.976   6.966
  274    HE1  MET  36          1HE       MET  36  -0.639  -2.032   7.504
  275    HE2  MET  36          2HE       MET  36  -1.787  -2.903   6.484
  276    HE3  MET  36          3HE       MET  36  -0.078  -3.340   6.461
  277    H    ILE  37           H        ILE  37  -5.634  -5.740   5.302
  278    HA   ILE  37           HA       ILE  37  -5.598  -3.416   3.624
  279    HB   ILE  37           HB       ILE  37  -7.065  -5.960   3.682
  280   HG12  ILE  37          2HG1      ILE  37  -5.615  -6.286   2.010
  281   HG13  ILE  37          1HG1      ILE  37  -6.379  -4.986   1.134
  282   HG21  ILE  37          1HG2      ILE  37  -8.079  -3.587   2.142
  283   HG22  ILE  37          2HG2      ILE  37  -8.899  -4.376   3.489
  284   HG23  ILE  37          3HG2      ILE  37  -8.641  -5.253   1.982
  285   HD11  ILE  37          1HD1      ILE  37  -3.953  -4.731   1.349
  286   HD12  ILE  37          2HD1      ILE  37  -4.169  -4.555   3.090
  287   HD13  ILE  37          3HD1      ILE  37  -4.881  -3.377   1.982
  288    H    ASP  38           H        ASP  38  -7.561  -4.615   6.275
  289    HA   ASP  38           HA       ASP  38  -9.582  -2.724   6.345
  290    HB2  ASP  38          2HB       ASP  38  -9.215  -4.912   7.592
  291    HB3  ASP  38          1HB       ASP  38  -8.260  -3.972   8.730
  292    H    GLN  39           H        GLN  39  -6.285  -2.616   7.729
  293    HA   GLN  39           HA       GLN  39  -6.669  -0.311   9.298
  294    HB2  GLN  39          2HB       GLN  39  -4.359  -0.182   9.571
  295    HB3  GLN  39          1HB       GLN  39  -4.605  -1.873   9.202
  296    HG2  GLN  39          2HG       GLN  39  -2.844  -1.531   7.859
  297    HG3  GLN  39          1HG       GLN  39  -4.087  -1.007   6.739
  298   HE21  GLN  39          1HE2      GLN  39  -4.124   1.126   6.117
  299   HE22  GLN  39          2HE2      GLN  39  -2.895   2.260   6.537
  300    H    LEU  40           H        LEU  40  -5.652  -0.742   5.980
  301    HA   LEU  40           HA       LEU  40  -5.405   2.045   5.451
  302    HB2  LEU  40          2HB       LEU  40  -4.255   0.336   4.147
  303    HB3  LEU  40          1HB       LEU  40  -5.803  -0.245   3.528
  304    HG   LEU  40           HG       LEU  40  -5.842   2.422   2.863
  305   HD11  LEU  40          1HD1      LEU  40  -3.785   3.244   2.580
  306   HD12  LEU  40          2HD1      LEU  40  -3.175   1.727   1.917
  307   HD13  LEU  40          3HD1      LEU  40  -3.280   1.944   3.667
  308   HD21  LEU  40          1HD2      LEU  40  -5.348   1.651   0.588
  309   HD22  LEU  40          2HD2      LEU  40  -6.477   0.571   1.405
  310   HD23  LEU  40          3HD2      LEU  40  -4.783   0.111   1.236
  311    H    ILE  41           H        ILE  41  -7.935  -0.307   4.551
  312    HA   ILE  41           HA       ILE  41  -9.497   1.597   3.186
  313    HB   ILE  41           HB       ILE  41 -10.183  -1.089   4.353
  314   HG12  ILE  41          2HG1      ILE  41  -8.618  -0.842   2.372
  315   HG13  ILE  41          1HG1      ILE  41 -10.018  -1.866   2.102
  316   HG21  ILE  41          1HG2      ILE  41 -12.287  -1.000   3.106
  317   HG22  ILE  41          2HG2      ILE  41 -11.948   0.672   2.657
  318   HG23  ILE  41          3HG2      ILE  41 -12.218   0.252   4.349
  319   HD11  ILE  41          1HD1      ILE  41  -9.661   0.974   1.183
  320   HD12  ILE  41          2HD1      ILE  41 -11.118   0.009   0.947
  321   HD13  ILE  41          3HD1      ILE  41  -9.605  -0.475   0.180
  322    H    CYS  42           H        CYS  42  -9.617   0.508   6.560
  323    HA   CYS  42           HA       CYS  42 -12.010   1.963   7.152
  324    HB2  CYS  42          2HB       CYS  42 -11.350  -0.045   8.426
  325    HB3  CYS  42          1HB       CYS  42  -9.930   0.804   9.020
  326    HG   CYS  42           HG       CYS  42 -11.738   2.833  10.191
  327    H    GLY  43           H        GLY  43  -8.676   2.698   6.931
  328    HA2  GLY  43          2HA       GLY  43  -8.368   4.871   8.622
  329    HA3  GLY  43          1HA       GLY  43  -7.570   4.700   7.069
  330    H    ALA  44           H        ALA  44  -9.403   5.077   5.182
  331    HA   ALA  44           HA       ALA  44 -10.096   7.874   5.637
  332    HB1  ALA  44          1HB       ALA  44 -10.351   8.057   3.248
  333    HB2  ALA  44          2HB       ALA  44 -10.228   6.308   3.064
  334    HB3  ALA  44          3HB       ALA  44  -8.831   7.236   3.608
  335    H    PHE  45           H        PHE  45 -11.701   4.905   4.480
  336    HA   PHE  45           HA       PHE  45 -14.231   6.145   5.325
  337    HB2  PHE  45          2HB       PHE  45 -14.983   4.129   3.653
  338    HB3  PHE  45          1HB       PHE  45 -15.018   5.865   3.324
  339    HD1  PHE  45          1HD       PHE  45 -12.555   3.089   3.318
  340    HD2  PHE  45          2HD       PHE  45 -14.060   6.504   1.295
  341    HE1  PHE  45          1HE       PHE  45 -10.966   2.687   1.476
  342    HE2  PHE  45          2HE       PHE  45 -12.464   6.129  -0.544
  343    HZ   PHE  45           HZ       PHE  45 -10.908   4.215  -0.451
  344    HA   PRO  46           HA       PRO  46 -14.149   2.480   7.797
  345    HB2  PRO  46          2HB       PRO  46 -14.875   3.659  10.076
  346    HB3  PRO  46          1HB       PRO  46 -13.239   3.793   9.443
  347    HG2  PRO  46          2HG       PRO  46 -15.451   5.788   9.393
  348    HG3  PRO  46          1HG       PRO  46 -13.709   6.054   9.555
  349    HD2  PRO  46          2HD       PRO  46 -15.222   6.274   7.165
  350    HD3  PRO  46          1HD       PRO  46 -13.450   6.237   7.303
  351    H    GLY  47           H        GLY  47 -15.891   1.545   9.244
  352    HA2  GLY  47          2HA       GLY  47 -18.114   1.174   9.817
  353    HA3  GLY  47          1HA       GLY  47 -18.570   2.579   8.864
  354    H    LEU  48           H        LEU  48 -16.552   0.162   7.433
  355    HA   LEU  48           HA       LEU  48 -18.689  -0.469   5.558
  356    HB2  LEU  48          2HB       LEU  48 -15.795  -1.324   5.556
  357    HB3  LEU  48          1HB       LEU  48 -16.942  -1.604   4.265
  358    HG   LEU  48           HG       LEU  48 -15.802   1.045   5.146
  359   HD11  LEU  48          1HD1      LEU  48 -14.316  -0.277   3.784
  360   HD12  LEU  48          2HD1      LEU  48 -14.950   1.067   2.833
  361   HD13  LEU  48          3HD1      LEU  48 -15.595  -0.560   2.607
  362   HD21  LEU  48          1HD2      LEU  48 -17.906   0.486   3.059
  363   HD22  LEU  48          2HD2      LEU  48 -17.122   2.038   3.343
  364   HD23  LEU  48          3HD2      LEU  48 -18.157   1.333   4.584
  365    H    SER  49           H        SER  49 -19.925  -2.207   5.817
  366    HA   SER  49           HA       SER  49 -19.192  -4.393   7.518
  367    HB2  SER  49          2HB       SER  49 -21.568  -3.720   7.093
  368    HB3  SER  49          1HB       SER  49 -21.384  -4.260   5.422
  369    HG   SER  49           HG       SER  49 -22.043  -6.092   6.232
  370    H    TRP  50           H        TRP  50 -19.039  -6.696   6.575
  371    HA   TRP  50           HA       TRP  50 -16.782  -6.750   4.957
  372    HB2  TRP  50          2HB       TRP  50 -17.348  -8.650   6.386
  373    HB3  TRP  50          1HB       TRP  50 -18.753  -9.000   5.384
  374    HD1  TRP  50           HD       TRP  50 -14.919  -8.768   4.864
  375    HE1  TRP  50          1HE       TRP  50 -14.286 -10.560   3.125
  376    HE3  TRP  50          3HE       TRP  50 -19.580 -10.557   3.843
  377    HZ2  TRP  50          2HZ       TRP  50 -15.614 -12.475   1.568
  378    HZ3  TRP  50          3HZ       TRP  50 -19.815 -12.364   2.200
  379    HH2  TRP  50           HH       TRP  50 -17.865 -13.319   1.085
  380    H    GLU  51           H        GLU  51 -20.153  -7.328   4.035
  381    HA   GLU  51           HA       GLU  51 -19.705  -7.952   1.349
  382    HB2  GLU  51          2HB       GLU  51 -22.055  -6.577   2.645
  383    HB3  GLU  51          1HB       GLU  51 -22.049  -7.157   0.987
  384    HG2  GLU  51          2HG       GLU  51 -21.682  -9.431   1.782
  385    HG3  GLU  51          1HG       GLU  51 -21.682  -8.859   3.435
  386    H    GLN  52           H        GLN  52 -20.088  -4.830   2.928
  387    HA   GLN  52           HA       GLN  52 -20.138  -3.275   0.553
  388    HB2  GLN  52          2HB       GLN  52 -21.032  -2.450   2.673
  389    HB3  GLN  52          1HB       GLN  52 -19.433  -2.523   3.397
  390    HG2  GLN  52          2HG       GLN  52 -19.912  -0.257   2.865
  391    HG3  GLN  52          1HG       GLN  52 -18.673  -0.833   1.751
  392   HE21  GLN  52          1HE2      GLN  52 -19.163  -1.074  -0.415
  393   HE22  GLN  52          2HE2      GLN  52 -20.598  -0.407  -1.115
  394    H    LEU  53           H        LEU  53 -17.588  -4.411   2.673
  395    HA   LEU  53           HA       LEU  53 -15.563  -2.758   1.485
  396    HB2  LEU  53          2HB       LEU  53 -15.432  -3.413   3.833
  397    HB3  LEU  53          1HB       LEU  53 -15.349  -5.098   3.377
  398    HG   LEU  53           HG       LEU  53 -13.232  -3.209   2.412
  399   HD11  LEU  53          1HD1      LEU  53 -13.306  -4.525   5.123
  400   HD12  LEU  53          2HD1      LEU  53 -13.389  -2.792   4.804
  401   HD13  LEU  53          3HD1      LEU  53 -11.920  -3.690   4.420
  402   HD21  LEU  53          1HD2      LEU  53 -11.851  -5.262   2.610
  403   HD22  LEU  53          2HD2      LEU  53 -13.202  -5.434   1.489
  404   HD23  LEU  53          3HD2      LEU  53 -13.296  -6.146   3.101
  405    H    GLN  54           H        GLN  54 -16.589  -6.128   1.233
  406    HA   GLN  54           HA       GLN  54 -14.456  -7.040  -0.320
  407    HB2  GLN  54          2HB       GLN  54 -15.703  -8.963  -0.740
  408    HB3  GLN  54          1HB       GLN  54 -16.277  -8.407   0.807
  409    HG2  GLN  54          2HG       GLN  54 -18.314  -7.688  -0.058
  410    HG3  GLN  54          1HG       GLN  54 -17.712  -7.689  -1.714
  411   HE21  GLN  54          1HE2      GLN  54 -19.007  -9.629   0.866
  412   HE22  GLN  54          2HE2      GLN  54 -19.258 -11.050  -0.078
  413    H    GLU  55           H        GLU  55 -17.488  -5.465  -1.223
  414    HA   GLU  55           HA       GLU  55 -16.937  -5.632  -4.026
  415    HB2  GLU  55          2HB       GLU  55 -18.912  -4.243  -4.321
  416    HB3  GLU  55          1HB       GLU  55 -19.235  -5.563  -3.213
  417    HG2  GLU  55          2HG       GLU  55 -20.161  -3.990  -1.946
  418    HG3  GLU  55          1HG       GLU  55 -18.529  -3.584  -1.494
  419    H    LYS  56           H        LYS  56 -16.296  -3.337  -1.487
  420    HA   LYS  56           HA       LYS  56 -15.668  -1.003  -2.743
  421    HB2  LYS  56          2HB       LYS  56 -14.616  -2.450  -0.412
  422    HB3  LYS  56          1HB       LYS  56 -13.476  -1.299  -1.101
  423    HG2  LYS  56          2HG       LYS  56 -16.282  -0.696  -0.143
  424    HG3  LYS  56          1HG       LYS  56 -14.789  -0.331   0.720
  425    HD2  LYS  56          2HD       LYS  56 -14.113   1.118  -1.180
  426    HD3  LYS  56          1HD       LYS  56 -15.692   0.827  -1.913
  427    HE2  LYS  56          2HE       LYS  56 -16.744   1.738   0.154
  428    HE3  LYS  56          1HE       LYS  56 -15.132   2.159   0.733
  429    HZ1  LYS  56          1HZ       LYS  56 -16.460   3.210  -1.704
  430    HZ2  LYS  56          2HZ       LYS  56 -14.870   3.561  -1.253
  431    HZ3  LYS  56          3HZ       LYS  56 -16.156   4.064  -0.276
  432    H    LYS  57           H        LYS  57 -13.427  -3.706  -2.294
  433    HA   LYS  57           HA       LYS  57 -11.732  -2.525  -4.381
  434    HB2  LYS  57          2HB       LYS  57 -10.491  -4.560  -2.701
  435    HB3  LYS  57          1HB       LYS  57  -9.934  -2.955  -3.135
  436    HG2  LYS  57          2HG       LYS  57 -10.184  -2.641  -0.925
  437    HG3  LYS  57          1HG       LYS  57 -11.812  -2.235  -1.422
  438    HD2  LYS  57          2HD       LYS  57 -11.619  -3.768   0.567
  439    HD3  LYS  57          1HD       LYS  57 -12.645  -4.336  -0.746
  440    HE2  LYS  57          2HE       LYS  57  -9.806  -5.186  -0.829
  441    HE3  LYS  57          1HE       LYS  57 -10.786  -5.857   0.466
  442    HZ1  LYS  57          1HZ       LYS  57 -12.330  -6.743  -1.111
  443    HZ2  LYS  57          2HZ       LYS  57 -10.781  -7.224  -1.582
  444    HZ3  LYS  57          3HZ       LYS  57 -11.559  -5.969  -2.400
  445    H    LYS  58           H        LYS  58 -14.019  -4.594  -4.537
  446    HA   LYS  58           HA       LYS  58 -13.066  -7.125  -5.138
  447    HB2  LYS  58          2HB       LYS  58 -15.103  -7.486  -6.398
  448    HB3  LYS  58          1HB       LYS  58 -15.452  -6.577  -4.935
  449    HG2  LYS  58          2HG       LYS  58 -15.526  -4.509  -6.245
  450    HG3  LYS  58          1HG       LYS  58 -15.197  -5.435  -7.709
  451    HD2  LYS  58          2HD       LYS  58 -17.588  -5.832  -5.914
  452    HD3  LYS  58          1HD       LYS  58 -17.595  -4.898  -7.408
  453    HE2  LYS  58          2HE       LYS  58 -16.951  -6.908  -8.656
  454    HE3  LYS  58          1HE       LYS  58 -16.972  -7.837  -7.157
  455    HZ1  LYS  58          1HZ       LYS  58 -19.021  -8.097  -8.434
  456    HZ2  LYS  58          2HZ       LYS  58 -19.311  -6.433  -8.324
  457    HZ3  LYS  58          3HZ       LYS  58 -19.316  -7.386  -6.927
  458    H    GLY  59           H        GLY  59 -12.661  -4.244  -6.985
  459    HA2  GLY  59          2HA       GLY  59 -12.443  -5.158  -9.586
  460    HA3  GLY  59          1HA       GLY  59 -11.487  -3.845  -8.922
  461    H    ARG  60           H        ARG  60  -9.779  -4.957  -7.206
  462    HA   ARG  60           HA       ARG  60  -8.467  -7.045  -8.798
  463    HB2  ARG  60          2HB       ARG  60  -7.569  -4.658  -9.101
  464    HB3  ARG  60          1HB       ARG  60  -6.906  -4.847  -7.483
  465    HG2  ARG  60          2HG       ARG  60  -5.316  -5.367  -9.323
  466    HG3  ARG  60          1HG       ARG  60  -5.553  -6.683  -8.170
  467    HD2  ARG  60          2HD       ARG  60  -6.971  -7.854  -9.663
  468    HD3  ARG  60          1HD       ARG  60  -7.095  -6.463 -10.744
  469    HE   ARG  60           HE       ARG  60  -4.401  -7.363 -10.454
  470   HH11  ARG  60          1HH1      ARG  60  -7.424  -8.089 -12.060
  471   HH12  ARG  60          2HH1      ARG  60  -6.668  -8.900 -13.395
  472   HH21  ARG  60          1HH2      ARG  60  -3.399  -8.443 -12.196
  473   HH22  ARG  60          2HH2      ARG  60  -4.377  -9.110 -13.466
  474    H    ALA  61           H        ALA  61  -9.444  -5.998  -5.722
  475    HA   ALA  61           HA       ALA  61  -7.625  -7.887  -4.402
  476    HB1  ALA  61          1HB       ALA  61  -9.618  -6.326  -2.850
  477    HB2  ALA  61          2HB       ALA  61  -8.253  -5.462  -3.542
  478    HB3  ALA  61          3HB       ALA  61  -7.972  -6.795  -2.419
  479    H    ALA  62           H        ALA  62 -10.447  -7.887  -5.964
  480    HA   ALA  62           HA       ALA  62 -12.343  -9.153  -5.994
  481    HB1  ALA  62          1HB       ALA  62 -12.055 -11.492  -5.426
  482    HB2  ALA  62          2HB       ALA  62 -10.599 -11.116  -4.503
  483    HB3  ALA  62          3HB       ALA  62 -10.613 -10.899  -6.254
  484    H    ALA  63           H        ALA  63 -12.887 -11.183  -3.758
  485    HA   ALA  63           HA       ALA  63 -14.372  -9.598  -2.007
  486    HB1  ALA  63          1HB       ALA  63 -14.738 -12.007  -2.230
  487    HB2  ALA  63          2HB       ALA  63 -14.465 -11.561  -0.545
  488    HB3  ALA  63          3HB       ALA  63 -13.174 -12.319  -1.476
  489    H    ASN  64           H        ASN  64 -11.275 -11.252  -1.337
  490    HA   ASN  64           HA       ASN  64 -10.382  -8.907   0.135
  491    HB2  ASN  64          2HB       ASN  64 -10.600 -11.652   1.363
  492    HB3  ASN  64          1HB       ASN  64  -9.591 -10.374   2.029
  493   HD21  ASN  64          1HD2      ASN  64 -10.651  -8.373   2.580
  494   HD22  ASN  64          2HD2      ASN  64 -12.269  -8.423   3.194
  495    H    GLY  65           H        GLY  65  -8.118  -8.863   0.540
  496    HA2  GLY  65          2HA       GLY  65  -5.910  -9.816   0.184
  497    HA3  GLY  65          1HA       GLY  65  -6.569 -10.712  -1.171
  498    H    TYR  66           H        TYR  66  -5.942  -7.378  -0.057
  499    HA   TYR  66           HA       TYR  66  -5.792  -6.316  -2.715
  500    HB2  TYR  66          2HB       TYR  66  -5.122  -5.308  -0.082
  501    HB3  TYR  66          1HB       TYR  66  -3.915  -4.840  -1.277
  502    HD1  TYR  66          1HD       TYR  66  -5.293  -2.850   0.114
  503    HD2  TYR  66          2HD       TYR  66  -6.545  -4.875  -3.365
  504    HE1  TYR  66          1HE       TYR  66  -6.671  -0.902  -0.480
  505    HE2  TYR  66          2HE       TYR  66  -7.936  -2.959  -3.998
  506    HH   TYR  66           HH       TYR  66  -7.687   0.075  -2.458
  507    H    ASP  67           H        ASP  67  -3.979  -5.730  -3.889
  508    HA   ASP  67           HA       ASP  67  -1.587  -7.266  -3.262
  509    HB2  ASP  67          2HB       ASP  67  -1.404  -8.025  -5.460
  510    HB3  ASP  67          1HB       ASP  67  -3.147  -8.111  -5.151
  511    H    ARG  68           H        ARG  68   0.259  -6.315  -4.606
  512    HA   ARG  68           HA       ARG  68   0.723  -3.839  -3.506
  513    HB2  ARG  68          2HB       ARG  68   2.707  -3.678  -4.982
  514    HB3  ARG  68          1HB       ARG  68   2.573  -5.226  -4.166
  515    HG2  ARG  68          2HG       ARG  68   1.534  -4.897  -6.946
  516    HG3  ARG  68          1HG       ARG  68   3.252  -5.142  -6.662
  517    HD2  ARG  68          2HD       ARG  68   2.880  -7.326  -6.540
  518    HD3  ARG  68          1HD       ARG  68   1.885  -7.045  -5.114
  519    HE   ARG  68           HE       ARG  68   0.158  -6.542  -7.119
  520   HH11  ARG  68          1HH1      ARG  68   2.317  -9.233  -6.482
  521   HH12  ARG  68          2HH1      ARG  68   1.283 -10.391  -7.274
  522   HH21  ARG  68          1HH2      ARG  68  -1.169  -8.062  -8.166
  523   HH22  ARG  68          2HH2      ARG  68  -0.675  -9.723  -8.247
  524    H    SER  69           H        SER  69  -0.394  -4.523  -6.822
  525    HA   SER  69           HA       SER  69  -0.172  -1.787  -7.617
  526    HB2  SER  69          2HB       SER  69  -1.395  -2.484  -9.641
  527    HB3  SER  69          1HB       SER  69  -0.052  -3.567  -9.278
  528    HG   SER  69           HG       SER  69  -1.677  -4.938  -8.222
  529    H    ALA  70           H        ALA  70  -2.866  -3.834  -6.545
  530    HA   ALA  70           HA       ALA  70  -4.941  -1.984  -6.990
  531    HB1  ALA  70          1HB       ALA  70  -6.309  -3.412  -5.751
  532    HB2  ALA  70          2HB       ALA  70  -4.981  -3.941  -4.716
  533    HB3  ALA  70          3HB       ALA  70  -5.071  -4.494  -6.398
  534    H    PHE  71           H        PHE  71  -3.175  -2.818  -4.061
  535    HA   PHE  71           HA       PHE  71  -4.494  -0.938  -2.433
  536    HB2  PHE  71          2HB       PHE  71  -3.648  -2.781  -1.319
  537    HB3  PHE  71          1HB       PHE  71  -2.098  -2.727  -2.121
  538    HD1  PHE  71          1HD       PHE  71  -3.904  -2.005   0.802
  539    HD2  PHE  71          2HD       PHE  71  -0.589  -0.675  -1.490
  540    HE1  PHE  71          1HE       PHE  71  -3.003  -0.890   2.779
  541    HE2  PHE  71          2HE       PHE  71   0.312   0.457   0.487
  542    HZ   PHE  71           HZ       PHE  71  -0.893   0.363   2.620
  543    H    PHE  72           H        PHE  72  -1.374  -0.860  -4.156
  544    HA   PHE  72           HA       PHE  72  -0.549   1.616  -3.076
  545    HB2  PHE  72          2HB       PHE  72   1.071   0.169  -4.157
  546    HB3  PHE  72          1HB       PHE  72   0.219   0.319  -5.690
  547    HD1  PHE  72          1HD       PHE  72   1.836   2.458  -3.100
  548    HD2  PHE  72          2HD       PHE  72   0.987   1.848  -7.225
  549    HE1  PHE  72          1HE       PHE  72   3.206   4.418  -3.667
  550    HE2  PHE  72          2HE       PHE  72   2.357   3.809  -7.801
  551    HZ   PHE  72           HZ       PHE  72   3.468   5.097  -6.020
  552    H    SER  73           H        SER  73  -2.482   0.771  -5.853
  553    HA   SER  73           HA       SER  73  -2.590   3.273  -7.099
  554    HB2  SER  73          2HB       SER  73  -3.405   1.151  -8.108
  555    HB3  SER  73          1HB       SER  73  -4.771   1.174  -7.000
  556    HG   SER  73           HG       SER  73  -4.160   3.128  -8.970
  557    H    LEU  74           H        LEU  74  -4.464   1.909  -4.444
  558    HA   LEU  74           HA       LEU  74  -6.279   4.099  -4.239
  559    HB2  LEU  74          2HB       LEU  74  -6.809   1.871  -3.361
  560    HB3  LEU  74          1HB       LEU  74  -5.500   2.010  -2.204
  561    HG   LEU  74           HG       LEU  74  -6.662   3.722  -0.990
  562   HD11  LEU  74          1HD1      LEU  74  -7.636   4.959  -2.831
  563   HD12  LEU  74          2HD1      LEU  74  -8.895   4.494  -1.687
  564   HD13  LEU  74          3HD1      LEU  74  -8.709   3.611  -3.202
  565   HD21  LEU  74          1HD2      LEU  74  -8.728   2.495  -0.385
  566   HD22  LEU  74          2HD2      LEU  74  -7.296   1.468  -0.456
  567   HD23  LEU  74          3HD2      LEU  74  -8.460   1.447  -1.780
  568    H    VAL  75           H        VAL  75  -3.331   3.210  -2.445
  569    HA   VAL  75           HA       VAL  75  -3.435   5.383  -0.635
  570    HB   VAL  75           HB       VAL  75  -0.903   4.001  -1.533
  571   HG11  VAL  75          1HG1      VAL  75  -0.407   4.316   0.942
  572   HG12  VAL  75          2HG1      VAL  75  -1.693   5.526   0.889
  573   HG13  VAL  75          3HG1      VAL  75  -0.272   5.700  -0.142
  574   HG21  VAL  75          1HG2      VAL  75  -3.026   3.052   0.359
  575   HG22  VAL  75          2HG2      VAL  75  -1.352   2.512   0.479
  576   HG23  VAL  75          3HG2      VAL  75  -2.285   2.181  -0.988
  577    H    ALA  76           H        ALA  76  -1.971   4.992  -3.817
  578    HA   ALA  76           HA       ALA  76  -0.488   7.412  -3.799
  579    HB1  ALA  76          1HB       ALA  76   0.010   5.540  -5.306
  580    HB2  ALA  76          2HB       ALA  76  -0.215   7.055  -6.179
  581    HB3  ALA  76          3HB       ALA  76  -1.499   5.846  -6.168
  582    H    SER  77           H        SER  77  -3.747   7.004  -3.715
  583    HA   SER  77           HA       SER  77  -4.215   9.564  -5.091
  584    HB2  SER  77          2HB       SER  77  -5.442   7.554  -5.993
  585    HB3  SER  77          1HB       SER  77  -6.274   7.439  -4.444
  586    HG   SER  77           HG       SER  77  -6.913   9.699  -4.871
  587    H    ASP  78           H        ASP  78  -3.991   8.026  -2.104
  588    HA   ASP  78           HA       ASP  78  -5.576  10.134  -0.808
  589    HB2  ASP  78          2HB       ASP  78  -5.589   7.171  -0.360
  590    HB3  ASP  78          1HB       ASP  78  -5.977   8.267   0.968
  591    H    GLU  79           H        GLU  79  -4.192  11.414   0.213
  592    HA   GLU  79           HA       GLU  79  -1.552  10.677   0.887
  593    HB2  GLU  79          2HB       GLU  79  -1.252  12.845   1.535
  594    HB3  GLU  79          1HB       GLU  79  -2.640  13.028   0.482
  595    HG2  GLU  79          2HG       GLU  79  -4.121  13.226   2.315
  596    HG3  GLU  79          1HG       GLU  79  -2.880  12.705   3.455
  597    H    GLN  80           H        GLN  80  -4.532  10.754   2.797
  598    HA   GLN  80           HA       GLN  80  -3.258  10.511   5.317
  599    HB2  GLN  80          2HB       GLN  80  -5.405  10.211   6.232
  600    HB3  GLN  80          1HB       GLN  80  -5.649  11.205   4.809
  601    HG2  GLN  80          2HG       GLN  80  -6.003   8.283   4.589
  602    HG3  GLN  80          1HG       GLN  80  -7.270   9.290   5.299
  603   HE21  GLN  80          1HE2      GLN  80  -7.378   7.823   2.858
  604   HE22  GLN  80          2HE2      GLN  80  -7.642   8.982   1.602
  605    H    TYR  81           H        TYR  81  -3.987   8.362   2.834
  606    HA   TYR  81           HA       TYR  81  -3.612   5.919   4.297
  607    HB2  TYR  81          2HB       TYR  81  -3.933   6.630   1.397
  608    HB3  TYR  81          1HB       TYR  81  -3.417   5.016   1.865
  609    HD1  TYR  81          1HD       TYR  81  -5.736   4.913   0.378
  610    HD2  TYR  81          2HD       TYR  81  -5.402   6.003   4.469
  611    HE1  TYR  81          1HE       TYR  81  -8.063   4.181   0.757
  612    HE2  TYR  81          2HE       TYR  81  -7.707   5.311   4.846
  613    HH   TYR  81           HH       TYR  81  -9.458   3.454   2.638
  614    H    VAL  82           H        VAL  82  -1.755   7.886   2.036
  615    HA   VAL  82           HA       VAL  82   0.597   6.387   1.971
  616    HB   VAL  82           HB       VAL  82  -0.004   9.318   1.657
  617   HG11  VAL  82          1HG1      VAL  82   2.206   9.870   1.133
  618   HG12  VAL  82          2HG1      VAL  82   2.713   8.181   1.093
  619   HG13  VAL  82          3HG1      VAL  82   2.320   8.944   2.632
  620   HG21  VAL  82          1HG2      VAL  82   0.932   7.185  -0.267
  621   HG22  VAL  82          2HG2      VAL  82   0.581   8.864  -0.681
  622   HG23  VAL  82          3HG2      VAL  82  -0.713   7.803  -0.118
  623    H    ARG  83           H        ARG  83  -0.327   9.065   4.075
  624    HA   ARG  83           HA       ARG  83   1.957   8.851   5.748
  625    HB2  ARG  83          2HB       ARG  83  -0.600  10.111   6.624
  626    HB3  ARG  83          1HB       ARG  83   1.029  10.539   7.077
  627    HG2  ARG  83          2HG       ARG  83   1.442  11.686   5.104
  628    HG3  ARG  83          1HG       ARG  83   0.152  10.847   4.249
  629    HD2  ARG  83          2HD       ARG  83  -0.262  13.247   4.790
  630    HD3  ARG  83          1HD       ARG  83  -1.494  12.071   5.207
  631    HE   ARG  83           HE       ARG  83  -0.198  12.281   7.520
  632   HH11  ARG  83          1HH1      ARG  83  -1.304  14.755   5.292
  633   HH12  ARG  83          2HH1      ARG  83  -1.531  15.943   6.540
  634   HH21  ARG  83          1HH2      ARG  83  -0.518  13.847   9.157
  635   HH22  ARG  83          2HH2      ARG  83  -1.091  15.428   8.728
  636    H    PHE  84           H        PHE  84  -1.174   7.316   5.662
  637    HA   PHE  84           HA       PHE  84  -1.382   6.540   8.351
  638    HB2  PHE  84          2HB       PHE  84  -2.799   5.896   6.074
  639    HB3  PHE  84          1HB       PHE  84  -2.017   4.359   6.463
  640    HD1  PHE  84          1HD       PHE  84  -2.582   3.148   8.452
  641    HD2  PHE  84          2HD       PHE  84  -4.448   6.866   7.568
  642    HE1  PHE  84          1HE       PHE  84  -4.301   2.685  10.150
  643    HE2  PHE  84          2HE       PHE  84  -6.171   6.412   9.262
  644    HZ   PHE  84           HZ       PHE  84  -6.098   4.317  10.556
  645    H    ILE  85           H        ILE  85   0.307   5.002   5.655
  646    HA   ILE  85           HA       ILE  85   1.402   2.982   7.390
  647    HB   ILE  85           HB       ILE  85   1.780   3.575   4.476
  648   HG12  ILE  85          2HG1      ILE  85   0.792   1.221   6.098
  649   HG13  ILE  85          1HG1      ILE  85  -0.162   2.269   5.057
  650   HG21  ILE  85          1HG2      ILE  85   3.996   3.083   5.185
  651   HG22  ILE  85          2HG2      ILE  85   3.356   1.622   4.431
  652   HG23  ILE  85          3HG2      ILE  85   3.444   1.744   6.186
  653   HD11  ILE  85          1HD1      ILE  85   0.941   1.371   3.099
  654   HD12  ILE  85          2HD1      ILE  85   0.249   0.072   4.069
  655   HD13  ILE  85          3HD1      ILE  85   1.986   0.366   4.111
  656    H    ALA  86           H        ALA  86   2.700   5.829   5.716
  657    HA   ALA  86           HA       ALA  86   5.353   5.636   6.488
  658    HB1  ALA  86          1HB       ALA  86   3.724   8.168   6.253
  659    HB2  ALA  86          2HB       ALA  86   4.460   7.303   4.905
  660    HB3  ALA  86          3HB       ALA  86   5.478   8.039   6.144
  661    H    GLN  87           H        GLN  87   2.616   6.915   8.318
  662    HA   GLN  87           HA       GLN  87   4.290   7.890  10.412
  663    HB2  GLN  87          2HB       GLN  87   1.309   7.611  10.174
  664    HB3  GLN  87          1HB       GLN  87   2.093   8.218  11.627
  665    HG2  GLN  87          2HG       GLN  87   2.310   9.422   8.877
  666    HG3  GLN  87          1HG       GLN  87   1.319  10.032  10.199
  667   HE21  GLN  87          1HE2      GLN  87   3.511  11.289   8.718
  668   HE22  GLN  87          2HE2      GLN  87   4.682  11.748   9.905
  669    H    HIS  88           H        HIS  88   2.560   4.917   9.762
  670    HA   HIS  88           HA       HIS  88   3.097   4.029  12.485
  671    HB2  HIS  88          2HB       HIS  88   1.537   2.340  12.214
  672    HB3  HIS  88          1HB       HIS  88   0.877   3.613  11.208
  673    HD1  HIS  88          1HD       HIS  88   3.152   0.595  10.624
  674    HD2  HIS  88          2HD       HIS  88  -0.066   2.597   8.906
  675    HE1  HIS  88          1HE       HIS  88   2.543  -0.719   8.577
  676    HE2  HIS  88          2HE       HIS  88   0.447   0.373   7.724
  677    H    PHE  89           H        PHE  89   4.756   4.030   9.589
  678    HA   PHE  89           HA       PHE  89   6.684   2.174  10.641
  679    HB2  PHE  89          2HB       PHE  89   4.938   0.767   9.447
  680    HB3  PHE  89          1HB       PHE  89   5.483   1.530   7.958
  681    HD1  PHE  89          1HD       PHE  89   7.124   0.469   6.730
  682    HD2  PHE  89          2HD       PHE  89   6.858  -0.270  10.912
  683    HE1  PHE  89          1HE       PHE  89   8.896  -1.232   6.542
  684    HE2  PHE  89          2HE       PHE  89   8.635  -1.959  10.733
  685    HZ   PHE  89           HZ       PHE  89   9.658  -2.440   8.547
  686    HA   PRO  90           HA       PRO  90   9.283   5.316   8.603
  687    HB2  PRO  90          2HB       PRO  90  11.156   3.197   9.556
  688    HB3  PRO  90          1HB       PRO  90  11.290   4.954   9.684
  689    HG2  PRO  90          2HG       PRO  90  10.571   3.485  11.784
  690    HG3  PRO  90          1HG       PRO  90   9.835   5.069  11.479
  691    HD2  PRO  90          2HD       PRO  90   8.689   2.353  11.110
  692    HD3  PRO  90          1HD       PRO  90   7.879   3.879  11.514
  693    H    CYS  91           H        CYS  91  10.714   5.285   6.817
  694    HA   CYS  91           HA       CYS  91   9.911   3.423   4.812
  695    HB2  CYS  91          2HB       CYS  91  11.566   4.815   3.427
  696    HB3  CYS  91          1HB       CYS  91  10.183   5.670   4.132
  697    HG   CYS  91           HG       CYS  91  12.970   6.871   4.233
  698    H    ALA  92           H        ALA  92  10.625   1.499   4.762
  699    HA   ALA  92           HA       ALA  92  13.530   1.122   4.501
  700    HB1  ALA  92          1HB       ALA  92  11.618  -0.835   5.781
  701    HB2  ALA  92          2HB       ALA  92  12.828   0.130   6.629
  702    HB3  ALA  92          3HB       ALA  92  13.335  -1.109   5.477
  703    HA   PRO  93           HA       PRO  93  12.229  -0.943   0.741
  704    HB2  PRO  93          2HB       PRO  93  14.444  -2.264   0.098
  705    HB3  PRO  93          1HB       PRO  93  14.440  -0.500   0.110
  706    HG2  PRO  93          2HG       PRO  93  15.435  -2.399   2.198
  707    HG3  PRO  93          1HG       PRO  93  16.226  -0.945   1.555
  708    HD2  PRO  93          2HD       PRO  93  14.804  -0.996   3.912
  709    HD3  PRO  93          1HD       PRO  93  15.005   0.458   2.911
  710    H    GLU  94           H        GLU  94  11.439  -2.952   0.087
  711    HA   GLU  94           HA       GLU  94  11.611  -5.074   2.114
  712    HB2  GLU  94          2HB       GLU  94   9.329  -4.198   1.648
  713    HB3  GLU  94          1HB       GLU  94   9.506  -4.703  -0.026
  714    HG2  GLU  94          2HG       GLU  94   8.166  -6.237   1.429
  715    HG3  GLU  94          1HG       GLU  94   9.504  -6.993   0.568
  716    H    GLU  95           H        GLU  95  12.493  -4.130  -0.951
  717    HA   GLU  95           HA       GLU  95  13.653  -6.782  -1.419
  718    HB2  GLU  95          2HB       GLU  95  12.416  -4.969  -3.501
  719    HB3  GLU  95          1HB       GLU  95  13.396  -6.380  -3.871
  720    HG2  GLU  95          2HG       GLU  95  11.798  -7.830  -2.853
  721    HG3  GLU  95          1HG       GLU  95  10.831  -6.456  -2.314
  722    H    GLU  96           H        GLU  96  15.782  -6.632  -1.362
  723    HA   GLU  96           HA       GLU  96  17.094  -4.073  -1.764
  724    HB2  GLU  96          2HB       GLU  96  19.160  -5.342  -1.156
  725    HB3  GLU  96          1HB       GLU  96  17.901  -5.411   0.069
  726    HG2  GLU  96          2HG       GLU  96  17.261  -7.636  -0.717
  727    HG3  GLU  96          1HG       GLU  96  18.536  -7.565  -1.934
  728    H    LYS  97           H        LYS  97  16.036  -6.555  -3.644
  729    HA   LYS  97           HA       LYS  97  18.062  -6.950  -5.520
  730    HB2  LYS  97          2HB       LYS  97  16.173  -8.425  -5.435
  731    HB3  LYS  97          1HB       LYS  97  15.063  -7.117  -5.797
  732    HG2  LYS  97          2HG       LYS  97  15.975  -6.917  -8.028
  733    HG3  LYS  97          1HG       LYS  97  17.166  -8.168  -7.672
  734    HD2  LYS  97          2HD       LYS  97  15.301  -9.071  -8.964
  735    HD3  LYS  97          1HD       LYS  97  15.369  -9.796  -7.359
  736    HE2  LYS  97          2HE       LYS  97  13.641  -7.407  -7.793
  737    HE3  LYS  97          1HE       LYS  97  13.093  -8.969  -8.393
  738    HZ1  LYS  97          1HZ       LYS  97  13.174  -9.865  -6.203
  739    HZ2  LYS  97          2HZ       LYS  97  12.305  -8.411  -6.118
  740    HZ3  LYS  97          3HZ       LYS  97  13.908  -8.477  -5.583
  741    HA   PRO  98           HA       PRO  98  16.112  -3.279  -8.127
  742    HB2  PRO  98          2HB       PRO  98  15.051  -1.606  -5.925
  743    HB3  PRO  98          1HB       PRO  98  14.378  -1.909  -7.530
  744    HG2  PRO  98          2HG       PRO  98  13.297  -3.013  -5.357
  745    HG3  PRO  98          1HG       PRO  98  13.402  -3.908  -6.885
  746    HD2  PRO  98          2HD       PRO  98  15.100  -4.135  -4.436
  747    HD3  PRO  98          1HD       PRO  98  14.477  -5.409  -5.500
  748    HA   PRO  99           HA       PRO  99  20.047  -1.508  -6.865
  749    HB2  PRO  99          2HB       PRO  99  20.335   0.021  -9.142
  750    HB3  PRO  99          1HB       PRO  99  20.824  -1.670  -8.994
  751    HG2  PRO  99          2HG       PRO  99  18.351  -0.508 -10.194
  752    HG3  PRO  99          1HG       PRO  99  19.338  -1.872 -10.751
  753    HD2  PRO  99          2HD       PRO  99  17.005  -2.238  -9.473
  754    HD3  PRO  99          1HD       PRO  99  18.376  -3.344  -9.252
  755    H    GLU 100           H        GLU 100  17.171   0.276  -7.819
  756    HA   GLU 100           HA       GLU 100  18.250   2.799  -6.972
  757    HB2  GLU 100          2HB       GLU 100  15.774   3.519  -7.111
  758    HB3  GLU 100          1HB       GLU 100  16.612   3.096  -8.589
  759    HG2  GLU 100          2HG       GLU 100  15.007   1.035  -7.159
  760    HG3  GLU 100          1HG       GLU 100  14.203   2.272  -8.119
  761    H    ILE 101           H        ILE 101  15.157   1.671  -5.679
  762    HA   ILE 101           HA       ILE 101  16.313   1.486  -3.018
  763    HB   ILE 101           HB       ILE 101  14.154   2.828  -2.247
  764   HG12  ILE 101          2HG1      ILE 101  13.735   3.252  -4.833
  765   HG13  ILE 101          1HG1      ILE 101  13.354   4.477  -3.634
  766   HG21  ILE 101          1HG2      ILE 101  15.574   4.791  -1.948
  767   HG22  ILE 101          2HG2      ILE 101  16.728   4.132  -3.106
  768   HG23  ILE 101          3HG2      ILE 101  16.438   3.298  -1.580
  769   HD11  ILE 101          1HD1      ILE 101  15.392   5.631  -4.158
  770   HD12  ILE 101          2HD1      ILE 101  14.468   5.326  -5.631
  771   HD13  ILE 101          3HD1      ILE 101  15.868   4.332  -5.250
  772    H    ASP 102           H        ASP 102  13.020   1.749  -4.307
  773    HA   ASP 102           HA       ASP 102  12.220  -0.893  -4.188
  774    HB2  ASP 102          2HB       ASP 102  12.812  -0.690  -1.737
  775    HB3  ASP 102          1HB       ASP 102  11.561   0.527  -1.585
  776    H    ALA 103           H        ALA 103  11.121   2.170  -2.848
  777    HA   ALA 103           HA       ALA 103   8.545   2.419  -3.510
  778    HB1  ALA 103          1HB       ALA 103   9.111   4.874  -4.008
  779    HB2  ALA 103          2HB       ALA 103  10.786   4.408  -3.708
  780    HB3  ALA 103          3HB       ALA 103   9.577   4.226  -2.438
  781    H    LEU 104           H        LEU 104  10.822   3.973  -5.692
  782    HA   LEU 104           HA       LEU 104   9.641   2.684  -8.002
  783    HB2  LEU 104          2HB       LEU 104   9.464   5.034  -9.064
  784    HB3  LEU 104          1HB       LEU 104   8.197   4.491  -7.985
  785    HG   LEU 104           HG       LEU 104  10.313   5.977  -6.606
  786   HD11  LEU 104          1HD1      LEU 104   8.602   7.368  -8.668
  787   HD12  LEU 104          2HD1      LEU 104  10.356   7.185  -8.730
  788   HD13  LEU 104          3HD1      LEU 104   9.615   8.163  -7.463
  789   HD21  LEU 104          1HD2      LEU 104   8.130   5.312  -5.639
  790   HD22  LEU 104          2HD2      LEU 104   7.328   6.387  -6.782
  791   HD23  LEU 104          3HD2      LEU 104   8.421   7.049  -5.567
  792    H    GLU 105           H        GLU 105  11.490   5.664  -7.827
  793    HA   GLU 105           HA       GLU 105  13.975   4.285  -8.430
  794    HB2  GLU 105          2HB       GLU 105  12.773   6.432 -10.193
  795    HB3  GLU 105          1HB       GLU 105  14.459   5.946 -10.263
  796    HG2  GLU 105          2HG       GLU 105  13.760   3.671 -10.864
  797    HG3  GLU 105          1HG       GLU 105  12.078   4.199 -10.839
  798    H    LEU 106           H        LEU 106  15.792   6.015  -8.456
  799    HA   LEU 106           HA       LEU 106  15.369   7.759  -6.172
  800    HB2  LEU 106          2HB       LEU 106  17.453   6.466  -6.339
  801    HB3  LEU 106          1HB       LEU 106  17.829   7.251  -7.859
  802    HG   LEU 106           HG       LEU 106  17.931   9.431  -6.636
  803   HD11  LEU 106          1HD1      LEU 106  17.752   7.649  -4.213
  804   HD12  LEU 106          2HD1      LEU 106  16.569   8.856  -4.715
  805   HD13  LEU 106          3HD1      LEU 106  18.177   9.360  -4.199
  806   HD21  LEU 106          1HD2      LEU 106  19.943   8.164  -7.204
  807   HD22  LEU 106          2HD2      LEU 106  19.816   7.283  -5.681
  808   HD23  LEU 106          3HD2      LEU 106  20.125   9.019  -5.673
  809    H    LYS 107           H        LYS 107  16.856   8.178  -9.341
  810    HA   LYS 107           HA       LYS 107  15.330  10.190 -10.420
  811    HB2  LYS 107          2HB       LYS 107  16.451  11.273  -8.189
  812    HB3  LYS 107          1HB       LYS 107  17.727  11.592  -9.351
  813    HG2  LYS 107          2HG       LYS 107  14.860  12.464  -9.663
  814    HG3  LYS 107          1HG       LYS 107  16.166  13.478  -9.054
  815    HD2  LYS 107          2HD       LYS 107  16.375  14.120 -11.193
  816    HD3  LYS 107          1HD       LYS 107  17.218  12.585 -11.401
  817    HE2  LYS 107          2HE       LYS 107  15.061  11.536 -12.020
  818    HE3  LYS 107          1HE       LYS 107  14.294  13.120 -11.916
  819    HZ1  LYS 107          1HZ       LYS 107  16.470  12.347 -13.782
  820    HZ2  LYS 107          2HZ       LYS 107  15.806  13.897 -13.660
  821    HZ3  LYS 107          3HZ       LYS 107  14.852  12.608 -14.189
  822    H    THR 108           H        THR 108  18.433   8.853  -9.738
  823    HA   THR 108           HA       THR 108  19.013   8.246 -12.436
  824    HB   THR 108           HB       THR 108  19.603  10.694 -12.404
  825    HG1  THR 108          1HG       THR 108  20.745   9.653 -13.918
  826   HG21  THR 108          1HG2      THR 108  20.366  10.840 -10.077
  827   HG22  THR 108          2HG2      THR 108  21.604  11.414 -11.196
  828   HG23  THR 108          3HG2      THR 108  21.748   9.815 -10.466
  829    H    GLN 109           H        GLN 109  21.266   7.169 -12.500
  830    HA   GLN 109           HA       GLN 109  21.496   5.504 -10.185
  831    HB2  GLN 109          2HB       GLN 109  21.806   4.528 -12.377
  832    HB3  GLN 109          1HB       GLN 109  23.101   5.659 -12.741
  833    HG2  GLN 109          2HG       GLN 109  24.499   4.671 -11.076
  834    HG3  GLN 109          1HG       GLN 109  23.201   3.599 -10.557
  835   HE21  GLN 109          1HE2      GLN 109  22.278   3.075 -13.258
  836   HE22  GLN 109          2HE2      GLN 109  23.446   2.026 -13.980
  837    H    LYS 110           H        LYS 110  22.123   6.730  -8.504
  838    HA   LYS 110           HA       LYS 110  24.541   8.376  -8.783
  839    HB2  LYS 110          2HB       LYS 110  22.333   9.434  -8.152
  840    HB3  LYS 110          1HB       LYS 110  22.414   8.532  -6.648
  841    HG2  LYS 110          2HG       LYS 110  24.433   9.705  -6.016
  842    HG3  LYS 110          1HG       LYS 110  24.447  10.556  -7.565
  843    HD2  LYS 110          2HD       LYS 110  22.211  11.493  -6.989
  844    HD3  LYS 110          1HD       LYS 110  22.366  10.761  -5.393
  845    HE2  LYS 110          2HE       LYS 110  24.335  12.093  -4.937
  846    HE3  LYS 110          1HE       LYS 110  24.283  12.768  -6.567
  847    HZ1  LYS 110          1HZ       LYS 110  23.334  14.303  -4.983
  848    HZ2  LYS 110          2HZ       LYS 110  22.225  13.140  -4.457
  849    HZ3  LYS 110          3HZ       LYS 110  22.126  13.752  -6.030
  850    H    GLY 111           H        GLY 111  22.853   6.411  -6.318
  851    HA2  GLY 111          2HA       GLY 111  23.672   5.080  -4.638
  852    HA3  GLY 111          1HA       GLY 111  25.059   4.809  -5.682
  853    H    PHE 112           H        PHE 112  23.762   7.564  -3.846
  854    HA   PHE 112           HA       PHE 112  26.282   7.726  -2.375
  855    HB2  PHE 112          2HB       PHE 112  26.409   9.282  -4.348
  856    HB3  PHE 112          1HB       PHE 112  25.017  10.139  -3.698
  857    HD1  PHE 112          1HD       PHE 112  25.233  11.603  -1.803
  858    HD2  PHE 112          2HD       PHE 112  28.570   9.384  -3.231
  859    HE1  PHE 112          1HE       PHE 112  26.735  12.995  -0.442
  860    HE2  PHE 112          2HE       PHE 112  30.078  10.768  -1.870
  861    HZ   PHE 112           HZ       PHE 112  29.163  12.577  -0.472
  Start of MODEL    7
    1    H1   GLY   1          1HT       GLY   1   7.011  -4.808 -10.821
    2    H2   GLY   1          2HT       GLY   1   6.090  -6.095 -10.234
    3    H    GLY   1           H        GLY   1   7.177  -4.608  -9.920
    4    H3   GLY   1          3HT       GLY   1   6.718  -4.948  -9.163
    5    HA2  GLY   1          1HA       GLY   1   4.663  -4.443 -11.242
    6    HA3  GLY   1          2HA       GLY   1   4.360  -4.577  -9.514
    7    H    SER   2           H        SER   2   4.434  -2.383 -11.821
    8    HA   SER   2           HA       SER   2   6.198  -0.401 -10.791
    9    HB2  SER   2          2HB       SER   2   3.826  -0.132 -12.652
   10    HB3  SER   2          1HB       SER   2   5.039   1.114 -12.359
   11    HG   SER   2           HG       SER   2   6.579  -0.136 -13.334
   12    H    ALA   3           H        ALA   3   5.913   0.998  -9.189
   13    HA   ALA   3           HA       ALA   3   3.184   1.442  -8.179
   14    HB1  ALA   3          1HB       ALA   3   5.825   1.854  -6.776
   15    HB2  ALA   3          2HB       ALA   3   4.712   0.511  -6.513
   16    HB3  ALA   3          3HB       ALA   3   4.232   2.153  -6.083
   17    H    MET   4           H        MET   4   2.686   2.993  -9.762
   18    HA   MET   4           HA       MET   4   4.473   5.235 -10.160
   19    HB2  MET   4          2HB       MET   4   3.255   4.129 -12.047
   20    HB3  MET   4          1HB       MET   4   1.751   4.741 -11.375
   21    HG2  MET   4          2HG       MET   4   2.172   6.325 -12.952
   22    HG3  MET   4          1HG       MET   4   2.963   7.053 -11.561
   23    HE1  MET   4          1HE       MET   4   6.721   6.695 -12.306
   24    HE2  MET   4          2HE       MET   4   5.858   5.471 -11.380
   25    HE3  MET   4          3HE       MET   4   5.463   7.177 -11.167
   26    H    GLY   5           H        GLY   5   4.449   6.447  -8.315
   27    HA2  GLY   5          2HA       GLY   5   1.939   7.913  -7.846
   28    HA3  GLY   5          1HA       GLY   5   2.832   7.247  -6.484
   29    H    HIS   6           H        HIS   6   3.801   8.844  -5.439
   30    HA   HIS   6           HA       HIS   6   5.132  10.621  -4.966
   31    HB2  HIS   6          2HB       HIS   6   6.772   9.337  -6.326
   32    HB3  HIS   6          1HB       HIS   6   6.232  10.200  -7.758
   33    HD1  HIS   6          1HD       HIS   6   7.329  11.435  -4.307
   34    HD2  HIS   6          2HD       HIS   6   8.130  12.011  -8.348
   35    HE1  HIS   6          1HE       HIS   6   9.102  13.213  -4.401
   36    HE2  HIS   6          2HE       HIS   6   9.438  13.664  -6.853
   37    H    MET   7           H        MET   7   2.586  11.203  -5.722
   38    HA   MET   7           HA       MET   7   2.955  13.880  -6.838
   39    HB2  MET   7          2HB       MET   7   2.156  12.297  -8.645
   40    HB3  MET   7          1HB       MET   7   0.690  12.073  -7.706
   41    HG2  MET   7          2HG       MET   7   0.198  14.460  -7.907
   42    HG3  MET   7          1HG       MET   7   1.664  14.676  -8.860
   43    HE1  MET   7          1HE       MET   7   0.246  15.841 -10.779
   44    HE2  MET   7          2HE       MET   7  -1.224  15.625  -9.827
   45    HE3  MET   7          3HE       MET   7  -1.186  15.116 -11.515
   46    H    VAL   8           H        VAL   8   2.724  13.098  -4.148
   47    HA   VAL   8           HA       VAL   8   0.643  14.753  -3.241
   48    HB   VAL   8           HB       VAL   8  -0.683  12.730  -3.979
   49   HG11  VAL   8          1HG1      VAL   8  -0.737  10.761  -2.540
   50   HG12  VAL   8          2HG1      VAL   8   0.645  11.388  -1.642
   51   HG13  VAL   8          3HG1      VAL   8   0.819  10.964  -3.344
   52   HG21  VAL   8          1HG2      VAL   8  -2.093  12.652  -1.931
   53   HG22  VAL   8          2HG2      VAL   8  -1.701  14.276  -2.493
   54   HG23  VAL   8          3HG2      VAL   8  -0.858  13.600  -1.104
   55    H    LYS   9           H        LYS   9   0.515  12.980  -0.709
   56    HA   LYS   9           HA       LYS   9   2.946  13.893   0.474
   57    HB2  LYS   9          2HB       LYS   9   0.804  12.018   1.520
   58    HB3  LYS   9          1HB       LYS   9   2.170  12.601   2.473
   59    HG2  LYS   9          2HG       LYS   9  -0.008  14.275   1.254
   60    HG3  LYS   9          1HG       LYS   9   0.183  13.883   2.962
   61    HD2  LYS   9          2HD       LYS   9   2.283  15.108   3.029
   62    HD3  LYS   9          1HD       LYS   9   2.160  15.451   1.304
   63    HE2  LYS   9          2HE       LYS   9   1.469  17.386   2.578
   64    HE3  LYS   9          1HE       LYS   9   0.092  16.705   1.716
   65    HZ1  LYS   9          1HZ       LYS   9   0.682  16.117   4.559
   66    HZ2  LYS   9          2HZ       LYS   9  -0.741  15.758   3.703
   67    HZ3  LYS   9          3HZ       LYS   9  -0.344  17.364   4.059
   68    H    ILE  10           H        ILE  10   3.762  12.441  -1.679
   69    HA   ILE  10           HA       ILE  10   4.867  10.040  -0.427
   70    HB   ILE  10           HB       ILE  10   3.993  10.312  -3.306
   71   HG12  ILE  10          2HG1      ILE  10   3.020   8.483  -1.102
   72   HG13  ILE  10          1HG1      ILE  10   2.141   9.863  -1.747
   73   HG21  ILE  10          1HG2      ILE  10   5.314   7.973  -1.936
   74   HG22  ILE  10          2HG2      ILE  10   6.102   9.064  -3.077
   75   HG23  ILE  10          3HG2      ILE  10   4.771   8.037  -3.612
   76   HD11  ILE  10          1HD1      ILE  10   1.328   7.737  -2.634
   77   HD12  ILE  10          2HD1      ILE  10   2.923   7.417  -3.312
   78   HD13  ILE  10          3HD1      ILE  10   1.972   8.778  -3.903
   79    H    SER  11           H        SER  11   6.817  10.905   0.069
   80    HA   SER  11           HA       SER  11   8.474  11.968  -2.087
   81    HB2  SER  11          2HB       SER  11   9.228  11.381   0.790
   82    HB3  SER  11          1HB       SER  11  10.099  12.410  -0.349
   83    HG   SER  11           HG       SER  11   7.659  12.873   0.980
   84    H    HIS  12           H        HIS  12  10.907  10.808  -1.683
   85    HA   HIS  12           HA       HIS  12  10.789   8.263  -2.804
   86    HB2  HIS  12          2HB       HIS  12  12.876   9.328  -0.887
   87    HB3  HIS  12          1HB       HIS  12  13.063   7.878  -1.858
   88    HD1  HIS  12          1HD       HIS  12  13.190  11.596  -2.077
   89    HD2  HIS  12          2HD       HIS  12  13.625   8.292  -4.558
   90    HE1  HIS  12          1HE       HIS  12  14.237  12.473  -4.184
   91    HE2  HIS  12          2HE       HIS  12  14.645  10.433  -5.601
   92    H    GLU  13           H        GLU  13  11.188   9.231   0.534
   93    HA   GLU  13           HA       GLU  13  11.324   6.709   1.683
   94    HB2  GLU  13          2HB       GLU  13  10.846   7.881   3.799
   95    HB3  GLU  13          1HB       GLU  13  12.059   8.709   2.828
   96    HG2  GLU  13          2HG       GLU  13  10.122  10.145   1.972
   97    HG3  GLU  13          1HG       GLU  13   9.215   9.495   3.335
   98    H    ASP  14           H        ASP  14   8.485   8.724   0.933
   99    HA   ASP  14           HA       ASP  14   6.767   7.263   2.652
  100    HB2  ASP  14          2HB       ASP  14   6.130   9.072   0.342
  101    HB3  ASP  14          1HB       ASP  14   4.948   8.435   1.481
  102    H    THR  15           H        THR  15   7.287   7.160  -0.878
  103    HA   THR  15           HA       THR  15   5.419   5.145  -1.415
  104    HB   THR  15           HB       THR  15   7.665   4.720  -3.088
  105    HG1  THR  15          1HG       THR  15   8.549   6.679  -2.571
  106   HG21  THR  15          1HG2      THR  15   5.000   6.064  -3.411
  107   HG22  THR  15          2HG2      THR  15   5.493   4.456  -3.943
  108   HG23  THR  15          3HG2      THR  15   6.132   5.888  -4.749
  109    H    GLN  16           H        GLN  16   8.830   4.958  -0.488
  110    HA   GLN  16           HA       GLN  16   9.110   2.171  -0.554
  111    HB2  GLN  16          2HB       GLN  16  10.433   4.151   1.317
  112    HB3  GLN  16          1HB       GLN  16  10.980   2.507   1.017
  113    HG2  GLN  16          2HG       GLN  16  11.486   3.038  -1.269
  114    HG3  GLN  16          1HG       GLN  16  10.790   4.646  -1.080
  115   HE21  GLN  16          1HE2      GLN  16  12.747   3.128   1.371
  116   HE22  GLN  16          2HE2      GLN  16  14.111   4.175   1.202
  117    H    ARG  17           H        ARG  17   7.932   4.382   1.897
  118    HA   ARG  17           HA       ARG  17   7.656   2.611   4.046
  119    HB2  ARG  17          2HB       ARG  17   6.380   5.209   3.287
  120    HB3  ARG  17          1HB       ARG  17   5.742   4.305   4.653
  121    HG2  ARG  17          2HG       ARG  17   7.499   4.791   5.965
  122    HG3  ARG  17          1HG       ARG  17   8.652   4.700   4.637
  123    HD2  ARG  17          2HD       ARG  17   8.198   6.879   3.931
  124    HD3  ARG  17          1HD       ARG  17   6.702   6.966   4.872
  125    HE   ARG  17           HE       ARG  17   8.991   6.594   6.532
  126   HH11  ARG  17          1HH1      ARG  17   7.182   9.030   4.761
  127   HH12  ARG  17          2HH1      ARG  17   7.732  10.328   5.770
  128   HH21  ARG  17          1HH2      ARG  17   9.678   8.312   7.868
  129   HH22  ARG  17          2HH2      ARG  17   9.133   9.924   7.534
  130    H    ILE  18           H        ILE  18   5.231   3.677   1.636
  131    HA   ILE  18           HA       ILE  18   3.111   2.221   2.722
  132    HB   ILE  18           HB       ILE  18   3.495   2.981  -0.168
  133   HG12  ILE  18          2HG1      ILE  18   1.649   4.544   1.462
  134   HG13  ILE  18          1HG1      ILE  18   3.307   4.635   2.052
  135   HG21  ILE  18          1HG2      ILE  18   1.045   2.829  -0.262
  136   HG22  ILE  18          2HG2      ILE  18   1.027   2.270   1.415
  137   HG23  ILE  18          3HG2      ILE  18   1.785   1.282   0.161
  138   HD11  ILE  18          1HD1      ILE  18   4.071   5.395  -0.072
  139   HD12  ILE  18          2HD1      ILE  18   2.731   6.415   0.460
  140   HD13  ILE  18          3HD1      ILE  18   2.467   5.183  -0.778
  141    H    LYS  19           H        LYS  19   5.302   1.328   0.040
  142    HA   LYS  19           HA       LYS  19   4.107  -1.146  -0.531
  143    HB2  LYS  19          2HB       LYS  19   7.075  -0.659  -0.662
  144    HB3  LYS  19          1HB       LYS  19   6.097  -1.736  -1.657
  145    HG2  LYS  19          2HG       LYS  19   5.024   0.128  -2.747
  146    HG3  LYS  19          1HG       LYS  19   5.889   1.262  -1.715
  147    HD2  LYS  19          2HD       LYS  19   6.907   1.133  -3.914
  148    HD3  LYS  19          1HD       LYS  19   8.015   0.531  -2.687
  149    HE2  LYS  19          2HE       LYS  19   6.243  -1.288  -4.251
  150    HE3  LYS  19          1HE       LYS  19   7.776  -0.736  -4.912
  151    HZ1  LYS  19          1HZ       LYS  19   8.935  -1.719  -3.056
  152    HZ2  LYS  19          2HZ       LYS  19   7.967  -2.891  -3.792
  153    HZ3  LYS  19          3HZ       LYS  19   7.479  -2.191  -2.340
  154    H    THR  20           H        THR  20   6.813  -0.315   1.585
  155    HA   THR  20           HA       THR  20   7.527  -2.949   2.033
  156    HB   THR  20           HB       THR  20   9.083  -1.057   2.375
  157    HG1  THR  20          1HG       THR  20  10.116  -2.481   3.518
  158   HG21  THR  20          1HG2      THR  20   7.458  -0.602   4.875
  159   HG22  THR  20          2HG2      THR  20   7.641   0.510   3.522
  160   HG23  THR  20          3HG2      THR  20   9.027   0.135   4.549
  161    H    ALA  21           H        ALA  21   5.435  -0.775   3.863
  162    HA   ALA  21           HA       ALA  21   5.288  -2.511   6.103
  163    HB1  ALA  21          1HB       ALA  21   3.543  -1.007   6.908
  164    HB2  ALA  21          2HB       ALA  21   3.470  -0.239   5.318
  165    HB3  ALA  21          3HB       ALA  21   4.930  -0.099   6.304
  166    H    PHE  22           H        PHE  22   2.893  -1.577   3.674
  167    HA   PHE  22           HA       PHE  22   0.782  -3.174   4.257
  168    HB2  PHE  22          2HB       PHE  22   0.300  -1.900   2.497
  169    HB3  PHE  22          1HB       PHE  22   1.959  -1.855   1.945
  170    HD1  PHE  22          1HD       PHE  22  -1.072  -3.952   1.906
  171    HD2  PHE  22          2HD       PHE  22   2.536  -2.876  -0.032
  172    HE1  PHE  22          1HE       PHE  22  -1.793  -5.219  -0.113
  173    HE2  PHE  22          2HE       PHE  22   1.869  -4.156  -2.018
  174    HZ   PHE  22           HZ       PHE  22  -0.295  -5.327  -2.057
  175    H    LEU  23           H        LEU  23   3.473  -4.277   2.137
  176    HA   LEU  23           HA       LEU  23   2.509  -6.887   1.771
  177    HB2  LEU  23          2HB       LEU  23   5.383  -5.974   1.817
  178    HB3  LEU  23          1HB       LEU  23   4.760  -7.413   1.034
  179    HG   LEU  23           HG       LEU  23   3.804  -4.682   0.233
  180   HD11  LEU  23          1HD1      LEU  23   6.205  -6.160  -0.852
  181   HD12  LEU  23          2HD1      LEU  23   6.250  -4.674   0.099
  182   HD13  LEU  23          3HD1      LEU  23   5.517  -4.674  -1.507
  183   HD21  LEU  23          1HD2      LEU  23   3.412  -5.865  -1.906
  184   HD22  LEU  23          2HD2      LEU  23   2.491  -6.534  -0.556
  185   HD23  LEU  23          3HD2      LEU  23   3.937  -7.365  -1.137
  186    H    SER  24           H        SER  24   5.092  -5.755   3.986
  187    HA   SER  24           HA       SER  24   5.659  -8.309   5.015
  188    HB2  SER  24          2HB       SER  24   6.938  -7.096   6.746
  189    HB3  SER  24          1HB       SER  24   7.318  -6.665   5.084
  190    HG   SER  24           HG       SER  24   6.452  -4.715   5.365
  191    H    TYR  25           H        TYR  25   3.416  -5.868   5.898
  192    HA   TYR  25           HA       TYR  25   3.068  -6.645   8.588
  193    HB2  TYR  25          2HB       TYR  25   1.634  -4.809   6.697
  194    HB3  TYR  25          1HB       TYR  25   0.816  -5.328   8.184
  195    HD1  TYR  25          1HD       TYR  25   4.397  -4.496   7.536
  196    HD2  TYR  25          2HD       TYR  25   0.859  -3.575   9.706
  197    HE1  TYR  25          1HE       TYR  25   5.651  -2.857   8.854
  198    HE2  TYR  25          2HE       TYR  25   2.102  -1.924  11.038
  199    HH   TYR  25           HH       TYR  25   5.258  -0.892  10.211
  200    H    ALA  26           H        ALA  26   1.179  -7.325   5.623
  201    HA   ALA  26           HA       ALA  26  -0.704  -8.862   7.143
  202    HB1  ALA  26          1HB       ALA  26  -1.699  -9.441   5.071
  203    HB2  ALA  26          2HB       ALA  26  -0.235  -9.020   4.180
  204    HB3  ALA  26          3HB       ALA  26  -1.185  -7.757   4.965
  205    H    GLN  27           H        GLN  27   1.414 -10.037   4.497
  206    HA   GLN  27           HA       GLN  27   1.722 -12.492   6.088
  207    HB2  GLN  27          2HB       GLN  27   2.060 -12.656   3.149
  208    HB3  GLN  27          1HB       GLN  27   1.472 -13.869   4.281
  209    HG2  GLN  27          2HG       GLN  27  -0.421 -13.397   3.078
  210    HG3  GLN  27          1HG       GLN  27  -0.622 -12.287   4.443
  211   HE21  GLN  27          1HE2      GLN  27  -1.639 -12.126   1.685
  212   HE22  GLN  27          2HE2      GLN  27  -1.043 -10.610   1.077
  213    H    GLY  28           H        GLY  28   3.280 -10.006   4.300
  214    HA2  GLY  28          2HA       GLY  28   5.636  -9.778   4.015
  215    HA3  GLY  28          1HA       GLY  28   5.812 -11.504   4.295
  216    H    GLN  29           H        GLN  29   3.304 -11.736   2.471
  217    HA   GLN  29           HA       GLN  29   4.755 -12.246   0.046
  218    HB2  GLN  29          2HB       GLN  29   1.774 -12.343   0.512
  219    HB3  GLN  29          1HB       GLN  29   2.675 -13.160  -0.757
  220    HG2  GLN  29          2HG       GLN  29   3.789 -14.545   0.889
  221    HG3  GLN  29          1HG       GLN  29   2.963 -13.685   2.188
  222   HE21  GLN  29          1HE2      GLN  29   0.440 -13.557   0.689
  223   HE22  GLN  29          2HE2      GLN  29  -0.229 -15.151   0.755
  224    H    ASP  30           H        ASP  30   3.034 -11.658  -1.980
  225    HA   ASP  30           HA       ASP  30   3.745  -8.887  -2.395
  226    HB2  ASP  30          2HB       ASP  30   2.783 -11.101  -4.165
  227    HB3  ASP  30          1HB       ASP  30   2.747  -9.437  -4.737
  228    H    LYS  31           H        LYS  31   1.099 -10.164  -1.016
  229    HA   LYS  31           HA       LYS  31  -0.558  -7.941  -1.918
  230    HB2  LYS  31          2HB       LYS  31  -1.678 -10.739  -1.608
  231    HB3  LYS  31          1HB       LYS  31  -2.540  -9.309  -2.148
  232    HG2  LYS  31          2HG       LYS  31  -0.742  -9.327  -4.053
  233    HG3  LYS  31          1HG       LYS  31  -0.601 -11.020  -3.622
  234    HD2  LYS  31          2HD       LYS  31  -3.142  -9.608  -4.404
  235    HD3  LYS  31          1HD       LYS  31  -2.210 -10.685  -5.448
  236    HE2  LYS  31          2HE       LYS  31  -3.733 -11.305  -2.962
  237    HE3  LYS  31          1HE       LYS  31  -4.069 -11.878  -4.585
  238    HZ1  LYS  31          1HZ       LYS  31  -1.682 -12.614  -2.976
  239    HZ2  LYS  31          2HZ       LYS  31  -2.035 -13.170  -4.531
  240    HZ3  LYS  31          3HZ       LYS  31  -3.031 -13.599  -3.235
  241    H    VAL  32           H        VAL  32  -2.708  -8.247  -0.287
  242    HA   VAL  32           HA       VAL  32  -1.563  -8.871   2.336
  243    HB   VAL  32           HB       VAL  32  -2.712  -6.276   1.460
  244   HG11  VAL  32          1HG1      VAL  32  -4.197  -6.819   3.272
  245   HG12  VAL  32          2HG1      VAL  32  -3.007  -5.656   3.854
  246   HG13  VAL  32          3HG1      VAL  32  -2.853  -7.364   4.266
  247   HG21  VAL  32          1HG2      VAL  32  -0.379  -6.405   1.600
  248   HG22  VAL  32          2HG2      VAL  32  -0.447  -7.218   3.164
  249   HG23  VAL  32          3HG2      VAL  32  -0.922  -5.527   3.029
  250    H    THR  33           H        THR  33  -2.810  -9.763   3.784
  251    HA   THR  33           HA       THR  33  -5.299 -10.875   3.085
  252    HB   THR  33           HB       THR  33  -5.404 -11.469   5.536
  253    HG1  THR  33          1HG       THR  33  -3.759 -10.854   6.852
  254   HG21  THR  33          1HG2      THR  33  -2.842 -12.141   4.088
  255   HG22  THR  33          2HG2      THR  33  -4.385 -12.976   3.900
  256   HG23  THR  33          3HG2      THR  33  -3.528 -13.043   5.439
  257    H    GLU  34           H        GLU  34  -7.125 -10.562   4.864
  258    HA   GLU  34           HA       GLU  34  -8.245  -8.084   4.152
  259    HB2  GLU  34          2HB       GLU  34  -9.521 -10.115   4.572
  260    HB3  GLU  34          1HB       GLU  34  -9.145 -10.005   6.289
  261    HG2  GLU  34          2HG       GLU  34 -10.469  -8.065   6.542
  262    HG3  GLU  34          1HG       GLU  34 -10.609  -7.850   4.794
  263    H    ALA  35           H        ALA  35  -6.317  -8.933   6.889
  264    HA   ALA  35           HA       ALA  35  -7.498  -7.208   8.806
  265    HB1  ALA  35          1HB       ALA  35  -6.223  -9.190   9.449
  266    HB2  ALA  35          2HB       ALA  35  -5.560  -7.730  10.186
  267    HB3  ALA  35          3HB       ALA  35  -4.757  -8.457   8.792
  268    H    MET  36           H        MET  36  -4.329  -7.021   7.156
  269    HA   MET  36           HA       MET  36  -3.835  -4.370   7.963
  270    HB2  MET  36          2HB       MET  36  -2.668  -6.218   5.946
  271    HB3  MET  36          1HB       MET  36  -2.263  -4.521   5.852
  272    HG2  MET  36          2HG       MET  36  -1.879  -6.277   8.255
  273    HG3  MET  36          1HG       MET  36  -0.619  -5.787   7.122
  274    HE1  MET  36          1HE       MET  36  -0.805  -1.853   7.597
  275    HE2  MET  36          2HE       MET  36  -1.937  -2.766   6.597
  276    HE3  MET  36          3HE       MET  36  -0.219  -3.166   6.573
  277    H    ILE  37           H        ILE  37  -5.702  -5.802   5.452
  278    HA   ILE  37           HA       ILE  37  -5.789  -3.506   3.753
  279    HB   ILE  37           HB       ILE  37  -7.144  -6.086   3.880
  280   HG12  ILE  37          2HG1      ILE  37  -5.709  -6.292   2.175
  281   HG13  ILE  37          1HG1      ILE  37  -6.667  -5.125   1.304
  282   HG21  ILE  37          1HG2      ILE  37  -8.363  -3.722   2.473
  283   HG22  ILE  37          2HG2      ILE  37  -9.067  -4.614   3.824
  284   HG23  ILE  37          3HG2      ILE  37  -8.840  -5.405   2.266
  285   HD11  ILE  37          1HD1      ILE  37  -4.370  -4.413   3.071
  286   HD12  ILE  37          2HD1      ILE  37  -5.306  -3.318   2.043
  287   HD13  ILE  37          3HD1      ILE  37  -4.304  -4.568   1.319
  288    H    ASP  38           H        ASP  38  -7.650  -4.649   6.500
  289    HA   ASP  38           HA       ASP  38  -9.776  -2.820   6.378
  290    HB2  ASP  38          2HB       ASP  38  -9.999  -4.729   7.704
  291    HB3  ASP  38          1HB       ASP  38  -8.442  -4.489   8.464
  292    H    GLN  39           H        GLN  39  -6.577  -2.758   7.833
  293    HA   GLN  39           HA       GLN  39  -6.886  -0.438   9.360
  294    HB2  GLN  39          2HB       GLN  39  -4.698  -0.705   9.892
  295    HB3  GLN  39          1HB       GLN  39  -4.840  -2.217   9.018
  296    HG2  GLN  39          2HG       GLN  39  -2.907  -1.323   8.142
  297    HG3  GLN  39          1HG       GLN  39  -4.105  -0.810   6.962
  298   HE21  GLN  39          1HE2      GLN  39  -2.898   0.921   6.255
  299   HE22  GLN  39          2HE2      GLN  39  -2.636   2.330   7.219
  300    H    LEU  40           H        LEU  40  -5.788  -0.904   6.032
  301    HA   LEU  40           HA       LEU  40  -5.394   1.853   5.513
  302    HB2  LEU  40          2HB       LEU  40  -4.334   0.117   4.164
  303    HB3  LEU  40          1HB       LEU  40  -5.909  -0.412   3.573
  304    HG   LEU  40           HG       LEU  40  -5.912   2.233   2.898
  305   HD11  LEU  40          1HD1      LEU  40  -3.333   1.743   3.697
  306   HD12  LEU  40          2HD1      LEU  40  -3.865   3.084   2.673
  307   HD13  LEU  40          3HD1      LEU  40  -3.243   1.601   1.939
  308   HD21  LEU  40          1HD2      LEU  40  -5.379   1.451   0.622
  309   HD22  LEU  40          2HD2      LEU  40  -6.546   0.403   1.429
  310   HD23  LEU  40          3HD2      LEU  40  -4.859  -0.096   1.289
  311    H    ILE  41           H        ILE  41  -8.030  -0.381   4.622
  312    HA   ILE  41           HA       ILE  41  -9.514   1.538   3.218
  313    HB   ILE  41           HB       ILE  41 -10.358  -1.035   4.534
  314   HG12  ILE  41          2HG1      ILE  41  -8.763  -0.964   2.533
  315   HG13  ILE  41          1HG1      ILE  41 -10.185  -1.985   2.370
  316   HG21  ILE  41          1HG2      ILE  41 -11.994   0.735   2.722
  317   HG22  ILE  41          2HG2      ILE  41 -12.304   0.421   4.430
  318   HG23  ILE  41          3HG2      ILE  41 -12.442  -0.887   3.254
  319   HD11  ILE  41          1HD1      ILE  41  -9.734  -0.757   0.331
  320   HD12  ILE  41          2HD1      ILE  41  -9.820   0.769   1.210
  321   HD13  ILE  41          3HD1      ILE  41 -11.265  -0.235   1.039
  322    H    CYS  42           H        CYS  42  -9.653   0.620   6.648
  323    HA   CYS  42           HA       CYS  42 -11.922   2.278   7.203
  324    HB2  CYS  42          2HB       CYS  42 -11.373   0.318   8.593
  325    HB3  CYS  42          1HB       CYS  42  -9.872   1.090   9.089
  326    HG   CYS  42           HG       CYS  42 -11.547   3.342  10.111
  327    H    GLY  43           H        GLY  43  -8.555   2.750   6.872
  328    HA2  GLY  43          2HA       GLY  43  -8.025   4.986   8.415
  329    HA3  GLY  43          1HA       GLY  43  -7.284   4.649   6.858
  330    H    ALA  44           H        ALA  44  -9.335   4.973   5.076
  331    HA   ALA  44           HA       ALA  44  -9.816   7.852   5.320
  332    HB1  ALA  44          1HB       ALA  44  -8.754   7.087   3.270
  333    HB2  ALA  44          2HB       ALA  44 -10.338   7.796   2.937
  334    HB3  ALA  44          3HB       ALA  44 -10.137   6.042   2.931
  335    H    PHE  45           H        PHE  45 -11.604   4.901   4.434
  336    HA   PHE  45           HA       PHE  45 -14.055   6.275   5.300
  337    HB2  PHE  45          2HB       PHE  45 -14.950   4.286   3.688
  338    HB3  PHE  45          1HB       PHE  45 -14.843   6.003   3.288
  339    HD1  PHE  45          1HD       PHE  45 -12.626   3.034   3.398
  340    HD2  PHE  45          2HD       PHE  45 -13.824   6.487   1.243
  341    HE1  PHE  45          1HE       PHE  45 -11.069   2.433   1.584
  342    HE2  PHE  45          2HE       PHE  45 -12.259   5.911  -0.569
  343    HZ   PHE  45           HZ       PHE  45 -10.869   3.879  -0.395
  344    HA   PRO  46           HA       PRO  46 -14.216   2.660   7.852
  345    HB2  PRO  46          2HB       PRO  46 -15.005   3.922  10.063
  346    HB3  PRO  46          1HB       PRO  46 -13.341   4.004   9.498
  347    HG2  PRO  46          2HG       PRO  46 -15.501   6.044   9.305
  348    HG3  PRO  46          1HG       PRO  46 -13.761   6.277   9.530
  349    HD2  PRO  46          2HD       PRO  46 -15.180   6.456   7.075
  350    HD3  PRO  46          1HD       PRO  46 -13.417   6.404   7.281
  351    H    GLY  47           H        GLY  47 -16.143   2.275   9.626
  352    HA2  GLY  47          2HA       GLY  47 -18.376   1.868   9.976
  353    HA3  GLY  47          1HA       GLY  47 -18.730   3.209   8.896
  354    H    LEU  48           H        LEU  48 -16.766   0.506   7.923
  355    HA   LEU  48           HA       LEU  48 -18.782  -0.126   5.895
  356    HB2  LEU  48          2HB       LEU  48 -15.848  -0.794   6.085
  357    HB3  LEU  48          1HB       LEU  48 -16.894  -1.387   4.811
  358    HG   LEU  48           HG       LEU  48 -16.071   1.467   5.332
  359   HD11  LEU  48          1HD1      LEU  48 -15.652  -0.403   3.007
  360   HD12  LEU  48          2HD1      LEU  48 -14.433   0.106   4.175
  361   HD13  LEU  48          3HD1      LEU  48 -15.143   1.285   3.071
  362   HD21  LEU  48          1HD2      LEU  48 -18.418   1.472   4.711
  363   HD22  LEU  48          2HD2      LEU  48 -18.077   0.418   3.340
  364   HD23  LEU  48          3HD2      LEU  48 -17.432   2.058   3.372
  365    H    SER  49           H        SER  49 -20.045  -1.823   6.202
  366    HA   SER  49           HA       SER  49 -19.373  -4.003   7.920
  367    HB2  SER  49          2HB       SER  49 -21.730  -3.435   7.364
  368    HB3  SER  49          1HB       SER  49 -21.427  -3.877   5.682
  369    HG   SER  49           HG       SER  49 -21.957  -5.464   7.839
  370    H    TRP  50           H        TRP  50 -19.029  -6.279   7.033
  371    HA   TRP  50           HA       TRP  50 -16.712  -6.247   5.500
  372    HB2  TRP  50          2HB       TRP  50 -17.303  -8.147   6.956
  373    HB3  TRP  50          1HB       TRP  50 -18.580  -8.593   5.827
  374    HD1  TRP  50           HD       TRP  50 -14.739  -8.217   5.809
  375    HE1  TRP  50          1HE       TRP  50 -13.814  -9.906   4.103
  376    HE3  TRP  50          3HE       TRP  50 -19.159 -10.030   4.029
  377    HZ2  TRP  50          2HZ       TRP  50 -14.858 -11.763   2.276
  378    HZ3  TRP  50          3HZ       TRP  50 -19.112 -11.758   2.287
  379    HH2  TRP  50           HH       TRP  50 -16.994 -12.618   1.427
  380    H    GLU  51           H        GLU  51 -20.023  -6.952   4.502
  381    HA   GLU  51           HA       GLU  51 -19.598  -7.669   1.867
  382    HB2  GLU  51          2HB       GLU  51 -21.860  -6.003   2.965
  383    HB3  GLU  51          1HB       GLU  51 -21.872  -6.837   1.421
  384    HG2  GLU  51          2HG       GLU  51 -21.631  -8.978   2.629
  385    HG3  GLU  51          1HG       GLU  51 -21.743  -8.104   4.140
  386    H    GLN  52           H        GLN  52 -19.822  -4.437   3.266
  387    HA   GLN  52           HA       GLN  52 -19.685  -3.062   0.777
  388    HB2  GLN  52          2HB       GLN  52 -19.520  -2.256   3.644
  389    HB3  GLN  52          1HB       GLN  52 -19.008  -1.119   2.404
  390    HG2  GLN  52          2HG       GLN  52 -21.715  -2.407   2.622
  391    HG3  GLN  52          1HG       GLN  52 -21.313  -0.740   3.028
  392   HE21  GLN  52          1HE2      GLN  52 -19.453  -0.576   0.720
  393   HE22  GLN  52          2HE2      GLN  52 -20.469  -0.398  -0.669
  394    H    LEU  53           H        LEU  53 -17.293  -4.120   3.118
  395    HA   LEU  53           HA       LEU  53 -15.226  -2.496   1.969
  396    HB2  LEU  53          2HB       LEU  53 -15.091  -2.995   4.306
  397    HB3  LEU  53          1HB       LEU  53 -15.190  -4.717   4.005
  398    HG   LEU  53           HG       LEU  53 -12.876  -3.299   2.790
  399   HD11  LEU  53          1HD1      LEU  53 -13.077  -3.886   5.749
  400   HD12  LEU  53          2HD1      LEU  53 -12.988  -2.284   5.018
  401   HD13  LEU  53          3HD1      LEU  53 -11.619  -3.389   4.890
  402   HD21  LEU  53          1HD2      LEU  53 -13.200  -5.921   4.255
  403   HD22  LEU  53          2HD2      LEU  53 -11.739  -5.364   3.438
  404   HD23  LEU  53          3HD2      LEU  53 -13.196  -5.703   2.504
  405    H    GLN  54           H        GLN  54 -16.254  -5.859   1.772
  406    HA   GLN  54           HA       GLN  54 -14.038  -6.728   0.266
  407    HB2  GLN  54          2HB       GLN  54 -15.194  -8.745  -0.071
  408    HB3  GLN  54          1HB       GLN  54 -15.652  -8.180   1.514
  409    HG2  GLN  54          2HG       GLN  54 -17.812  -7.770   0.916
  410    HG3  GLN  54          1HG       GLN  54 -17.403  -7.490  -0.778
  411   HE21  GLN  54          1HE2      GLN  54 -19.429  -9.256   0.488
  412   HE22  GLN  54          2HE2      GLN  54 -19.111 -10.826  -0.150
  413    H    GLU  55           H        GLU  55 -17.157  -5.304  -0.633
  414    HA   GLU  55           HA       GLU  55 -16.779  -5.699  -3.433
  415    HB2  GLU  55          2HB       GLU  55 -18.640  -4.150  -3.767
  416    HB3  GLU  55          1HB       GLU  55 -19.032  -5.370  -2.568
  417    HG2  GLU  55          2HG       GLU  55 -18.746  -3.805  -0.802
  418    HG3  GLU  55          1HG       GLU  55 -18.113  -2.606  -1.885
  419    H    LYS  56           H        LYS  56 -15.888  -3.221  -1.144
  420    HA   LYS  56           HA       LYS  56 -15.047  -1.131  -2.719
  421    HB2  LYS  56          2HB       LYS  56 -14.552  -1.936  -0.088
  422    HB3  LYS  56          1HB       LYS  56 -12.954  -1.953  -0.835
  423    HG2  LYS  56          2HG       LYS  56 -13.252   0.190   0.135
  424    HG3  LYS  56          1HG       LYS  56 -13.419   0.402  -1.609
  425    HD2  LYS  56          2HD       LYS  56 -15.875   0.326  -1.350
  426    HD3  LYS  56          1HD       LYS  56 -15.667   0.197   0.396
  427    HE2  LYS  56          2HE       LYS  56 -16.153   2.482  -0.149
  428    HE3  LYS  56          1HE       LYS  56 -14.468   2.374   0.354
  429    HZ1  LYS  56          1HZ       LYS  56 -15.407   2.456  -2.461
  430    HZ2  LYS  56          2HZ       LYS  56 -13.797   2.425  -1.951
  431    HZ3  LYS  56          3HZ       LYS  56 -14.764   3.768  -1.611
  432    H    LYS  57           H        LYS  57 -13.430  -4.149  -2.008
  433    HA   LYS  57           HA       LYS  57 -11.186  -3.437  -3.734
  434    HB2  LYS  57          2HB       LYS  57 -11.351  -5.956  -2.143
  435    HB3  LYS  57          1HB       LYS  57  -9.968  -4.958  -2.530
  436    HG2  LYS  57          2HG       LYS  57 -10.171  -3.717  -0.729
  437    HG3  LYS  57          1HG       LYS  57 -11.907  -3.581  -0.914
  438    HD2  LYS  57          2HD       LYS  57 -11.427  -4.749   1.148
  439    HD3  LYS  57          1HD       LYS  57 -12.145  -5.871   0.001
  440    HE2  LYS  57          2HE       LYS  57 -10.024  -6.533   1.390
  441    HE3  LYS  57          1HE       LYS  57 -10.201  -7.060  -0.272
  442    HZ1  LYS  57          1HZ       LYS  57  -7.994  -6.180   0.175
  443    HZ2  LYS  57          2HZ       LYS  57  -8.657  -4.688   0.619
  444    HZ3  LYS  57          3HZ       LYS  57  -8.799  -5.236  -0.973
  445    H    LYS  58           H        LYS  58 -14.079  -5.020  -4.149
  446    HA   LYS  58           HA       LYS  58 -13.420  -7.410  -5.423
  447    HB2  LYS  58          2HB       LYS  58 -15.765  -5.580  -5.553
  448    HB3  LYS  58          1HB       LYS  58 -15.610  -6.804  -6.804
  449    HG2  LYS  58          2HG       LYS  58 -15.546  -8.548  -5.099
  450    HG3  LYS  58          1HG       LYS  58 -15.692  -7.322  -3.838
  451    HD2  LYS  58          2HD       LYS  58 -17.869  -6.651  -4.751
  452    HD3  LYS  58          1HD       LYS  58 -17.713  -7.870  -6.014
  453    HE2  LYS  58          2HE       LYS  58 -17.724  -8.488  -3.064
  454    HE3  LYS  58          1HE       LYS  58 -19.158  -8.540  -4.088
  455    HZ1  LYS  58          1HZ       LYS  58 -18.076 -10.227  -5.444
  456    HZ2  LYS  58          2HZ       LYS  58 -18.200 -10.726  -3.835
  457    HZ3  LYS  58          3HZ       LYS  58 -16.717 -10.191  -4.437
  458    H    GLY  59           H        GLY  59 -12.077  -7.683  -7.023
  459    HA2  GLY  59          2HA       GLY  59 -12.145  -7.327  -9.558
  460    HA3  GLY  59          1HA       GLY  59 -11.906  -5.638  -9.132
  461    H    ARG  60           H        ARG  60 -10.140  -6.222  -6.885
  462    HA   ARG  60           HA       ARG  60  -7.861  -7.474  -8.147
  463    HB2  ARG  60          2HB       ARG  60  -8.111  -5.023  -8.960
  464    HB3  ARG  60          1HB       ARG  60  -7.527  -4.603  -7.354
  465    HG2  ARG  60          2HG       ARG  60  -5.718  -4.645  -8.980
  466    HG3  ARG  60          1HG       ARG  60  -5.496  -5.884  -7.740
  467    HD2  ARG  60          2HD       ARG  60  -6.275  -7.595  -9.217
  468    HD3  ARG  60          1HD       ARG  60  -6.744  -6.400 -10.432
  469    HE   ARG  60           HE       ARG  60  -3.930  -6.751  -9.617
  470   HH11  ARG  60          1HH1      ARG  60  -6.392  -6.647 -12.113
  471   HH12  ARG  60          2HH1      ARG  60  -5.252  -6.762 -13.410
  472   HH21  ARG  60          1HH2      ARG  60  -2.441  -6.921 -11.332
  473   HH22  ARG  60          2HH2      ARG  60  -3.009  -6.929 -12.970
  474    H    ALA  61           H        ALA  61  -9.245  -8.099  -5.774
  475    HA   ALA  61           HA       ALA  61  -6.892  -8.023  -4.053
  476    HB1  ALA  61          1HB       ALA  61  -9.607  -7.503  -2.865
  477    HB2  ALA  61          2HB       ALA  61  -8.474  -6.220  -3.283
  478    HB3  ALA  61          3HB       ALA  61  -8.035  -7.418  -2.061
  479    H    ALA  62           H        ALA  62  -9.029  -9.758  -5.681
  480    HA   ALA  62           HA       ALA  62 -10.006 -11.810  -5.579
  481    HB1  ALA  62          1HB       ALA  62  -8.529 -13.585  -4.836
  482    HB2  ALA  62          2HB       ALA  62  -7.537 -12.422  -3.956
  483    HB3  ALA  62          3HB       ALA  62  -7.613 -12.363  -5.718
  484    H    ALA  63           H        ALA  63 -11.113 -10.099  -3.763
  485    HA   ALA  63           HA       ALA  63 -12.253  -9.835  -1.825
  486    HB1  ALA  63          1HB       ALA  63 -13.175 -12.070  -2.307
  487    HB2  ALA  63          2HB       ALA  63 -13.014 -11.762  -0.577
  488    HB3  ALA  63          3HB       ALA  63 -11.845 -12.793  -1.403
  489    H    ASN  64           H        ASN  64  -9.864 -12.340  -1.000
  490    HA   ASN  64           HA       ASN  64  -8.700 -10.452   0.924
  491    HB2  ASN  64          2HB       ASN  64  -8.964 -13.450   1.090
  492    HB3  ASN  64          1HB       ASN  64  -7.848 -12.544   2.107
  493   HD21  ASN  64          1HD2      ASN  64  -9.606 -10.243   2.281
  494   HD22  ASN  64          2HD2      ASN  64 -10.885 -10.682   3.371
  495    H    GLY  65           H        GLY  65  -6.848  -9.712   0.379
  496    HA2  GLY  65          2HA       GLY  65  -4.491 -10.424  -0.236
  497    HA3  GLY  65          1HA       GLY  65  -5.254 -11.235  -1.590
  498    H    TYR  66           H        TYR  66  -5.174  -7.969  -0.109
  499    HA   TYR  66           HA       TYR  66  -5.599  -6.662  -2.619
  500    HB2  TYR  66          2HB       TYR  66  -5.668  -5.784  -0.014
  501    HB3  TYR  66          1HB       TYR  66  -4.130  -5.144  -0.584
  502    HD1  TYR  66          1HD       TYR  66  -5.045  -2.944  -0.106
  503    HD2  TYR  66          2HD       TYR  66  -6.770  -5.401  -3.092
  504    HE1  TYR  66          1HE       TYR  66  -6.137  -0.966  -1.064
  505    HE2  TYR  66          2HE       TYR  66  -7.881  -3.443  -4.070
  506    HH   TYR  66           HH       TYR  66  -7.045  -0.273  -3.273
  507    H    ASP  67           H        ASP  67  -4.240  -6.670  -4.210
  508    HA   ASP  67           HA       ASP  67  -1.530  -7.442  -3.774
  509    HB2  ASP  67          2HB       ASP  67  -1.686  -8.203  -5.873
  510    HB3  ASP  67          1HB       ASP  67  -3.401  -7.788  -5.762
  511    H    ARG  68           H        ARG  68   0.172  -6.307  -4.732
  512    HA   ARG  68           HA       ARG  68   0.428  -3.816  -3.524
  513    HB2  ARG  68          2HB       ARG  68   2.651  -3.748  -4.710
  514    HB3  ARG  68          1HB       ARG  68   2.352  -5.182  -3.741
  515    HG2  ARG  68          2HG       ARG  68   1.591  -6.277  -5.922
  516    HG3  ARG  68          1HG       ARG  68   2.361  -4.907  -6.725
  517    HD2  ARG  68          2HD       ARG  68   3.710  -6.812  -4.812
  518    HD3  ARG  68          1HD       ARG  68   3.858  -6.847  -6.567
  519    HE   ARG  68           HE       ARG  68   4.654  -4.351  -5.994
  520   HH11  ARG  68          1HH1      ARG  68   5.578  -7.462  -4.643
  521   HH12  ARG  68          2HH1      ARG  68   7.192  -6.937  -4.239
  522   HH21  ARG  68          1HH2      ARG  68   6.776  -3.690  -5.491
  523   HH22  ARG  68          2HH2      ARG  68   7.870  -4.807  -4.725
  524    H    SER  69           H        SER  69  -0.492  -4.601  -6.814
  525    HA   SER  69           HA       SER  69  -0.139  -1.931  -7.798
  526    HB2  SER  69          2HB       SER  69  -0.237  -3.894  -9.300
  527    HB3  SER  69          1HB       SER  69  -1.927  -4.133  -8.860
  528    HG   SER  69           HG       SER  69  -0.882  -1.767 -10.037
  529    H    ALA  70           H        ALA  70  -2.922  -3.815  -6.656
  530    HA   ALA  70           HA       ALA  70  -4.867  -1.794  -6.966
  531    HB1  ALA  70          1HB       ALA  70  -6.298  -3.176  -5.699
  532    HB2  ALA  70          2HB       ALA  70  -4.946  -3.953  -4.875
  533    HB3  ALA  70          3HB       ALA  70  -5.243  -4.275  -6.589
  534    H    PHE  71           H        PHE  71  -3.027  -2.888  -4.167
  535    HA   PHE  71           HA       PHE  71  -4.110  -1.138  -2.291
  536    HB2  PHE  71          2HB       PHE  71  -2.723  -3.094  -1.694
  537    HB3  PHE  71          1HB       PHE  71  -1.310  -2.291  -2.382
  538    HD1  PHE  71          1HD       PHE  71  -3.533  -2.507   0.465
  539    HD2  PHE  71          2HD       PHE  71  -0.351  -0.316  -1.285
  540    HE1  PHE  71          1HE       PHE  71  -3.114  -1.422   2.625
  541    HE2  PHE  71          2HE       PHE  71   0.083   0.759   0.875
  542    HZ   PHE  71           HZ       PHE  71  -1.295   0.224   2.826
  543    H    PHE  72           H        PHE  72  -1.265  -0.781  -4.408
  544    HA   PHE  72           HA       PHE  72  -0.463   1.649  -3.212
  545    HB2  PHE  72          2HB       PHE  72   1.100   0.218  -4.479
  546    HB3  PHE  72          1HB       PHE  72   0.265   0.673  -5.965
  547    HD1  PHE  72          1HD       PHE  72   2.230   1.989  -3.133
  548    HD2  PHE  72          2HD       PHE  72   0.718   2.721  -7.043
  549    HE1  PHE  72          1HE       PHE  72   3.591   4.030  -3.274
  550    HE2  PHE  72          2HE       PHE  72   2.084   4.759  -7.193
  551    HZ   PHE  72           HZ       PHE  72   3.519   5.416  -5.307
  552    H    SER  73           H        SER  73  -2.409   0.950  -6.046
  553    HA   SER  73           HA       SER  73  -2.453   3.571  -7.065
  554    HB2  SER  73          2HB       SER  73  -4.575   2.767  -8.246
  555    HB3  SER  73          1HB       SER  73  -3.095   1.866  -8.556
  556    HG   SER  73           HG       SER  73  -3.822   0.206  -7.384
  557    H    LEU  74           H        LEU  74  -4.447   1.950  -4.680
  558    HA   LEU  74           HA       LEU  74  -6.328   4.070  -4.374
  559    HB2  LEU  74          2HB       LEU  74  -6.766   1.748  -3.647
  560    HB3  LEU  74          1HB       LEU  74  -5.524   1.912  -2.422
  561    HG   LEU  74           HG       LEU  74  -6.850   3.537  -1.223
  562   HD11  LEU  74          1HD1      LEU  74  -7.870   4.684  -3.118
  563   HD12  LEU  74          2HD1      LEU  74  -9.100   4.150  -1.972
  564   HD13  LEU  74          3HD1      LEU  74  -8.843   3.256  -3.471
  565   HD21  LEU  74          1HD2      LEU  74  -7.306   1.266  -0.676
  566   HD22  LEU  74          2HD2      LEU  74  -8.339   1.078  -2.092
  567   HD23  LEU  74          3HD2      LEU  74  -8.857   2.107  -0.754
  568    H    VAL  75           H        VAL  75  -3.339   3.195  -2.682
  569    HA   VAL  75           HA       VAL  75  -3.567   5.189  -0.669
  570    HB   VAL  75           HB       VAL  75  -1.057   3.787  -1.605
  571   HG11  VAL  75          1HG1      VAL  75  -0.230   5.375  -0.225
  572   HG12  VAL  75          2HG1      VAL  75  -0.582   4.080   0.927
  573   HG13  VAL  75          3HG1      VAL  75  -1.691   5.443   0.757
  574   HG21  VAL  75          1HG2      VAL  75  -2.541   2.060  -1.018
  575   HG22  VAL  75          2HG2      VAL  75  -3.161   2.967   0.361
  576   HG23  VAL  75          3HG2      VAL  75  -1.518   2.321   0.403
  577    H    ALA  76           H        ALA  76  -1.951   5.076  -3.801
  578    HA   ALA  76           HA       ALA  76  -0.336   7.346  -3.520
  579    HB1  ALA  76          1HB       ALA  76  -1.525   6.229  -6.050
  580    HB2  ALA  76          2HB       ALA  76  -0.036   5.677  -5.283
  581    HB3  ALA  76          3HB       ALA  76  -0.137   7.310  -5.939
  582    H    SER  77           H        SER  77  -3.730   7.102  -4.039
  583    HA   SER  77           HA       SER  77  -3.886   9.891  -4.929
  584    HB2  SER  77          2HB       SER  77  -5.182   8.177  -6.172
  585    HB3  SER  77          1HB       SER  77  -6.072   7.807  -4.698
  586    HG   SER  77           HG       SER  77  -6.480  10.259  -4.807
  587    H    ASP  78           H        ASP  78  -4.161   7.952  -2.161
  588    HA   ASP  78           HA       ASP  78  -5.732   9.999  -0.744
  589    HB2  ASP  78          2HB       ASP  78  -5.604   7.027  -0.545
  590    HB3  ASP  78          1HB       ASP  78  -5.957   7.950   0.909
  591    H    GLU  79           H        GLU  79  -4.294  11.346   0.204
  592    HA   GLU  79           HA       GLU  79  -1.667  10.598   0.921
  593    HB2  GLU  79          2HB       GLU  79  -1.355  12.750   1.604
  594    HB3  GLU  79          1HB       GLU  79  -2.700  12.961   0.495
  595    HG2  GLU  79          2HG       GLU  79  -4.245  13.009   2.373
  596    HG3  GLU  79          1HG       GLU  79  -2.900  12.739   3.489
  597    H    GLN  80           H        GLN  80  -4.678  10.656   2.775
  598    HA   GLN  80           HA       GLN  80  -3.434  10.405   5.294
  599    HB2  GLN  80          2HB       GLN  80  -5.528  10.198   6.175
  600    HB3  GLN  80          1HB       GLN  80  -5.935  10.858   4.605
  601    HG2  GLN  80          2HG       GLN  80  -5.848   7.973   4.599
  602    HG3  GLN  80          1HG       GLN  80  -7.005   8.626   5.760
  603   HE21  GLN  80          1HE2      GLN  80  -6.185   8.266   2.451
  604   HE22  GLN  80          2HE2      GLN  80  -7.673   8.849   1.797
  605    H    TYR  81           H        TYR  81  -3.772   8.311   2.708
  606    HA   TYR  81           HA       TYR  81  -3.580   5.850   4.218
  607    HB2  TYR  81          2HB       TYR  81  -3.856   6.495   1.300
  608    HB3  TYR  81          1HB       TYR  81  -3.315   4.897   1.804
  609    HD1  TYR  81          1HD       TYR  81  -5.631   4.731   0.284
  610    HD2  TYR  81          2HD       TYR  81  -5.347   5.874   4.364
  611    HE1  TYR  81          1HE       TYR  81  -7.946   3.948   0.663
  612    HE2  TYR  81          2HE       TYR  81  -7.631   5.133   4.734
  613    HH   TYR  81           HH       TYR  81  -9.321   3.208   2.539
  614    H    VAL  82           H        VAL  82  -1.573   7.780   1.998
  615    HA   VAL  82           HA       VAL  82   0.629   6.092   2.041
  616    HB   VAL  82           HB       VAL  82   1.842   8.080   1.339
  617   HG11  VAL  82          1HG1      VAL  82  -0.721   7.564  -0.071
  618   HG12  VAL  82          2HG1      VAL  82   0.848   6.825  -0.397
  619   HG13  VAL  82          3HG1      VAL  82   0.585   8.533  -0.757
  620   HG21  VAL  82          1HG2      VAL  82  -0.632   9.524   1.958
  621   HG22  VAL  82          2HG2      VAL  82   0.528  10.138   0.781
  622   HG23  VAL  82          3HG2      VAL  82   1.022   9.886   2.456
  623    H    ARG  83           H        ARG  83  -0.091   8.988   3.863
  624    HA   ARG  83           HA       ARG  83   2.076   8.825   5.605
  625    HB2  ARG  83          2HB       ARG  83   1.042  10.650   6.763
  626    HB3  ARG  83          1HB       ARG  83   0.822  10.893   5.053
  627    HG2  ARG  83          2HG       ARG  83  -1.421   9.957   5.277
  628    HG3  ARG  83          1HG       ARG  83  -1.218   9.928   7.032
  629    HD2  ARG  83          2HD       ARG  83  -1.234  12.214   5.148
  630    HD3  ARG  83          1HD       ARG  83  -2.401  11.892   6.417
  631    HE   ARG  83           HE       ARG  83   0.103  12.208   7.612
  632   HH11  ARG  83          1HH1      ARG  83  -2.234  14.113   5.830
  633   HH12  ARG  83          2HH1      ARG  83  -1.796  15.604   6.603
  634   HH21  ARG  83          1HH2      ARG  83   0.686  14.174   8.630
  635   HH22  ARG  83          2HH2      ARG  83  -0.128  15.641   8.188
  636    H    PHE  84           H        PHE  84  -1.099   7.371   5.660
  637    HA   PHE  84           HA       PHE  84  -1.240   6.676   8.377
  638    HB2  PHE  84          2HB       PHE  84  -2.687   5.998   6.094
  639    HB3  PHE  84          1HB       PHE  84  -2.030   4.454   6.647
  640    HD1  PHE  84          1HD       PHE  84  -2.763   3.472   8.702
  641    HD2  PHE  84          2HD       PHE  84  -4.236   7.270   7.486
  642    HE1  PHE  84          1HE       PHE  84  -4.543   3.320  10.394
  643    HE2  PHE  84          2HE       PHE  84  -6.018   7.127   9.176
  644    HZ   PHE  84           HZ       PHE  84  -6.174   5.152  10.634
  645    H    ILE  85           H        ILE  85   0.317   5.002   5.679
  646    HA   ILE  85           HA       ILE  85   1.357   2.951   7.412
  647    HB   ILE  85           HB       ILE  85   1.662   3.508   4.491
  648   HG12  ILE  85          2HG1      ILE  85   0.787   1.138   6.160
  649   HG13  ILE  85          1HG1      ILE  85  -0.246   2.193   5.203
  650   HG21  ILE  85          1HG2      ILE  85   3.433   1.747   6.161
  651   HG22  ILE  85          2HG2      ILE  85   3.907   3.022   5.040
  652   HG23  ILE  85          3HG2      ILE  85   3.224   1.516   4.428
  653   HD11  ILE  85          1HD1      ILE  85   1.849   0.310   4.105
  654   HD12  ILE  85          2HD1      ILE  85   0.770   1.348   3.158
  655   HD13  ILE  85          3HD1      ILE  85   0.106   0.035   4.130
  656    H    ALA  86           H        ALA  86   2.763   5.709   5.677
  657    HA   ALA  86           HA       ALA  86   5.386   5.558   6.464
  658    HB1  ALA  86          1HB       ALA  86   4.447   7.263   4.941
  659    HB2  ALA  86          2HB       ALA  86   5.483   7.965   6.183
  660    HB3  ALA  86          3HB       ALA  86   3.731   8.079   6.330
  661    H    GLN  87           H        GLN  87   2.644   6.692   8.379
  662    HA   GLN  87           HA       GLN  87   4.257   7.547  10.583
  663    HB2  GLN  87          2HB       GLN  87   1.993   8.454  10.103
  664    HB3  GLN  87          1HB       GLN  87   1.306   6.888  10.506
  665    HG2  GLN  87          2HG       GLN  87   2.102   7.101  12.787
  666    HG3  GLN  87          1HG       GLN  87   2.854   8.644  12.394
  667   HE21  GLN  87          1HE2      GLN  87  -0.130   6.973  12.970
  668   HE22  GLN  87          2HE2      GLN  87  -1.122   8.384  13.115
  669    H    HIS  88           H        HIS  88   2.580   4.594   9.698
  670    HA   HIS  88           HA       HIS  88   2.983   3.304  12.224
  671    HB2  HIS  88          2HB       HIS  88   2.240   2.243   9.500
  672    HB3  HIS  88          1HB       HIS  88   2.446   1.197  10.896
  673    HD1  HIS  88          1HD       HIS  88   0.973   3.150  12.938
  674    HD2  HIS  88          2HD       HIS  88  -0.477   1.884   9.248
  675    HE1  HIS  88          1HE       HIS  88  -1.523   3.344  13.087
  676    HE2  HIS  88          2HE       HIS  88  -2.387   2.420  10.907
  677    H    PHE  89           H        PHE  89   4.765   3.439   9.181
  678    HA   PHE  89           HA       PHE  89   6.961   1.950  10.406
  679    HB2  PHE  89          2HB       PHE  89   5.291   0.407   9.217
  680    HB3  PHE  89          1HB       PHE  89   5.867   1.132   7.726
  681    HD1  PHE  89          1HD       PHE  89   7.637   0.188   6.626
  682    HD2  PHE  89          2HD       PHE  89   7.133  -0.597  10.772
  683    HE1  PHE  89          1HE       PHE  89   9.447  -1.475   6.523
  684    HE2  PHE  89          2HE       PHE  89   8.960  -2.243  10.688
  685    HZ   PHE  89           HZ       PHE  89  10.120  -2.685   8.560
  686    HA   PRO  90           HA       PRO  90   9.207   5.256   8.220
  687    HB2  PRO  90          2HB       PRO  90  11.337   3.425   9.227
  688    HB3  PRO  90          1HB       PRO  90  11.240   5.185   9.310
  689    HG2  PRO  90          2HG       PRO  90  10.743   3.702  11.457
  690    HG3  PRO  90          1HG       PRO  90   9.785   5.153  11.112
  691    HD2  PRO  90          2HD       PRO  90   9.055   2.286  10.789
  692    HD3  PRO  90          1HD       PRO  90   8.036   3.669  11.231
  693    H    CYS  91           H        CYS  91  10.750   5.252   6.461
  694    HA   CYS  91           HA       CYS  91   9.961   3.375   4.475
  695    HB2  CYS  91          2HB       CYS  91  11.485   4.724   3.002
  696    HB3  CYS  91          1HB       CYS  91  10.315   5.707   3.902
  697    HG   CYS  91           HG       CYS  91  13.400   5.260   5.250
  698    H    ALA  92           H        ALA  92  10.623   1.429   4.493
  699    HA   ALA  92           HA       ALA  92  13.515   0.885   4.599
  700    HB1  ALA  92          1HB       ALA  92  11.336  -0.826   5.804
  701    HB2  ALA  92          2HB       ALA  92  12.471   0.177   6.706
  702    HB3  ALA  92          3HB       ALA  92  13.060  -1.203   5.779
  703    HA   PRO  93           HA       PRO  93  12.621  -1.501   0.906
  704    HB2  PRO  93          2HB       PRO  93  14.708  -3.163   0.829
  705    HB3  PRO  93          1HB       PRO  93  14.924  -1.430   0.604
  706    HG2  PRO  93          2HG       PRO  93  15.383  -3.090   3.049
  707    HG3  PRO  93          1HG       PRO  93  16.394  -1.801   2.371
  708    HD2  PRO  93          2HD       PRO  93  14.648  -1.440   4.459
  709    HD3  PRO  93          1HD       PRO  93  15.147  -0.145   3.351
  710    H    GLU  94           H        GLU  94  11.953  -3.611   0.204
  711    HA   GLU  94           HA       GLU  94  11.673  -5.647   2.266
  712    HB2  GLU  94          2HB       GLU  94   9.571  -4.311   2.219
  713    HB3  GLU  94          1HB       GLU  94   9.391  -4.693   0.513
  714    HG2  GLU  94          2HG       GLU  94   7.976  -6.063   2.018
  715    HG3  GLU  94          1HG       GLU  94   9.056  -7.006   0.995
  716    H    GLU  95           H        GLU  95  11.174  -7.712   1.355
  717    HA   GLU  95           HA       GLU  95  11.403  -9.457  -0.075
  718    HB2  GLU  95          2HB       GLU  95  11.504  -7.322  -2.201
  719    HB3  GLU  95          1HB       GLU  95  11.496  -9.046  -2.538
  720    HG2  GLU  95          2HG       GLU  95   9.315  -9.142  -1.290
  721    HG3  GLU  95          1HG       GLU  95   9.359  -7.380  -1.283
  722    H    GLU  96           H        GLU  96  13.047 -10.656  -1.103
  723    HA   GLU  96           HA       GLU  96  15.673  -9.790  -0.296
  724    HB2  GLU  96          2HB       GLU  96  16.370 -12.049  -1.037
  725    HB3  GLU  96          1HB       GLU  96  15.038 -12.083   0.110
  726    HG2  GLU  96          2HG       GLU  96  13.473 -12.382  -1.763
  727    HG3  GLU  96          1HG       GLU  96  14.842 -12.432  -2.871
  728    H    LYS  97           H        LYS  97  13.832  -9.784  -3.164
  729    HA   LYS  97           HA       LYS  97  15.929  -9.754  -5.062
  730    HB2  LYS  97          2HB       LYS  97  13.142  -8.583  -5.158
  731    HB3  LYS  97          1HB       LYS  97  14.229  -8.646  -6.538
  732    HG2  LYS  97          2HG       LYS  97  14.264 -11.093  -6.391
  733    HG3  LYS  97          1HG       LYS  97  13.154 -11.018  -5.023
  734    HD2  LYS  97          2HD       LYS  97  12.527  -9.882  -7.741
  735    HD3  LYS  97          1HD       LYS  97  12.093 -11.517  -7.247
  736    HE2  LYS  97          2HE       LYS  97  11.238  -9.015  -5.800
  737    HE3  LYS  97          1HE       LYS  97  10.256  -9.857  -6.996
  738    HZ1  LYS  97          1HZ       LYS  97  10.148 -11.765  -5.606
  739    HZ2  LYS  97          2HZ       LYS  97   9.744 -10.428  -4.643
  740    HZ3  LYS  97          3HZ       LYS  97  11.277 -11.134  -4.522
  741    HA   PRO  98           HA       PRO  98  18.092  -6.187  -3.796
  742    HB2  PRO  98          2HB       PRO  98  18.862  -5.369  -6.379
  743    HB3  PRO  98          1HB       PRO  98  19.759  -6.428  -5.290
  744    HG2  PRO  98          2HG       PRO  98  17.964  -7.124  -7.558
  745    HG3  PRO  98          1HG       PRO  98  19.434  -7.939  -6.993
  746    HD2  PRO  98          2HD       PRO  98  17.024  -8.962  -6.498
  747    HD3  PRO  98          1HD       PRO  98  18.309  -9.035  -5.273
  748    HA   PRO  99           HA       PRO  99  14.877  -3.126  -4.752
  749    HB2  PRO  99          2HB       PRO  99  15.240  -2.090  -2.108
  750    HB3  PRO  99          1HB       PRO  99  13.881  -3.030  -2.724
  751    HG2  PRO  99          2HG       PRO  99  15.676  -3.916  -0.821
  752    HG3  PRO  99          1HG       PRO  99  14.668  -4.967  -1.830
  753    HD2  PRO  99          2HD       PRO  99  17.545  -4.223  -2.140
  754    HD3  PRO  99          1HD       PRO  99  16.737  -5.775  -2.448
  755    H    GLU 100           H        GLU 100  15.879  -1.713  -6.086
  756    HA   GLU 100           HA       GLU 100  18.272  -0.328  -5.487
  757    HB2  GLU 100          2HB       GLU 100  17.160  -0.796  -7.778
  758    HB3  GLU 100          1HB       GLU 100  16.209   0.641  -7.441
  759    HG2  GLU 100          2HG       GLU 100  18.069   1.212  -8.828
  760    HG3  GLU 100          1HG       GLU 100  18.247   1.945  -7.236
  761    H    ILE 101           H        ILE 101  15.004   1.036  -5.927
  762    HA   ILE 101           HA       ILE 101  15.585   2.888  -3.712
  763    HB   ILE 101           HB       ILE 101  13.665   3.266  -6.019
  764   HG12  ILE 101          2HG1      ILE 101  16.222   4.711  -5.302
  765   HG13  ILE 101          1HG1      ILE 101  16.027   3.580  -6.633
  766   HG21  ILE 101          1HG2      ILE 101  13.231   5.481  -5.088
  767   HG22  ILE 101          2HG2      ILE 101  14.284   5.123  -3.721
  768   HG23  ILE 101          3HG2      ILE 101  12.786   4.218  -3.940
  769   HD11  ILE 101          1HD1      ILE 101  14.420   5.136  -7.635
  770   HD12  ILE 101          2HD1      ILE 101  16.022   5.837  -7.403
  771   HD13  ILE 101          3HD1      ILE 101  14.715   6.246  -6.298
  772    H    ASP 102           H        ASP 102  13.082   0.974  -5.279
  773    HA   ASP 102           HA       ASP 102  11.451  -0.366  -4.482
  774    HB2  ASP 102          2HB       ASP 102  13.245  -0.910  -2.719
  775    HB3  ASP 102          1HB       ASP 102  12.363   0.176  -1.666
  776    H    ALA 103           H        ALA 103  11.063   2.360  -4.957
  777    HA   ALA 103           HA       ALA 103   8.842   2.950  -3.119
  778    HB1  ALA 103          1HB       ALA 103   9.132   5.343  -4.000
  779    HB2  ALA 103          2HB       ALA 103  10.706   4.798  -4.587
  780    HB3  ALA 103          3HB       ALA 103  10.341   4.738  -2.865
  781    H    LEU 104           H        LEU 104   9.818   4.018  -6.359
  782    HA   LEU 104           HA       LEU 104   7.119   3.525  -7.325
  783    HB2  LEU 104          2HB       LEU 104   9.444   4.509  -8.973
  784    HB3  LEU 104          1HB       LEU 104   7.735   4.713  -9.289
  785    HG   LEU 104           HG       LEU 104   9.428   6.154  -7.261
  786   HD11  LEU 104          1HD1      LEU 104   8.598   8.135  -8.417
  787   HD12  LEU 104          2HD1      LEU 104   7.687   7.108  -9.524
  788   HD13  LEU 104          3HD1      LEU 104   9.451   7.051  -9.514
  789   HD21  LEU 104          1HD2      LEU 104   6.425   6.073  -7.449
  790   HD22  LEU 104          2HD2      LEU 104   7.333   7.301  -6.567
  791   HD23  LEU 104          3HD2      LEU 104   7.434   5.609  -6.077
  792    H    GLU 105           H        GLU 105  10.405   2.766  -8.416
  793    HA   GLU 105           HA       GLU 105   9.753  -0.037  -8.620
  794    HB2  GLU 105          2HB       GLU 105  10.219   1.687 -11.010
  795    HB3  GLU 105          1HB       GLU 105  10.928   0.082 -11.010
  796    HG2  GLU 105          2HG       GLU 105   8.625  -0.798 -10.463
  797    HG3  GLU 105          1HG       GLU 105   8.027   0.821 -10.817
  798    H    LEU 106           H        LEU 106  12.092  -0.710 -10.137
  799    HA   LEU 106           HA       LEU 106  14.065  -0.326  -8.067
  800    HB2  LEU 106          2HB       LEU 106  14.248  -1.810 -10.690
  801    HB3  LEU 106          1HB       LEU 106  15.451  -1.851  -9.415
  802    HG   LEU 106           HG       LEU 106  12.621  -2.880  -9.180
  803   HD11  LEU 106          1HD1      LEU 106  14.005  -4.256 -10.647
  804   HD12  LEU 106          2HD1      LEU 106  13.649  -5.088  -9.134
  805   HD13  LEU 106          3HD1      LEU 106  15.236  -4.364  -9.389
  806   HD21  LEU 106          1HD2      LEU 106  14.935  -2.996  -7.249
  807   HD22  LEU 106          2HD2      LEU 106  13.386  -3.813  -7.044
  808   HD23  LEU 106          3HD2      LEU 106  13.456  -2.052  -7.055
  809    H    LYS 107           H        LYS 107  14.461  -0.076 -11.607
  810    HA   LYS 107           HA       LYS 107  16.007   2.383 -11.130
  811    HB2  LYS 107          2HB       LYS 107  17.462   0.412 -11.621
  812    HB3  LYS 107          1HB       LYS 107  16.658   0.255 -13.176
  813    HG2  LYS 107          2HG       LYS 107  17.418   2.582 -13.705
  814    HG3  LYS 107          1HG       LYS 107  18.378   2.532 -12.227
  815    HD2  LYS 107          2HD       LYS 107  19.795   1.966 -14.080
  816    HD3  LYS 107          1HD       LYS 107  19.533   0.516 -13.113
  817    HE2  LYS 107          2HE       LYS 107  19.386   0.059 -15.523
  818    HE3  LYS 107          1HE       LYS 107  17.868  -0.273 -14.692
  819    HZ1  LYS 107          1HZ       LYS 107  18.457   2.214 -16.209
  820    HZ2  LYS 107          2HZ       LYS 107  16.981   1.802 -15.495
  821    HZ3  LYS 107          3HZ       LYS 107  17.562   0.910 -16.806
  822    H    THR 108           H        THR 108  13.788   3.258 -11.609
  823    HA   THR 108           HA       THR 108  13.850   4.505 -14.096
  824    HB   THR 108           HB       THR 108  13.137   2.319 -15.006
  825    HG1  THR 108          1HG       THR 108  12.126   3.559 -16.380
  826   HG21  THR 108          1HG2      THR 108  11.914   1.441 -13.097
  827   HG22  THR 108          2HG2      THR 108  10.867   1.485 -14.517
  828   HG23  THR 108          3HG2      THR 108  10.702   2.712 -13.260
  829    H    GLN 109           H        GLN 109  12.448   6.204 -14.188
  830    HA   GLN 109           HA       GLN 109  10.604   6.557 -11.934
  831    HB2  GLN 109          2HB       GLN 109  11.738   8.505 -13.953
  832    HB3  GLN 109          1HB       GLN 109  10.489   8.934 -12.794
  833    HG2  GLN 109          2HG       GLN 109  13.229   7.927 -12.068
  834    HG3  GLN 109          1HG       GLN 109  12.754   9.626 -12.112
  835   HE21  GLN 109          1HE2      GLN 109  11.300  10.402 -10.562
  836   HE22  GLN 109          2HE2      GLN 109  11.010   9.555  -9.087
  837    H    LYS 110           H        LYS 110  10.657   5.391 -14.981
  838    HA   LYS 110           HA       LYS 110   8.066   6.490 -15.799
  839    HB2  LYS 110          2HB       LYS 110  10.267   6.247 -17.276
  840    HB3  LYS 110          1HB       LYS 110   9.654   4.618 -17.504
  841    HG2  LYS 110          2HG       LYS 110   8.103   7.125 -18.116
  842    HG3  LYS 110          1HG       LYS 110   9.018   6.194 -19.300
  843    HD2  LYS 110          2HD       LYS 110   7.602   4.246 -18.848
  844    HD3  LYS 110          1HD       LYS 110   6.682   5.194 -17.676
  845    HE2  LYS 110          2HE       LYS 110   6.938   5.780 -20.623
  846    HE3  LYS 110          1HE       LYS 110   5.534   5.069 -19.832
  847    HZ1  LYS 110          1HZ       LYS 110   5.236   7.432 -20.212
  848    HZ2  LYS 110          2HZ       LYS 110   6.620   7.782 -19.308
  849    HZ3  LYS 110          3HZ       LYS 110   5.270   7.099 -18.556
  850    H    GLY 111           H        GLY 111   6.998   5.259 -14.113
  851    HA2  GLY 111          2HA       GLY 111   7.045   2.399 -14.130
  852    HA3  GLY 111          1HA       GLY 111   5.898   3.420 -13.271
  853    H    PHE 112           H        PHE 112   6.455   1.470 -16.012
  854    HA   PHE 112           HA       PHE 112   3.683   1.463 -16.698
  855    HB2  PHE 112          2HB       PHE 112   4.404   3.518 -17.880
  856    HB3  PHE 112          1HB       PHE 112   5.624   2.585 -18.737
  857    HD1  PHE 112          1HD       PHE 112   5.120   1.848 -20.852
  858    HD2  PHE 112          2HD       PHE 112   1.948   2.544 -18.104
  859    HE1  PHE 112          1HE       PHE 112   3.483   1.332 -22.615
  860    HE2  PHE 112          2HE       PHE 112   0.305   2.032 -19.861
  861    HZ   PHE 112           HZ       PHE 112   1.073   1.424 -22.121
  Start of MODEL    8
    1    H1   GLY   1          1HT       GLY   1   5.176  18.265  -2.613
    2    H2   GLY   1          2HT       GLY   1   5.901  19.514  -1.736
    3    H    GLY   1           H        GLY   1   5.299  19.158  -2.386
    4    H3   GLY   1          3HT       GLY   1   6.024  17.916  -1.193
    5    HA2  GLY   1          1HA       GLY   1   8.087  18.634  -2.215
    6    HA3  GLY   1          2HA       GLY   1   7.341  17.317  -3.108
    7    H    SER   2           H        SER   2   8.113  17.753  -5.115
    8    HA   SER   2           HA       SER   2   7.057  20.185  -6.369
    9    HB2  SER   2          2HB       SER   2   9.543  20.386  -5.872
   10    HB3  SER   2          1HB       SER   2   9.797  19.057  -7.002
   11    HG   SER   2           HG       SER   2   9.245  21.702  -7.483
   12    H    ALA   3           H        ALA   3   5.468  18.295  -6.669
   13    HA   ALA   3           HA       ALA   3   6.263  16.485  -8.818
   14    HB1  ALA   3          1HB       ALA   3   3.730  16.541  -7.189
   15    HB2  ALA   3          2HB       ALA   3   5.141  15.538  -6.859
   16    HB3  ALA   3          3HB       ALA   3   4.210  15.289  -8.334
   17    H    MET   4           H        MET   4   4.584  16.074 -10.533
   18    HA   MET   4           HA       MET   4   3.105  18.463 -11.326
   19    HB2  MET   4          2HB       MET   4   4.179  18.458 -13.562
   20    HB3  MET   4          1HB       MET   4   5.306  18.850 -12.270
   21    HG2  MET   4          2HG       MET   4   6.139  16.545 -12.312
   22    HG3  MET   4          1HG       MET   4   5.027  16.176 -13.627
   23    HE1  MET   4          1HE       MET   4   5.139  18.804 -15.380
   24    HE2  MET   4          2HE       MET   4   5.223  17.182 -16.065
   25    HE3  MET   4          3HE       MET   4   6.414  18.399 -16.527
   26    H    GLY   5           H        GLY   5   2.352  15.758 -10.516
   27    HA2  GLY   5          2HA       GLY   5   0.831  15.039 -12.905
   28    HA3  GLY   5          1HA       GLY   5   1.888  13.807 -12.235
   29    H    HIS   6           H        HIS   6   0.975  12.442 -10.894
   30    HA   HIS   6           HA       HIS   6  -1.409  13.333  -9.409
   31    HB2  HIS   6          2HB       HIS   6  -2.266  11.027  -9.534
   32    HB3  HIS   6          1HB       HIS   6  -2.043  11.721 -11.133
   33    HD1  HIS   6          1HD       HIS   6  -1.007   8.907  -8.988
   34    HD2  HIS   6          2HD       HIS   6   0.157  10.607 -12.598
   35    HE1  HIS   6          1HE       HIS   6   0.475   7.202 -10.091
   36    HE2  HIS   6          2HE       HIS   6   1.304   8.326 -12.188
   37    H    MET   7           H        MET   7   1.485  13.292  -8.739
   38    HA   MET   7           HA       MET   7   1.737  11.312  -6.642
   39    HB2  MET   7          2HB       MET   7   3.674  12.103  -8.028
   40    HB3  MET   7          1HB       MET   7   3.510  13.682  -7.279
   41    HG2  MET   7          2HG       MET   7   5.299  12.371  -6.270
   42    HG3  MET   7          1HG       MET   7   4.024  12.745  -5.110
   43    HE1  MET   7          1HE       MET   7   4.690   8.602  -7.038
   44    HE2  MET   7          2HE       MET   7   5.699  10.017  -7.336
   45    HE3  MET   7          3HE       MET   7   4.049   9.964  -7.955
   46    H    VAL   8           H        VAL   8   2.212  12.038  -4.363
   47    HA   VAL   8           HA       VAL   8   0.863  14.504  -3.637
   48    HB   VAL   8           HB       VAL   8  -0.895  12.774  -3.848
   49   HG11  VAL   8          1HG1      VAL   8   0.291  10.792  -3.217
   50   HG12  VAL   8          2HG1      VAL   8  -1.102  11.011  -2.159
   51   HG13  VAL   8          3HG1      VAL   8   0.517  11.400  -1.576
   52   HG21  VAL   8          1HG2      VAL   8  -2.027  13.253  -1.755
   53   HG22  VAL   8          2HG2      VAL   8  -1.225  14.687  -2.393
   54   HG23  VAL   8          3HG2      VAL   8  -0.511  13.805  -1.043
   55    H    LYS   9           H        LYS   9   0.786  12.926  -0.882
   56    HA   LYS   9           HA       LYS   9   3.219  14.004   0.101
   57    HB2  LYS   9          2HB       LYS   9   1.235  12.097   1.390
   58    HB3  LYS   9          1HB       LYS   9   2.607  12.830   2.222
   59    HG2  LYS   9          2HG       LYS   9   0.444  14.430   0.894
   60    HG3  LYS   9          1HG       LYS   9   0.414  13.952   2.589
   61    HD2  LYS   9          2HD       LYS   9   2.559  15.131   2.925
   62    HD3  LYS   9          1HD       LYS   9   2.502  15.660   1.241
   63    HE2  LYS   9          2HE       LYS   9   0.391  16.817   1.682
   64    HE3  LYS   9          1HE       LYS   9   0.459  16.296   3.363
   65    HZ1  LYS   9          1HZ       LYS   9   2.484  17.565   3.644
   66    HZ2  LYS   9          2HZ       LYS   9   1.243  18.565   3.087
   67    HZ3  LYS   9          3HZ       LYS   9   2.446  18.044   2.023
   68    H    ILE  10           H        ILE  10   3.573  12.037  -2.029
   69    HA   ILE  10           HA       ILE  10   4.958   9.909  -0.570
   70    HB   ILE  10           HB       ILE  10   3.951   9.916  -3.412
   71   HG12  ILE  10          2HG1      ILE  10   3.088   8.327  -0.986
   72   HG13  ILE  10          1HG1      ILE  10   2.190   9.660  -1.707
   73   HG21  ILE  10          1HG2      ILE  10   5.324   7.705  -1.882
   74   HG22  ILE  10          2HG2      ILE  10   6.082   8.693  -3.131
   75   HG23  ILE  10          3HG2      ILE  10   4.735   7.635  -3.543
   76   HD11  ILE  10          1HD1      ILE  10   2.822   7.049  -3.059
   77   HD12  ILE  10          2HD1      ILE  10   1.888   8.377  -3.746
   78   HD13  ILE  10          3HD1      ILE  10   1.274   7.498  -2.347
   79    H    SER  11           H        SER  11   6.940  10.567  -0.282
   80    HA   SER  11           HA       SER  11   8.522  11.352  -2.631
   81    HB2  SER  11          2HB       SER  11   9.225  11.419   0.323
   82    HB3  SER  11          1HB       SER  11  10.276  11.957  -0.990
   83    HG   SER  11           HG       SER  11   9.213  13.763  -1.089
   84    H    HIS  12           H        HIS  12  10.988  10.255  -2.014
   85    HA   HIS  12           HA       HIS  12  10.809   7.584  -2.778
   86    HB2  HIS  12          2HB       HIS  12  12.948   8.890  -1.078
   87    HB3  HIS  12          1HB       HIS  12  13.098   7.302  -1.813
   88    HD1  HIS  12          1HD       HIS  12  14.094   7.211  -4.088
   89    HD2  HIS  12          2HD       HIS  12  12.771  11.025  -3.100
   90    HE1  HIS  12          1HE       HIS  12  14.835   8.693  -5.976
   91    HE2  HIS  12          2HE       HIS  12  13.992  10.993  -5.377
   92    H    GLU  13           H        GLU  13  10.947   9.070   0.359
   93    HA   GLU  13           HA       GLU  13  11.175   6.723   1.873
   94    HB2  GLU  13          2HB       GLU  13  10.588   8.187   3.787
   95    HB3  GLU  13          1HB       GLU  13  11.858   8.848   2.747
   96    HG2  GLU  13          2HG       GLU  13  10.166  10.274   1.644
   97    HG3  GLU  13          1HG       GLU  13   8.966   9.688   2.793
   98    H    ASP  14           H        ASP  14   8.289   8.550   0.779
   99    HA   ASP  14           HA       ASP  14   6.648   7.068   2.594
  100    HB2  ASP  14          2HB       ASP  14   6.309   9.402   1.000
  101    HB3  ASP  14          1HB       ASP  14   4.966   8.327   0.739
  102    H    THR  15           H        THR  15   7.185   6.920  -0.948
  103    HA   THR  15           HA       THR  15   5.283   4.877  -1.391
  104    HB   THR  15           HB       THR  15   7.466   4.322  -3.077
  105    HG1  THR  15          1HG       THR  15   6.986   7.062  -3.335
  106   HG21  THR  15          1HG2      THR  15   5.255   4.118  -3.851
  107   HG22  THR  15          2HG2      THR  15   5.958   5.444  -4.775
  108   HG23  THR  15          3HG2      THR  15   4.869   5.783  -3.434
  109    H    GLN  16           H        GLN  16   8.655   4.826  -0.434
  110    HA   GLN  16           HA       GLN  16   9.130   2.113  -0.341
  111    HB2  GLN  16          2HB       GLN  16  10.429   4.449   0.217
  112    HB3  GLN  16          1HB       GLN  16  10.235   3.761   1.816
  113    HG2  GLN  16          2HG       GLN  16  11.404   1.769   1.150
  114    HG3  GLN  16          1HG       GLN  16  11.420   2.324  -0.528
  115   HE21  GLN  16          1HE2      GLN  16  12.002   5.074   0.199
  116   HE22  GLN  16          2HE2      GLN  16  13.670   5.108   0.650
  117    H    ARG  17           H        ARG  17   7.791   4.335   2.041
  118    HA   ARG  17           HA       ARG  17   7.394   2.541   4.147
  119    HB2  ARG  17          2HB       ARG  17   6.157   5.144   3.353
  120    HB3  ARG  17          1HB       ARG  17   5.481   4.234   4.695
  121    HG2  ARG  17          2HG       ARG  17   7.232   4.662   6.049
  122    HG3  ARG  17          1HG       ARG  17   8.396   4.675   4.721
  123    HD2  ARG  17          2HD       ARG  17   7.874   6.864   4.123
  124    HD3  ARG  17          1HD       ARG  17   6.344   6.837   5.007
  125    HE   ARG  17           HE       ARG  17   8.185   6.533   6.960
  126   HH11  ARG  17          1HH1      ARG  17   7.611   8.872   4.449
  127   HH12  ARG  17          2HH1      ARG  17   8.545  10.125   5.212
  128   HH21  ARG  17          1HH2      ARG  17   9.340   8.212   8.041
  129   HH22  ARG  17          2HH2      ARG  17   9.494   9.761   7.269
  130    H    ILE  18           H        ILE  18   5.093   3.636   1.623
  131    HA   ILE  18           HA       ILE  18   2.899   2.251   2.620
  132    HB   ILE  18           HB       ILE  18   3.472   2.984  -0.247
  133   HG12  ILE  18          2HG1      ILE  18   1.488   4.505   1.272
  134   HG13  ILE  18          1HG1      ILE  18   3.112   4.629   1.947
  135   HG21  ILE  18          1HG2      ILE  18   1.759   1.261  -0.050
  136   HG22  ILE  18          2HG2      ILE  18   1.055   2.801  -0.549
  137   HG23  ILE  18          3HG2      ILE  18   0.892   2.252   1.125
  138   HD11  ILE  18          1HD1      ILE  18   2.446   5.140  -0.934
  139   HD12  ILE  18          2HD1      ILE  18   3.974   5.442  -0.099
  140   HD13  ILE  18          3HD1      ILE  18   2.543   6.388   0.306
  141    H    LYS  19           H        LYS  19   5.172   1.187   0.045
  142    HA   LYS  19           HA       LYS  19   3.882  -1.299  -0.366
  143    HB2  LYS  19          2HB       LYS  19   6.855  -0.939  -0.628
  144    HB3  LYS  19          1HB       LYS  19   5.795  -2.002  -1.547
  145    HG2  LYS  19          2HG       LYS  19   4.744  -0.035  -2.608
  146    HG3  LYS  19          1HG       LYS  19   5.899   1.000  -1.770
  147    HD2  LYS  19          2HD       LYS  19   6.673   0.621  -4.015
  148    HD3  LYS  19          1HD       LYS  19   7.742  -0.227  -2.898
  149    HE2  LYS  19          2HE       LYS  19   6.506  -2.313  -3.375
  150    HE3  LYS  19          1HE       LYS  19   5.519  -1.427  -4.537
  151    HZ1  LYS  19          1HZ       LYS  19   7.429  -1.023  -5.892
  152    HZ2  LYS  19          2HZ       LYS  19   7.389  -2.677  -5.538
  153    HZ3  LYS  19          3HZ       LYS  19   8.467  -1.672  -4.720
  154    H    THR  20           H        THR  20   6.637  -0.332   1.624
  155    HA   THR  20           HA       THR  20   7.389  -2.918   2.246
  156    HB   THR  20           HB       THR  20   8.823  -0.833   2.483
  157    HG1  THR  20          1HG       THR  20   9.806  -2.606   3.245
  158   HG21  THR  20          1HG2      THR  20   7.239   0.448   3.891
  159   HG22  THR  20          2HG2      THR  20   8.836   0.304   4.627
  160   HG23  THR  20          3HG2      THR  20   7.508  -0.703   5.200
  161    H    ALA  21           H        ALA  21   5.232  -0.684   3.913
  162    HA   ALA  21           HA       ALA  21   5.025  -2.327   6.221
  163    HB1  ALA  21          1HB       ALA  21   4.617   0.041   6.390
  164    HB2  ALA  21          2HB       ALA  21   3.140  -0.828   6.808
  165    HB3  ALA  21          3HB       ALA  21   3.300  -0.072   5.219
  166    H    PHE  22           H        PHE  22   2.676  -1.493   3.709
  167    HA   PHE  22           HA       PHE  22   0.591  -3.140   4.248
  168    HB2  PHE  22          2HB       PHE  22   0.191  -1.836   2.477
  169    HB3  PHE  22          1HB       PHE  22   1.845  -1.881   1.921
  170    HD1  PHE  22          1HD       PHE  22  -1.268  -3.855   1.941
  171    HD2  PHE  22          2HD       PHE  22   2.362  -2.962  -0.035
  172    HE1  PHE  22          1HE       PHE  22  -2.073  -5.111  -0.076
  173    HE2  PHE  22          2HE       PHE  22   1.626  -4.234  -2.000
  174    HZ   PHE  22           HZ       PHE  22  -0.589  -5.302  -2.020
  175    H    LEU  23           H        LEU  23   3.340  -4.208   2.180
  176    HA   LEU  23           HA       LEU  23   2.406  -6.834   1.848
  177    HB2  LEU  23          2HB       LEU  23   5.271  -5.905   1.848
  178    HB3  LEU  23          1HB       LEU  23   4.628  -7.333   1.055
  179    HG   LEU  23           HG       LEU  23   3.630  -4.607   0.316
  180   HD11  LEU  23          1HD1      LEU  23   5.330  -4.548  -1.452
  181   HD12  LEU  23          2HD1      LEU  23   6.075  -6.000  -0.781
  182   HD13  LEU  23          3HD1      LEU  23   6.057  -4.502   0.157
  183   HD21  LEU  23          1HD2      LEU  23   3.793  -7.279  -1.064
  184   HD22  LEU  23          2HD2      LEU  23   3.290  -5.786  -1.854
  185   HD23  LEU  23          3HD2      LEU  23   2.342  -6.435  -0.513
  186    H    SER  24           H        SER  24   4.967  -5.627   4.029
  187    HA   SER  24           HA       SER  24   5.583  -8.152   5.130
  188    HB2  SER  24          2HB       SER  24   6.950  -7.002   6.659
  189    HB3  SER  24          1HB       SER  24   7.129  -6.245   5.085
  190    HG   SER  24           HG       SER  24   6.126  -4.483   5.773
  191    H    TYR  25           H        TYR  25   3.238  -5.768   5.929
  192    HA   TYR  25           HA       TYR  25   2.887  -6.537   8.635
  193    HB2  TYR  25          2HB       TYR  25   1.507  -4.688   6.740
  194    HB3  TYR  25          1HB       TYR  25   0.579  -5.248   8.147
  195    HD1  TYR  25          1HD       TYR  25   3.977  -3.876   7.383
  196    HD2  TYR  25          2HD       TYR  25   0.726  -4.064  10.115
  197    HE1  TYR  25          1HE       TYR  25   5.108  -2.245   8.812
  198    HE2  TYR  25          2HE       TYR  25   1.846  -2.426  11.566
  199    HH   TYR  25           HH       TYR  25   4.178  -1.632  11.994
  200    H    ALA  26           H        ALA  26   1.079  -7.286   5.646
  201    HA   ALA  26           HA       ALA  26  -0.819  -8.854   7.098
  202    HB1  ALA  26          1HB       ALA  26  -1.719  -9.463   4.994
  203    HB2  ALA  26          2HB       ALA  26  -0.235  -8.995   4.162
  204    HB3  ALA  26          3HB       ALA  26  -1.251  -7.765   4.916
  205    H    GLN  27           H        GLN  27   1.427 -10.014   4.546
  206    HA   GLN  27           HA       GLN  27   1.700 -12.438   6.192
  207    HB2  GLN  27          2HB       GLN  27   2.223 -12.658   3.288
  208    HB3  GLN  27          1HB       GLN  27   1.550 -13.844   4.400
  209    HG2  GLN  27          2HG       GLN  27  -0.254 -13.389   3.062
  210    HG3  GLN  27          1HG       GLN  27  -0.538 -12.241   4.380
  211   HE21  GLN  27          1HE2      GLN  27  -1.390 -12.112   1.597
  212   HE22  GLN  27          2HE2      GLN  27  -0.734 -10.628   0.994
  213    H    GLY  28           H        GLY  28   3.312  -9.962   4.416
  214    HA2  GLY  28          2HA       GLY  28   5.673  -9.698   4.250
  215    HA3  GLY  28          1HA       GLY  28   5.864 -11.402   4.633
  216    H    GLN  29           H        GLN  29   3.464 -11.740   2.619
  217    HA   GLN  29           HA       GLN  29   5.086 -12.339   0.338
  218    HB2  GLN  29          2HB       GLN  29   2.076 -12.297   0.552
  219    HB3  GLN  29          1HB       GLN  29   3.035 -13.146  -0.654
  220    HG2  GLN  29          2HG       GLN  29   3.962 -14.584   1.056
  221    HG3  GLN  29          1HG       GLN  29   3.069 -13.698   2.297
  222   HE21  GLN  29          1HE2      GLN  29   0.701 -13.445   0.556
  223   HE22  GLN  29          2HE2      GLN  29  -0.051 -15.001   0.571
  224    H    ASP  30           H        ASP  30   3.443 -11.724  -1.814
  225    HA   ASP  30           HA       ASP  30   4.195  -8.942  -2.223
  226    HB2  ASP  30          2HB       ASP  30   3.109 -11.014  -4.142
  227    HB3  ASP  30          1HB       ASP  30   3.601  -9.388  -4.600
  228    H    LYS  31           H        LYS  31   1.607 -10.217  -0.869
  229    HA   LYS  31           HA       LYS  31  -0.219  -8.222  -1.988
  230    HB2  LYS  31          2HB       LYS  31  -0.871 -11.127  -1.460
  231    HB3  LYS  31          1HB       LYS  31  -2.086  -9.882  -1.701
  232    HG2  LYS  31          2HG       LYS  31  -0.701  -9.488  -3.919
  233    HG3  LYS  31          1HG       LYS  31  -0.282 -11.173  -3.658
  234    HD2  LYS  31          2HD       LYS  31  -3.063 -10.016  -3.871
  235    HD3  LYS  31          1HD       LYS  31  -2.256 -11.051  -5.050
  236    HE2  LYS  31          2HE       LYS  31  -2.876 -11.856  -2.224
  237    HE3  LYS  31          1HE       LYS  31  -3.948 -12.127  -3.592
  238    HZ1  LYS  31          1HZ       LYS  31  -1.176 -13.174  -3.360
  239    HZ2  LYS  31          2HZ       LYS  31  -2.252 -13.489  -4.626
  240    HZ3  LYS  31          3HZ       LYS  31  -2.576 -14.077  -3.075
  241    H    VAL  32           H        VAL  32  -2.333  -8.484  -0.393
  242    HA   VAL  32           HA       VAL  32  -1.329  -8.909   2.322
  243    HB   VAL  32           HB       VAL  32  -2.604  -6.431   1.283
  244   HG11  VAL  32          1HG1      VAL  32  -2.912  -7.541   4.052
  245   HG12  VAL  32          2HG1      VAL  32  -4.169  -6.938   2.975
  246   HG13  VAL  32          3HG1      VAL  32  -3.012  -5.819   3.697
  247   HG21  VAL  32          1HG2      VAL  32  -0.268  -6.431   1.588
  248   HG22  VAL  32          2HG2      VAL  32  -0.420  -7.139   3.195
  249   HG23  VAL  32          3HG2      VAL  32  -0.983  -5.496   2.898
  250    H    THR  33           H        THR  33  -2.568 -10.047   3.596
  251    HA   THR  33           HA       THR  33  -5.122 -11.005   2.778
  252    HB   THR  33           HB       THR  33  -5.231 -11.875   5.128
  253    HG1  THR  33          1HG       THR  33  -3.535 -11.457   6.521
  254   HG21  THR  33          1HG2      THR  33  -2.622 -12.389   3.697
  255   HG22  THR  33          2HG2      THR  33  -4.153 -13.207   3.378
  256   HG23  THR  33          3HG2      THR  33  -3.341 -13.427   4.927
  257    H    GLU  34           H        GLU  34  -7.076 -10.559   4.119
  258    HA   GLU  34           HA       GLU  34  -7.558  -7.881   3.528
  259    HB2  GLU  34          2HB       GLU  34  -9.287  -9.375   3.168
  260    HB3  GLU  34          1HB       GLU  34  -9.316  -9.902   4.858
  261    HG2  GLU  34          2HG       GLU  34 -10.237  -7.822   5.569
  262    HG3  GLU  34          1HG       GLU  34  -9.958  -7.090   3.991
  263    H    ALA  35           H        ALA  35  -6.534  -9.198   6.476
  264    HA   ALA  35           HA       ALA  35  -7.643  -7.539   8.416
  265    HB1  ALA  35          1HB       ALA  35  -5.800  -8.167   9.810
  266    HB2  ALA  35          2HB       ALA  35  -4.831  -8.613   8.407
  267    HB3  ALA  35          3HB       ALA  35  -6.252  -9.570   8.837
  268    H    MET  36           H        MET  36  -4.493  -7.247   6.792
  269    HA   MET  36           HA       MET  36  -4.045  -4.615   7.721
  270    HB2  MET  36          2HB       MET  36  -2.701  -6.458   5.842
  271    HB3  MET  36          1HB       MET  36  -2.368  -4.752   5.662
  272    HG2  MET  36          2HG       MET  36  -2.171  -6.153   8.293
  273    HG3  MET  36          1HG       MET  36  -0.812  -6.040   7.169
  274    HE1  MET  36          1HE       MET  36  -1.767  -2.996   6.010
  275    HE2  MET  36          2HE       MET  36  -0.163  -3.717   6.109
  276    HE3  MET  36          3HE       MET  36  -0.471  -2.149   6.855
  277    H    ILE  37           H        ILE  37  -5.850  -5.959   5.126
  278    HA   ILE  37           HA       ILE  37  -5.806  -3.612   3.497
  279    HB   ILE  37           HB       ILE  37  -7.337  -6.100   3.558
  280   HG12  ILE  37          2HG1      ILE  37  -5.847  -6.435   1.929
  281   HG13  ILE  37          1HG1      ILE  37  -6.646  -5.180   1.019
  282   HG21  ILE  37          1HG2      ILE  37  -9.135  -4.474   3.381
  283   HG22  ILE  37          2HG2      ILE  37  -8.890  -5.308   1.845
  284   HG23  ILE  37          3HG2      ILE  37  -8.286  -3.665   2.064
  285   HD11  ILE  37          1HD1      ILE  37  -4.409  -4.667   2.923
  286   HD12  ILE  37          2HD1      ILE  37  -5.184  -3.503   1.848
  287   HD13  ILE  37          3HD1      ILE  37  -4.245  -4.830   1.178
  288    H    ASP  38           H        ASP  38  -7.997  -4.825   6.022
  289    HA   ASP  38           HA       ASP  38  -9.694  -2.646   6.235
  290    HB2  ASP  38          2HB       ASP  38  -9.712  -4.938   7.328
  291    HB3  ASP  38          1HB       ASP  38  -8.600  -4.273   8.512
  292    H    GLN  39           H        GLN  39  -6.418  -3.150   7.386
  293    HA   GLN  39           HA       GLN  39  -6.166  -1.083   9.232
  294    HB2  GLN  39          2HB       GLN  39  -4.364  -2.569   9.135
  295    HB3  GLN  39          1HB       GLN  39  -4.290  -2.527   7.388
  296    HG2  GLN  39          2HG       GLN  39  -3.454  -0.178   9.043
  297    HG3  GLN  39          1HG       GLN  39  -2.376  -1.508   8.725
  298   HE21  GLN  39          1HE2      GLN  39  -2.400   1.386   7.895
  299   HE22  GLN  39          2HE2      GLN  39  -2.190   1.345   6.183
  300    H    LEU  40           H        LEU  40  -5.500  -1.079   5.766
  301    HA   LEU  40           HA       LEU  40  -5.066   1.722   5.659
  302    HB2  LEU  40          2HB       LEU  40  -3.980   0.337   4.084
  303    HB3  LEU  40          1HB       LEU  40  -5.508  -0.349   3.516
  304    HG   LEU  40           HG       LEU  40  -5.746   2.400   3.099
  305   HD11  LEU  40          1HD1      LEU  40  -3.765   3.242   2.431
  306   HD12  LEU  40          2HD1      LEU  40  -3.187   1.688   1.831
  307   HD13  LEU  40          3HD1      LEU  40  -3.144   2.035   3.562
  308   HD21  LEU  40          1HD2      LEU  40  -4.973   0.161   1.229
  309   HD22  LEU  40          2HD2      LEU  40  -5.482   1.767   0.710
  310   HD23  LEU  40          3HD2      LEU  40  -6.606   0.728   1.592
  311    H    ILE  41           H        ILE  41  -7.753  -0.336   4.537
  312    HA   ILE  41           HA       ILE  41  -9.238   1.756   3.421
  313    HB   ILE  41           HB       ILE  41 -10.091  -0.934   4.466
  314   HG12  ILE  41          2HG1      ILE  41  -8.587  -0.531   2.376
  315   HG13  ILE  41          1HG1      ILE  41  -9.927  -1.659   2.253
  316   HG21  ILE  41          1HG2      ILE  41 -11.999   0.584   4.616
  317   HG22  ILE  41          2HG2      ILE  41 -12.226  -0.606   3.334
  318   HG23  ILE  41          3HG2      ILE  41 -11.764   1.048   2.930
  319   HD11  ILE  41          1HD1      ILE  41  -9.921   1.197   1.304
  320   HD12  ILE  41          2HD1      ILE  41 -11.260   0.054   1.136
  321   HD13  ILE  41          3HD1      ILE  41  -9.739  -0.232   0.289
  322    H    CYS  42           H        CYS  42  -9.209   0.536   6.748
  323    HA   CYS  42           HA       CYS  42 -11.448   2.121   7.582
  324    HB2  CYS  42          2HB       CYS  42 -10.750   0.056   8.773
  325    HB3  CYS  42          1HB       CYS  42  -9.263   0.859   9.258
  326    HG   CYS  42           HG       CYS  42 -11.467   0.573  11.246
  327    H    GLY  43           H        GLY  43  -8.056   2.604   7.167
  328    HA2  GLY  43          2HA       GLY  43  -7.474   4.781   8.748
  329    HA3  GLY  43          1HA       GLY  43  -6.837   4.545   7.128
  330    H    ALA  44           H        ALA  44  -8.973   4.986   5.469
  331    HA   ALA  44           HA       ALA  44  -9.523   7.809   6.021
  332    HB1  ALA  44          1HB       ALA  44 -10.103   8.035   3.696
  333    HB2  ALA  44          2HB       ALA  44 -10.035   6.288   3.470
  334    HB3  ALA  44          3HB       ALA  44  -8.559   7.185   3.824
  335    H    PHE  45           H        PHE  45 -11.337   4.923   4.930
  336    HA   PHE  45           HA       PHE  45 -13.723   6.143   6.146
  337    HB2  PHE  45          2HB       PHE  45 -14.768   4.455   4.320
  338    HB3  PHE  45          1HB       PHE  45 -14.630   6.209   4.159
  339    HD1  PHE  45          1HD       PHE  45 -12.446   3.238   3.739
  340    HD2  PHE  45          2HD       PHE  45 -13.796   6.913   2.098
  341    HE1  PHE  45          1HE       PHE  45 -11.022   2.867   1.760
  342    HE2  PHE  45          2HE       PHE  45 -12.365   6.568   0.124
  343    HZ   PHE  45           HZ       PHE  45 -10.965   4.541  -0.044
  344    HA   PRO  46           HA       PRO  46 -13.693   2.167   8.107
  345    HB2  PRO  46          2HB       PRO  46 -14.535   3.029  10.493
  346    HB3  PRO  46          1HB       PRO  46 -12.876   3.250   9.949
  347    HG2  PRO  46          2HG       PRO  46 -15.108   5.223  10.053
  348    HG3  PRO  46          1HG       PRO  46 -13.380   5.473  10.352
  349    HD2  PRO  46          2HD       PRO  46 -14.739   6.042   7.951
  350    HD3  PRO  46          1HD       PRO  46 -12.979   5.919   8.151
  351    H    GLY  47           H        GLY  47 -16.118   4.234   7.117
  352    HA2  GLY  47          2HA       GLY  47 -18.322   2.973   8.484
  353    HA3  GLY  47          1HA       GLY  47 -18.431   4.207   7.241
  354    H    LEU  48           H        LEU  48 -16.467   2.121   5.822
  355    HA   LEU  48           HA       LEU  48 -18.409   1.114   4.057
  356    HB2  LEU  48          2HB       LEU  48 -15.588   0.165   4.548
  357    HB3  LEU  48          1HB       LEU  48 -16.597  -0.379   3.226
  358    HG   LEU  48           HG       LEU  48 -15.458   2.378   3.641
  359   HD11  LEU  48          1HD1      LEU  48 -13.895   0.806   2.723
  360   HD12  LEU  48          2HD1      LEU  48 -14.431   1.883   1.432
  361   HD13  LEU  48          3HD1      LEU  48 -15.081   0.243   1.547
  362   HD21  LEU  48          1HD2      LEU  48 -16.578   2.994   1.551
  363   HD22  LEU  48          2HD2      LEU  48 -17.741   2.597   2.816
  364   HD23  LEU  48          3HD2      LEU  48 -17.400   1.435   1.536
  365    H    SER  49           H        SER  49 -19.804  -0.476   4.333
  366    HA   SER  49           HA       SER  49 -19.439  -2.513   6.336
  367    HB2  SER  49          2HB       SER  49 -21.699  -1.624   5.607
  368    HB3  SER  49          1HB       SER  49 -21.454  -2.456   4.070
  369    HG   SER  49           HG       SER  49 -22.276  -3.439   6.456
  370    H    TRP  50           H        TRP  50 -19.292  -4.882   5.678
  371    HA   TRP  50           HA       TRP  50 -16.986  -5.087   4.124
  372    HB2  TRP  50          2HB       TRP  50 -17.672  -6.747   5.882
  373    HB3  TRP  50          1HB       TRP  50 -18.801  -7.417   4.704
  374    HD1  TRP  50           HD       TRP  50 -14.999  -6.733   4.930
  375    HE1  TRP  50          1HE       TRP  50 -13.811  -8.570   3.571
  376    HE3  TRP  50          3HE       TRP  50 -19.107  -9.195   3.182
  377    HZ2  TRP  50          2HZ       TRP  50 -14.559 -10.760   1.982
  378    HZ3  TRP  50          3HZ       TRP  50 -18.784 -11.159   1.742
  379    HH2  TRP  50           HH       TRP  50 -16.549 -11.927   1.148
  380    H    GLU  51           H        GLU  51 -20.349  -5.564   3.207
  381    HA   GLU  51           HA       GLU  51 -19.881  -6.706   0.687
  382    HB2  GLU  51          2HB       GLU  51 -22.136  -4.938   1.634
  383    HB3  GLU  51          1HB       GLU  51 -22.127  -5.767   0.084
  384    HG2  GLU  51          2HG       GLU  51 -22.075  -7.046   2.802
  385    HG3  GLU  51          1HG       GLU  51 -23.423  -7.012   1.687
  386    H    GLN  52           H        GLN  52 -20.283  -3.291   1.599
  387    HA   GLN  52           HA       GLN  52 -19.767  -2.245  -0.976
  388    HB2  GLN  52          2HB       GLN  52 -20.877  -0.898   0.704
  389    HB3  GLN  52          1HB       GLN  52 -19.478  -0.996   1.763
  390    HG2  GLN  52          2HG       GLN  52 -19.556   1.161   0.705
  391    HG3  GLN  52          1HG       GLN  52 -18.164   0.257   0.114
  392   HE21  GLN  52          1HE2      GLN  52 -17.958   1.332  -1.782
  393   HE22  GLN  52          2HE2      GLN  52 -19.115   1.247  -3.064
  394    H    LEU  53           H        LEU  53 -17.709  -3.270   1.631
  395    HA   LEU  53           HA       LEU  53 -15.391  -1.893   0.661
  396    HB2  LEU  53          2HB       LEU  53 -15.724  -2.401   3.046
  397    HB3  LEU  53          1HB       LEU  53 -15.653  -4.110   2.692
  398    HG   LEU  53           HG       LEU  53 -13.314  -2.379   1.997
  399   HD11  LEU  53          1HD1      LEU  53 -13.910  -3.520   4.731
  400   HD12  LEU  53          2HD1      LEU  53 -13.869  -1.808   4.312
  401   HD13  LEU  53          3HD1      LEU  53 -12.393  -2.770   4.234
  402   HD21  LEU  53          1HD2      LEU  53 -13.571  -5.240   2.939
  403   HD22  LEU  53          2HD2      LEU  53 -12.082  -4.434   2.443
  404   HD23  LEU  53          3HD2      LEU  53 -13.364  -4.720   1.266
  405    H    GLN  54           H        GLN  54 -16.703  -5.165   0.440
  406    HA   GLN  54           HA       GLN  54 -14.431  -6.335  -0.721
  407    HB2  GLN  54          2HB       GLN  54 -15.747  -8.212  -1.196
  408    HB3  GLN  54          1HB       GLN  54 -16.412  -7.533   0.267
  409    HG2  GLN  54          2HG       GLN  54 -18.314  -6.728  -0.823
  410    HG3  GLN  54          1HG       GLN  54 -17.584  -6.923  -2.415
  411   HE21  GLN  54          1HE2      GLN  54 -19.097  -8.563   0.268
  412   HE22  GLN  54          2HE2      GLN  54 -19.424 -10.035  -0.573
  413    H    GLU  55           H        GLU  55 -17.238  -4.697  -2.139
  414    HA   GLU  55           HA       GLU  55 -16.354  -5.111  -4.811
  415    HB2  GLU  55          2HB       GLU  55 -18.031  -3.440  -5.468
  416    HB3  GLU  55          1HB       GLU  55 -18.694  -4.694  -4.434
  417    HG2  GLU  55          2HG       GLU  55 -18.631  -3.169  -2.543
  418    HG3  GLU  55          1HG       GLU  55 -17.939  -1.929  -3.549
  419    H    LYS  56           H        LYS  56 -15.695  -2.702  -2.381
  420    HA   LYS  56           HA       LYS  56 -14.516  -0.649  -3.758
  421    HB2  LYS  56          2HB       LYS  56 -14.552  -1.142  -1.157
  422    HB3  LYS  56          1HB       LYS  56 -12.999  -1.904  -1.482
  423    HG2  LYS  56          2HG       LYS  56 -12.576   0.316  -0.760
  424    HG3  LYS  56          1HG       LYS  56 -12.233   0.244  -2.488
  425    HD2  LYS  56          2HD       LYS  56 -14.466   1.203  -2.939
  426    HD3  LYS  56          1HD       LYS  56 -14.733   1.342  -1.200
  427    HE2  LYS  56          2HE       LYS  56 -14.024   3.474  -2.048
  428    HE3  LYS  56          1HE       LYS  56 -12.731   2.797  -1.060
  429    HZ1  LYS  56          1HZ       LYS  56 -11.633   2.064  -3.111
  430    HZ2  LYS  56          2HZ       LYS  56 -11.849   3.739  -3.086
  431    HZ3  LYS  56          3HZ       LYS  56 -12.863   2.774  -4.030
  432    H    LYS  57           H        LYS  57 -13.066  -3.766  -2.899
  433    HA   LYS  57           HA       LYS  57 -10.752  -3.078  -4.570
  434    HB2  LYS  57          2HB       LYS  57 -10.347  -5.437  -3.008
  435    HB3  LYS  57          1HB       LYS  57  -9.483  -3.914  -2.949
  436    HG2  LYS  57          2HG       LYS  57 -10.237  -3.935  -0.837
  437    HG3  LYS  57          1HG       LYS  57 -11.660  -3.222  -1.586
  438    HD2  LYS  57          2HD       LYS  57 -12.775  -4.890  -0.597
  439    HD3  LYS  57          1HD       LYS  57 -12.141  -5.887  -1.903
  440    HE2  LYS  57          2HE       LYS  57 -10.240  -6.528  -0.498
  441    HE3  LYS  57          1HE       LYS  57 -10.854  -5.512   0.798
  442    HZ1  LYS  57          1HZ       LYS  57 -12.958  -6.928   0.599
  443    HZ2  LYS  57          2HZ       LYS  57 -11.622  -7.609   1.371
  444    HZ3  LYS  57          3HZ       LYS  57 -11.986  -8.041  -0.230
  445    H    LYS  58           H        LYS  58 -13.497  -4.556  -5.230
  446    HA   LYS  58           HA       LYS  58 -12.746  -7.125  -6.130
  447    HB2  LYS  58          2HB       LYS  58 -15.007  -5.287  -6.809
  448    HB3  LYS  58          1HB       LYS  58 -14.735  -6.726  -7.784
  449    HG2  LYS  58          2HG       LYS  58 -14.927  -8.120  -5.800
  450    HG3  LYS  58          1HG       LYS  58 -15.168  -6.687  -4.803
  451    HD2  LYS  58          2HD       LYS  58 -17.313  -7.635  -5.224
  452    HD3  LYS  58          1HD       LYS  58 -17.188  -6.171  -6.199
  453    HE2  LYS  58          2HE       LYS  58 -16.651  -7.501  -8.159
  454    HE3  LYS  58          1HE       LYS  58 -16.713  -8.976  -7.193
  455    HZ1  LYS  58          1HZ       LYS  58 -18.758  -8.700  -8.376
  456    HZ2  LYS  58          2HZ       LYS  58 -18.970  -7.140  -7.764
  457    HZ3  LYS  58          3HZ       LYS  58 -19.058  -8.474  -6.726
  458    H    GLY  59           H        GLY  59 -12.384  -7.885  -8.272
  459    HA2  GLY  59          2HA       GLY  59 -11.662  -7.572 -10.522
  460    HA3  GLY  59          1HA       GLY  59 -11.274  -5.902 -10.139
  461    H    ARG  60           H        ARG  60 -10.092  -7.154  -7.555
  462    HA   ARG  60           HA       ARG  60  -7.588  -8.078  -8.660
  463    HB2  ARG  60          2HB       ARG  60  -7.686  -5.560  -8.882
  464    HB3  ARG  60          1HB       ARG  60  -7.670  -5.489  -7.125
  465    HG2  ARG  60          2HG       ARG  60  -5.465  -5.149  -8.166
  466    HG3  ARG  60          1HG       ARG  60  -5.518  -6.512  -7.042
  467    HD2  ARG  60          2HD       ARG  60  -5.685  -8.062  -8.877
  468    HD3  ARG  60          1HD       ARG  60  -5.787  -6.724 -10.037
  469    HE   ARG  60           HE       ARG  60  -3.438  -6.518  -8.440
  470   HH11  ARG  60          1HH1      ARG  60  -4.757  -8.327 -11.132
  471   HH12  ARG  60          2HH1      ARG  60  -3.202  -8.751 -11.770
  472   HH21  ARG  60          1HH2      ARG  60  -1.396  -7.075  -9.261
  473   HH22  ARG  60          2HH2      ARG  60  -1.284  -8.037 -10.704
  474    H    ALA  61           H        ALA  61  -9.389  -6.987  -5.845
  475    HA   ALA  61           HA       ALA  61  -7.838  -8.857  -4.181
  476    HB1  ALA  61          1HB       ALA  61  -9.340  -7.183  -2.501
  477    HB2  ALA  61          2HB       ALA  61  -8.612  -6.126  -3.712
  478    HB3  ALA  61          3HB       ALA  61  -7.595  -7.181  -2.731
  479    H    ALA  62           H        ALA  62 -10.004  -9.186  -6.027
  480    HA   ALA  62           HA       ALA  62 -12.478  -9.758  -5.475
  481    HB1  ALA  62          1HB       ALA  62 -12.267 -11.908  -6.571
  482    HB2  ALA  62          2HB       ALA  62 -10.536 -11.928  -6.230
  483    HB3  ALA  62          3HB       ALA  62 -11.200 -10.728  -7.338
  484    H    ALA  63           H        ALA  63 -13.538 -10.219  -3.688
  485    HA   ALA  63           HA       ALA  63 -14.065 -10.932  -1.616
  486    HB1  ALA  63          1HB       ALA  63 -14.099 -13.138  -2.670
  487    HB2  ALA  63          2HB       ALA  63 -13.542 -13.231  -1.000
  488    HB3  ALA  63          3HB       ALA  63 -12.381 -13.333  -2.323
  489    H    ASN  64           H        ASN  64 -10.856 -12.444  -1.631
  490    HA   ASN  64           HA       ASN  64  -9.947 -10.423   0.270
  491    HB2  ASN  64          2HB       ASN  64 -10.105 -13.378   0.788
  492    HB3  ASN  64          1HB       ASN  64  -8.925 -12.374   1.623
  493   HD21  ASN  64          1HD2      ASN  64 -10.629 -10.064   1.704
  494   HD22  ASN  64          2HD2      ASN  64 -11.841 -10.375   2.902
  495    H    GLY  65           H        GLY  65  -8.271  -9.564  -0.667
  496    HA2  GLY  65          2HA       GLY  65  -5.782 -10.479  -0.431
  497    HA3  GLY  65          1HA       GLY  65  -6.245 -11.253  -1.934
  498    H    TYR  66           H        TYR  66  -6.031  -8.006  -0.395
  499    HA   TYR  66           HA       TYR  66  -5.742  -6.628  -2.890
  500    HB2  TYR  66          2HB       TYR  66  -5.571  -5.873  -0.147
  501    HB3  TYR  66          1HB       TYR  66  -4.115  -5.328  -0.963
  502    HD1  TYR  66          1HD       TYR  66  -5.133  -3.144  -0.074
  503    HD2  TYR  66          2HD       TYR  66  -6.826  -5.311  -3.294
  504    HE1  TYR  66          1HE       TYR  66  -6.254  -1.100  -0.819
  505    HE2  TYR  66          2HE       TYR  66  -7.965  -3.279  -4.064
  506    HH   TYR  66           HH       TYR  66  -8.728  -1.135  -3.158
  507    H    ASP  67           H        ASP  67  -3.942  -5.947  -3.982
  508    HA   ASP  67           HA       ASP  67  -1.474  -7.341  -3.290
  509    HB2  ASP  67          2HB       ASP  67  -1.218  -8.158  -5.419
  510    HB3  ASP  67          1HB       ASP  67  -2.986  -8.124  -5.345
  511    H    ARG  68           H        ARG  68   0.359  -6.198  -4.655
  512    HA   ARG  68           HA       ARG  68   0.372  -3.627  -3.482
  513    HB2  ARG  68          2HB       ARG  68   2.619  -3.395  -4.235
  514    HB3  ARG  68          1HB       ARG  68   2.393  -5.061  -3.735
  515    HG2  ARG  68          2HG       ARG  68   2.124  -5.671  -6.137
  516    HG3  ARG  68          1HG       ARG  68   2.555  -4.006  -6.546
  517    HD2  ARG  68          2HD       ARG  68   4.613  -4.439  -5.026
  518    HD3  ARG  68          1HD       ARG  68   4.229  -6.139  -5.276
  519    HE   ARG  68           HE       ARG  68   4.319  -4.883  -7.778
  520   HH11  ARG  68          1HH1      ARG  68   6.431  -5.833  -5.160
  521   HH12  ARG  68          2HH1      ARG  68   7.858  -5.883  -6.149
  522   HH21  ARG  68          1HH2      ARG  68   6.200  -4.945  -9.095
  523   HH22  ARG  68          2HH2      ARG  68   7.729  -5.359  -8.386
  524    H    SER  69           H        SER  69  -0.471  -4.714  -6.668
  525    HA   SER  69           HA       SER  69  -0.212  -2.178  -7.947
  526    HB2  SER  69          2HB       SER  69  -0.271  -4.212  -9.267
  527    HB3  SER  69          1HB       SER  69  -1.876  -4.607  -8.653
  528    HG   SER  69           HG       SER  69  -1.095  -2.700 -10.545
  529    H    ALA  70           H        ALA  70  -2.981  -3.940  -6.555
  530    HA   ALA  70           HA       ALA  70  -4.893  -1.900  -7.063
  531    HB1  ALA  70          1HB       ALA  70  -5.101  -3.900  -4.832
  532    HB2  ALA  70          2HB       ALA  70  -5.299  -4.365  -6.522
  533    HB3  ALA  70          3HB       ALA  70  -6.391  -3.185  -5.803
  534    H    PHE  71           H        PHE  71  -3.085  -2.852  -4.206
  535    HA   PHE  71           HA       PHE  71  -4.206  -1.055  -2.397
  536    HB2  PHE  71          2HB       PHE  71  -2.847  -3.001  -1.747
  537    HB3  PHE  71          1HB       PHE  71  -1.421  -2.237  -2.446
  538    HD1  PHE  71          1HD       PHE  71  -3.825  -2.123   0.312
  539    HD2  PHE  71          2HD       PHE  71  -0.244  -0.510  -1.291
  540    HE1  PHE  71          1HE       PHE  71  -3.348  -1.079   2.473
  541    HE2  PHE  71          2HE       PHE  71   0.238   0.541   0.872
  542    HZ   PHE  71           HZ       PHE  71  -1.312   0.269   2.751
  543    H    PHE  72           H        PHE  72  -1.381  -0.740  -4.529
  544    HA   PHE  72           HA       PHE  72  -0.578   1.771  -3.514
  545    HB2  PHE  72          2HB       PHE  72   0.920   0.288  -4.794
  546    HB3  PHE  72          1HB       PHE  72  -0.018   0.623  -6.245
  547    HD1  PHE  72          1HD       PHE  72   1.719   2.483  -3.524
  548    HD2  PHE  72          2HD       PHE  72   0.794   2.238  -7.671
  549    HE1  PHE  72          1HE       PHE  72   3.112   4.461  -3.944
  550    HE2  PHE  72          2HE       PHE  72   2.190   4.218  -8.102
  551    HZ   PHE  72           HZ       PHE  72   3.350   5.333  -6.236
  552    H    SER  73           H        SER  73  -2.755   0.815  -6.056
  553    HA   SER  73           HA       SER  73  -3.068   3.279  -7.346
  554    HB2  SER  73          2HB       SER  73  -3.893   1.097  -8.220
  555    HB3  SER  73          1HB       SER  73  -5.158   1.113  -6.994
  556    HG   SER  73           HG       SER  73  -5.607   1.967  -9.237
  557    H    LEU  74           H        LEU  74  -4.589   1.945  -4.469
  558    HA   LEU  74           HA       LEU  74  -6.428   4.122  -4.136
  559    HB2  LEU  74          2HB       LEU  74  -6.863   1.880  -3.229
  560    HB3  LEU  74          1HB       LEU  74  -5.481   2.044  -2.166
  561    HG   LEU  74           HG       LEU  74  -6.579   3.695  -0.847
  562   HD11  LEU  74          1HD1      LEU  74  -8.792   4.572  -1.394
  563   HD12  LEU  74          2HD1      LEU  74  -8.776   3.680  -2.915
  564   HD13  LEU  74          3HD1      LEU  74  -7.619   4.983  -2.643
  565   HD21  LEU  74          1HD2      LEU  74  -7.239   1.455  -0.329
  566   HD22  LEU  74          2HD2      LEU  74  -8.433   1.461  -1.623
  567   HD23  LEU  74          3HD2      LEU  74  -8.662   2.490  -0.207
  568    H    VAL  75           H        VAL  75  -3.402   3.197  -2.477
  569    HA   VAL  75           HA       VAL  75  -3.442   5.360  -0.663
  570    HB   VAL  75           HB       VAL  75  -0.907   4.020  -1.576
  571   HG11  VAL  75          1HG1      VAL  75  -0.778   4.188   1.100
  572   HG12  VAL  75          2HG1      VAL  75  -1.709   5.640   0.708
  573   HG13  VAL  75          3HG1      VAL  75  -0.123   5.380  -0.019
  574   HG21  VAL  75          1HG2      VAL  75  -2.222   2.134  -1.191
  575   HG22  VAL  75          2HG2      VAL  75  -3.096   2.907   0.131
  576   HG23  VAL  75          3HG2      VAL  75  -1.417   2.411   0.359
  577    H    ALA  76           H        ALA  76  -1.952   4.994  -3.855
  578    HA   ALA  76           HA       ALA  76  -0.344   7.310  -3.737
  579    HB1  ALA  76          1HB       ALA  76   0.022   5.524  -5.368
  580    HB2  ALA  76          2HB       ALA  76  -0.142   7.095  -6.152
  581    HB3  ALA  76          3HB       ALA  76  -1.486   5.954  -6.174
  582    H    SER  77           H        SER  77  -3.707   6.982  -4.003
  583    HA   SER  77           HA       SER  77  -3.962   9.666  -5.166
  584    HB2  SER  77          2HB       SER  77  -5.226   7.727  -6.196
  585    HB3  SER  77          1HB       SER  77  -6.172   7.651  -4.713
  586    HG   SER  77           HG       SER  77  -7.327   9.226  -5.453
  587    H    ASP  78           H        ASP  78  -3.810   8.137  -2.228
  588    HA   ASP  78           HA       ASP  78  -5.378  10.259  -0.930
  589    HB2  ASP  78          2HB       ASP  78  -5.420   7.300  -0.428
  590    HB3  ASP  78          1HB       ASP  78  -5.797   8.429   0.873
  591    H    GLU  79           H        GLU  79  -3.746  11.523  -0.186
  592    HA   GLU  79           HA       GLU  79  -1.242  10.669   0.761
  593    HB2  GLU  79          2HB       GLU  79  -0.886  12.853   1.370
  594    HB3  GLU  79          1HB       GLU  79  -2.181  13.065   0.207
  595    HG2  GLU  79          2HG       GLU  79  -3.800  13.268   1.982
  596    HG3  GLU  79          1HG       GLU  79  -2.552  12.928   3.186
  597    H    GLN  80           H        GLN  80  -4.367  10.891   2.360
  598    HA   GLN  80           HA       GLN  80  -3.521  10.799   5.027
  599    HB2  GLN  80          2HB       GLN  80  -5.954   9.292   4.119
  600    HB3  GLN  80          1HB       GLN  80  -5.713  10.191   5.603
  601    HG2  GLN  80          2HG       GLN  80  -7.093  11.625   4.532
  602    HG3  GLN  80          1HG       GLN  80  -5.550  12.221   3.922
  603   HE21  GLN  80          1HE2      GLN  80  -7.068   9.214   2.929
  604   HE22  GLN  80          2HE2      GLN  80  -7.397   9.704   1.298
  605    H    TYR  81           H        TYR  81  -3.602   8.444   2.549
  606    HA   TYR  81           HA       TYR  81  -3.425   6.180   4.321
  607    HB2  TYR  81          2HB       TYR  81  -3.709   6.543   1.363
  608    HB3  TYR  81          1HB       TYR  81  -3.160   5.001   2.003
  609    HD1  TYR  81          1HD       TYR  81  -5.663   5.282   0.405
  610    HD2  TYR  81          2HD       TYR  81  -5.021   5.605   4.592
  611    HE1  TYR  81          1HE       TYR  81  -7.979   4.522   0.824
  612    HE2  TYR  81          2HE       TYR  81  -7.305   4.890   5.002
  613    HH   TYR  81           HH       TYR  81  -9.254   3.493   2.624
  614    H    VAL  82           H        VAL  82  -1.424   7.978   2.047
  615    HA   VAL  82           HA       VAL  82   0.777   6.309   2.150
  616    HB   VAL  82           HB       VAL  82   1.856   7.965   1.024
  617   HG11  VAL  82          1HG1      VAL  82  -0.012   7.205  -0.246
  618   HG12  VAL  82          2HG1      VAL  82   0.378   8.886  -0.630
  619   HG13  VAL  82          3HG1      VAL  82  -0.983   8.520   0.430
  620   HG21  VAL  82          1HG2      VAL  82   0.231  10.065   2.306
  621   HG22  VAL  82          2HG2      VAL  82   1.312  10.342   0.936
  622   HG23  VAL  82          3HG2      VAL  82   1.972   9.777   2.469
  623    H    ARG  83           H        ARG  83   0.063   9.262   3.940
  624    HA   ARG  83           HA       ARG  83   2.162   8.904   5.792
  625    HB2  ARG  83          2HB       ARG  83   1.007  10.603   7.196
  626    HB3  ARG  83          1HB       ARG  83   1.391  11.122   5.572
  627    HG2  ARG  83          2HG       ARG  83  -1.051  10.363   5.078
  628    HG3  ARG  83          1HG       ARG  83  -1.256  10.554   6.818
  629    HD2  ARG  83          2HD       ARG  83  -0.720  12.525   4.685
  630    HD3  ARG  83          1HD       ARG  83  -1.867  12.610   6.013
  631    HE   ARG  83           HE       ARG  83   0.728  12.665   7.080
  632   HH11  ARG  83          1HH1      ARG  83  -1.342  14.695   5.104
  633   HH12  ARG  83          2HH1      ARG  83  -0.685  16.171   5.729
  634   HH21  ARG  83          1HH2      ARG  83   1.600  14.622   7.878
  635   HH22  ARG  83          2HH2      ARG  83   0.985  16.136   7.292
  636    H    PHE  84           H        PHE  84  -1.093   7.649   5.656
  637    HA   PHE  84           HA       PHE  84  -1.353   6.958   8.373
  638    HB2  PHE  84          2HB       PHE  84  -3.030   6.539   6.401
  639    HB3  PHE  84          1HB       PHE  84  -2.184   4.999   6.242
  640    HD1  PHE  84          1HD       PHE  84  -2.574   3.223   7.730
  641    HD2  PHE  84          2HD       PHE  84  -4.194   7.072   8.542
  642    HE1  PHE  84          1HE       PHE  84  -3.964   2.257   9.515
  643    HE2  PHE  84          2HE       PHE  84  -5.586   6.114  10.330
  644    HZ   PHE  84           HZ       PHE  84  -5.473   3.704  10.818
  645    H    ILE  85           H        ILE  85   0.245   5.255   5.709
  646    HA   ILE  85           HA       ILE  85   1.214   3.187   7.461
  647    HB   ILE  85           HB       ILE  85   1.685   3.793   4.559
  648   HG12  ILE  85          2HG1      ILE  85   0.629   1.429   6.127
  649   HG13  ILE  85          1HG1      ILE  85  -0.291   2.512   5.094
  650   HG21  ILE  85          1HG2      ILE  85   3.266   1.869   6.252
  651   HG22  ILE  85          2HG2      ILE  85   3.882   3.253   5.351
  652   HG23  ILE  85          3HG2      ILE  85   3.247   1.854   4.489
  653   HD11  ILE  85          1HD1      ILE  85   0.890   1.642   3.136
  654   HD12  ILE  85          2HD1      ILE  85   0.058   0.371   4.025
  655   HD13  ILE  85          3HD1      ILE  85   1.807   0.537   4.171
  656    H    ALA  86           H        ALA  86   2.722   5.936   5.769
  657    HA   ALA  86           HA       ALA  86   5.300   5.762   6.646
  658    HB1  ALA  86          1HB       ALA  86   3.757   8.343   6.573
  659    HB2  ALA  86          2HB       ALA  86   4.323   7.503   5.131
  660    HB3  ALA  86          3HB       ALA  86   5.484   8.114   6.312
  661    H    GLN  87           H        GLN  87   2.550   7.051   8.458
  662    HA   GLN  87           HA       GLN  87   4.129   8.013  10.605
  663    HB2  GLN  87          2HB       GLN  87   1.184   7.557  10.258
  664    HB3  GLN  87          1HB       GLN  87   1.851   8.042  11.810
  665    HG2  GLN  87          2HG       GLN  87   2.709  10.072  10.870
  666    HG3  GLN  87          1HG       GLN  87   2.237   9.569   9.248
  667   HE21  GLN  87          1HE2      GLN  87   0.981  11.400   8.980
  668   HE22  GLN  87          2HE2      GLN  87  -0.555  11.585   9.755
  669    H    HIS  88           H        HIS  88   2.351   5.025   9.965
  670    HA   HIS  88           HA       HIS  88   2.945   4.073  12.646
  671    HB2  HIS  88          2HB       HIS  88   1.424   2.352  12.322
  672    HB3  HIS  88          1HB       HIS  88   0.747   3.641  11.345
  673    HD1  HIS  88          1HD       HIS  88   3.040   0.643  10.725
  674    HD2  HIS  88          2HD       HIS  88  -0.124   2.710   8.981
  675    HE1  HIS  88          1HE       HIS  88   2.468  -0.619   8.637
  676    HE2  HIS  88          2HE       HIS  88   0.392   0.494   7.772
  677    H    PHE  89           H        PHE  89   4.540   4.073   9.691
  678    HA   PHE  89           HA       PHE  89   6.535   2.251  10.711
  679    HB2  PHE  89          2HB       PHE  89   4.751   0.877   9.481
  680    HB3  PHE  89          1HB       PHE  89   5.346   1.645   8.014
  681    HD1  PHE  89          1HD       PHE  89   7.135   0.701   6.861
  682    HD2  PHE  89          2HD       PHE  89   6.476  -0.342  10.934
  683    HE1  PHE  89          1HE       PHE  89   8.874  -1.034   6.700
  684    HE2  PHE  89          2HE       PHE  89   8.220  -2.067  10.781
  685    HZ   PHE  89           HZ       PHE  89   9.418  -2.413   8.661
  686    HA   PRO  90           HA       PRO  90   8.736   5.665   8.656
  687    HB2  PRO  90          2HB       PRO  90  10.932   4.035   9.830
  688    HB3  PRO  90          1HB       PRO  90  10.659   5.777   9.912
  689    HG2  PRO  90          2HG       PRO  90  10.165   4.246  12.019
  690    HG3  PRO  90          1HG       PRO  90   9.080   5.587  11.601
  691    HD2  PRO  90          2HD       PRO  90   8.723   2.650  11.170
  692    HD3  PRO  90          1HD       PRO  90   7.527   3.879  11.636
  693    H    CYS  91           H        CYS  91  10.100   5.794   6.866
  694    HA   CYS  91           HA       CYS  91  10.045   3.602   5.056
  695    HB2  CYS  91          2HB       CYS  91  11.477   5.129   3.654
  696    HB3  CYS  91          1HB       CYS  91   9.977   5.875   4.226
  697    HG   CYS  91           HG       CYS  91  12.818   6.311   6.045
  698    H    ALA  92           H        ALA  92  11.461   2.150   4.588
  699    HA   ALA  92           HA       ALA  92  13.682   1.566   6.224
  700    HB1  ALA  92          1HB       ALA  92  12.483  -0.144   4.952
  701    HB2  ALA  92          2HB       ALA  92  14.202  -0.147   4.556
  702    HB3  ALA  92          3HB       ALA  92  13.043   0.579   3.444
  703    HA   PRO  93           HA       PRO  93  16.831   4.047   4.310
  704    HB2  PRO  93          2HB       PRO  93  19.024   2.613   4.879
  705    HB3  PRO  93          1HB       PRO  93  18.130   3.488   6.117
  706    HG2  PRO  93          2HG       PRO  93  18.121   0.578   5.463
  707    HG3  PRO  93          1HG       PRO  93  18.052   1.373   7.045
  708    HD2  PRO  93          2HD       PRO  93  15.869   0.336   5.728
  709    HD3  PRO  93          1HD       PRO  93  15.787   1.622   6.946
  710    H    GLU  94           H        GLU  94  15.504   1.957   2.647
  711    HA   GLU  94           HA       GLU  94  15.670   0.884   0.665
  712    HB2  GLU  94          2HB       GLU  94  16.664   3.247   0.168
  713    HB3  GLU  94          1HB       GLU  94  18.197   2.394   0.069
  714    HG2  GLU  94          2HG       GLU  94  17.266   0.952  -1.685
  715    HG3  GLU  94          1HG       GLU  94  15.749   1.846  -1.597
  716    H    GLU  95           H        GLU  95  16.555  -0.553   2.701
  717    HA   GLU  95           HA       GLU  95  18.957  -1.939   1.704
  718    HB2  GLU  95          2HB       GLU  95  17.997  -1.593   4.554
  719    HB3  GLU  95          1HB       GLU  95  19.306  -2.658   4.081
  720    HG2  GLU  95          2HG       GLU  95  19.335   0.279   3.503
  721    HG3  GLU  95          1HG       GLU  95  19.903  -0.400   5.025
  722    H    GLU  96           H        GLU  96  18.645  -4.165   3.477
  723    HA   GLU  96           HA       GLU  96  17.594  -6.157   3.716
  724    HB2  GLU  96          2HB       GLU  96  15.072  -4.632   3.059
  725    HB3  GLU  96          1HB       GLU  96  15.151  -6.232   3.781
  726    HG2  GLU  96          2HG       GLU  96  16.344  -5.229   5.718
  727    HG3  GLU  96          1HG       GLU  96  16.067  -3.642   5.004
  728    H    LYS  97           H        LYS  97  18.738  -5.481   1.237
  729    HA   LYS  97           HA       LYS  97  18.930  -6.177  -0.912
  730    HB2  LYS  97          2HB       LYS  97  16.953  -8.316  -0.101
  731    HB3  LYS  97          1HB       LYS  97  17.998  -8.356  -1.512
  732    HG2  LYS  97          2HG       LYS  97  18.906  -8.378   1.358
  733    HG3  LYS  97          1HG       LYS  97  18.853  -9.767   0.274
  734    HD2  LYS  97          2HD       LYS  97  20.469  -8.635  -1.206
  735    HD3  LYS  97          1HD       LYS  97  20.547  -7.294  -0.063
  736    HE2  LYS  97          2HE       LYS  97  21.294 -10.156   0.530
  737    HE3  LYS  97          1HE       LYS  97  22.428  -8.846   0.211
  738    HZ1  LYS  97          1HZ       LYS  97  22.174  -9.268   2.578
  739    HZ2  LYS  97          2HZ       LYS  97  20.518  -8.947   2.483
  740    HZ3  LYS  97          3HZ       LYS  97  21.636  -7.714   2.185
  741    HA   PRO  98           HA       PRO  98  14.981  -3.972  -1.953
  742    HB2  PRO  98          2HB       PRO  98  16.718  -2.134  -3.402
  743    HB3  PRO  98          1HB       PRO  98  15.598  -1.797  -2.081
  744    HG2  PRO  98          2HG       PRO  98  18.288  -1.662  -1.797
  745    HG3  PRO  98          1HG       PRO  98  17.197  -2.103  -0.472
  746    HD2  PRO  98          2HD       PRO  98  18.882  -3.865  -2.206
  747    HD3  PRO  98          1HD       PRO  98  18.572  -3.964  -0.461
  748    HA   PRO  99           HA       PRO  99  14.959  -6.043  -5.968
  749    HB2  PRO  99          2HB       PRO  99  12.345  -4.647  -6.096
  750    HB3  PRO  99          1HB       PRO  99  12.716  -6.357  -6.338
  751    HG2  PRO  99          2HG       PRO  99  11.501  -5.520  -4.115
  752    HG3  PRO  99          1HG       PRO  99  12.715  -6.811  -4.066
  753    HD2  PRO  99          2HD       PRO  99  12.979  -3.932  -3.300
  754    HD3  PRO  99          1HD       PRO  99  13.661  -5.376  -2.523
  755    H    GLU 100           H        GLU 100  14.049  -2.721  -5.288
  756    HA   GLU 100           HA       GLU 100  15.836  -1.826  -7.370
  757    HB2  GLU 100          2HB       GLU 100  13.648  -1.987  -8.539
  758    HB3  GLU 100          1HB       GLU 100  12.952  -0.904  -7.348
  759    HG2  GLU 100          2HG       GLU 100  13.559   0.135  -9.510
  760    HG3  GLU 100          1HG       GLU 100  14.281   0.906  -8.098
  761    H    ILE 101           H        ILE 101  13.222  -0.099  -5.703
  762    HA   ILE 101           HA       ILE 101  15.201   1.096  -3.893
  763    HB   ILE 101           HB       ILE 101  14.137   3.328  -4.184
  764   HG12  ILE 101          2HG1      ILE 101  12.882   2.089  -6.636
  765   HG13  ILE 101          1HG1      ILE 101  12.008   2.526  -5.177
  766   HG21  ILE 101          1HG2      ILE 101  15.272   3.868  -6.298
  767   HG22  ILE 101          2HG2      ILE 101  15.435   2.143  -6.632
  768   HG23  ILE 101          3HG2      ILE 101  16.255   2.855  -5.243
  769   HD11  ILE 101          1HD1      ILE 101  11.728   4.155  -6.919
  770   HD12  ILE 101          2HD1      ILE 101  13.469   4.370  -7.026
  771   HD13  ILE 101          3HD1      ILE 101  12.609   4.857  -5.564
  772    H    ASP 102           H        ASP 102  12.439  -0.556  -4.210
  773    HA   ASP 102           HA       ASP 102  10.843  -1.254  -2.776
  774    HB2  ASP 102          2HB       ASP 102  12.423   0.371  -0.784
  775    HB3  ASP 102          1HB       ASP 102  11.013  -0.572  -0.352
  776    H    ALA 103           H        ALA 103  10.919   1.485  -4.149
  777    HA   ALA 103           HA       ALA 103   8.571   2.604  -2.770
  778    HB1  ALA 103          1HB       ALA 103  10.572   4.267  -4.299
  779    HB2  ALA 103          2HB       ALA 103  10.723   3.953  -2.568
  780    HB3  ALA 103          3HB       ALA 103   9.312   4.824  -3.186
  781    H    LEU 104           H        LEU 104   8.425   4.639  -4.937
  782    HA   LEU 104           HA       LEU 104   6.561   3.539  -6.622
  783    HB2  LEU 104          2HB       LEU 104   6.913   5.486  -8.075
  784    HB3  LEU 104          1HB       LEU 104   6.809   5.927  -6.384
  785    HG   LEU 104           HG       LEU 104   9.515   5.532  -7.588
  786   HD11  LEU 104          1HD1      LEU 104   9.532   7.885  -8.296
  787   HD12  LEU 104          2HD1      LEU 104   7.812   8.002  -7.920
  788   HD13  LEU 104          3HD1      LEU 104   8.363   6.932  -9.212
  789   HD21  LEU 104          1HD2      LEU 104   8.377   7.353  -5.473
  790   HD22  LEU 104          2HD2      LEU 104  10.051   7.376  -6.023
  791   HD23  LEU 104          3HD2      LEU 104   9.408   5.946  -5.222
  792    H    GLU 105           H        GLU 105  10.008   3.348  -6.879
  793    HA   GLU 105           HA       GLU 105  11.411   2.273  -8.312
  794    HB2  GLU 105          2HB       GLU 105   8.856   1.113  -9.450
  795    HB3  GLU 105          1HB       GLU 105  10.478   0.554  -9.830
  796    HG2  GLU 105          2HG       GLU 105  10.791  -0.372  -7.730
  797    HG3  GLU 105          1HG       GLU 105   9.513   0.601  -7.004
  798    H    LEU 106           H        LEU 106  11.059   1.719 -11.083
  799    HA   LEU 106           HA       LEU 106  11.054   4.427 -12.141
  800    HB2  LEU 106          2HB       LEU 106  11.641   1.788 -13.499
  801    HB3  LEU 106          1HB       LEU 106  11.793   3.360 -14.252
  802    HG   LEU 106           HG       LEU 106  13.984   2.744 -13.711
  803   HD11  LEU 106          1HD1      LEU 106  14.713   4.322 -12.025
  804   HD12  LEU 106          2HD1      LEU 106  13.065   4.465 -11.418
  805   HD13  LEU 106          3HD1      LEU 106  13.459   5.033 -13.039
  806   HD21  LEU 106          1HD2      LEU 106  13.473   0.850 -12.273
  807   HD22  LEU 106          2HD2      LEU 106  13.025   1.949 -10.969
  808   HD23  LEU 106          3HD2      LEU 106  14.693   1.892 -11.540
  809    H    LYS 107           H        LYS 107   8.685   4.378 -11.466
  810    HA   LYS 107           HA       LYS 107   6.479   4.435 -12.002
  811    HB2  LYS 107          2HB       LYS 107   7.069   5.250 -14.206
  812    HB3  LYS 107          1HB       LYS 107   7.472   3.629 -14.742
  813    HG2  LYS 107          2HG       LYS 107   5.042   3.037 -14.316
  814    HG3  LYS 107          1HG       LYS 107   4.758   4.772 -14.159
  815    HD2  LYS 107          2HD       LYS 107   4.264   4.098 -16.420
  816    HD3  LYS 107          1HD       LYS 107   5.726   5.088 -16.425
  817    HE2  LYS 107          2HE       LYS 107   7.098   3.060 -16.527
  818    HE3  LYS 107          1HE       LYS 107   5.642   2.071 -16.510
  819    HZ1  LYS 107          1HZ       LYS 107   4.996   3.007 -18.621
  820    HZ2  LYS 107          2HZ       LYS 107   6.556   2.365 -18.744
  821    HZ3  LYS 107          3HZ       LYS 107   6.340   4.036 -18.623
  822    H    THR 108           H        THR 108   7.577   1.760 -14.030
  823    HA   THR 108           HA       THR 108   6.734  -0.259 -12.180
  824    HB   THR 108           HB       THR 108   5.261  -0.097 -14.827
  825    HG1  THR 108          1HG       THR 108   4.717   1.034 -12.384
  826   HG21  THR 108          1HG2      THR 108   5.601  -2.369 -13.994
  827   HG22  THR 108          2HG2      THR 108   3.902  -1.911 -13.881
  828   HG23  THR 108          3HG2      THR 108   4.912  -1.911 -12.437
  829    H    GLN 109           H        GLN 109   8.271  -1.790 -12.418
  830    HA   GLN 109           HA       GLN 109  10.085  -1.583 -14.632
  831    HB2  GLN 109          2HB       GLN 109  10.019  -3.555 -12.349
  832    HB3  GLN 109          1HB       GLN 109  11.329  -3.397 -13.512
  833    HG2  GLN 109          2HG       GLN 109  11.524  -0.990 -12.757
  834    HG3  GLN 109          1HG       GLN 109  10.455  -1.428 -11.425
  835   HE21  GLN 109          1HE2      GLN 109  13.595  -1.823 -12.831
  836   HE22  GLN 109          2HE2      GLN 109  14.344  -2.545 -11.451
  837    H    LYS 110           H        LYS 110   8.537  -2.068 -16.297
  838    HA   LYS 110           HA       LYS 110   8.849  -4.826 -17.090
  839    HB2  LYS 110          2HB       LYS 110   6.504  -5.186 -17.662
  840    HB3  LYS 110          1HB       LYS 110   6.670  -4.895 -15.939
  841    HG2  LYS 110          2HG       LYS 110   5.734  -2.760 -16.090
  842    HG3  LYS 110          1HG       LYS 110   5.970  -2.685 -17.835
  843    HD2  LYS 110          2HD       LYS 110   3.694  -3.082 -17.647
  844    HD3  LYS 110          1HD       LYS 110   4.351  -4.696 -17.911
  845    HE2  LYS 110          2HE       LYS 110   3.664  -3.536 -15.215
  846    HE3  LYS 110          1HE       LYS 110   2.614  -4.590 -16.153
  847    HZ1  LYS 110          1HZ       LYS 110   5.283  -5.307 -15.068
  848    HZ2  LYS 110          2HZ       LYS 110   4.316  -6.323 -16.011
  849    HZ3  LYS 110          3HZ       LYS 110   3.792  -5.836 -14.479
  850    H    GLY 111           H        GLY 111   8.359  -5.104 -19.392
  851    HA2  GLY 111          2HA       GLY 111   8.966  -2.632 -20.836
  852    HA3  GLY 111          1HA       GLY 111   9.153  -4.266 -21.453
  853    H    PHE 112           H        PHE 112   6.349  -2.732 -19.936
  854    HA   PHE 112           HA       PHE 112   4.887  -3.005 -22.461
  855    HB2  PHE 112          2HB       PHE 112   3.924  -3.945 -19.741
  856    HB3  PHE 112          1HB       PHE 112   2.910  -3.833 -21.177
  857    HD1  PHE 112          1HD       PHE 112   3.134  -5.410 -22.987
  858    HD2  PHE 112          2HD       PHE 112   5.622  -5.670 -19.546
  859    HE1  PHE 112          1HE       PHE 112   3.814  -7.677 -23.653
  860    HE2  PHE 112          2HE       PHE 112   6.306  -7.937 -20.207
  861    HZ   PHE 112           HZ       PHE 112   5.403  -8.943 -22.264
  Start of MODEL    9
    1    H1   GLY   1          1HT       GLY   1   8.216  -1.007 -10.411
    2    H2   GLY   1          2HT       GLY   1   9.119   0.090 -11.340
    3    H    GLY   1           H        GLY   1   8.362  -1.610 -11.157
    4    H3   GLY   1          3HT       GLY   1   8.663  -1.397 -11.994
    5    HA2  GLY   1          1HA       GLY   1   6.800   0.765 -11.207
    6    HA3  GLY   1          2HA       GLY   1   7.294   0.404 -12.856
    7    H    SER   2           H        SER   2   6.425  -1.764 -10.171
    8    HA   SER   2           HA       SER   2   4.767  -3.368 -11.845
    9    HB2  SER   2          2HB       SER   2   5.967  -4.204  -9.812
   10    HB3  SER   2          1HB       SER   2   4.853  -3.269  -8.817
   11    HG   SER   2           HG       SER   2   3.895  -5.137 -10.704
   12    H    ALA   3           H        ALA   3   4.242  -0.719  -9.639
   13    HA   ALA   3           HA       ALA   3   1.470  -0.542 -10.593
   14    HB1  ALA   3          1HB       ALA   3   0.728   0.168  -8.415
   15    HB2  ALA   3          2HB       ALA   3   2.378   0.115  -7.793
   16    HB3  ALA   3          3HB       ALA   3   1.564  -1.379  -8.253
   17    H    MET   4           H        MET   4   0.837   1.465 -11.219
   18    HA   MET   4           HA       MET   4   2.914   3.446 -11.529
   19    HB2  MET   4          2HB       MET   4   0.024   3.424 -12.414
   20    HB3  MET   4          1HB       MET   4   1.175   4.697 -12.805
   21    HG2  MET   4          2HG       MET   4   1.350   1.806 -13.624
   22    HG3  MET   4          1HG       MET   4   0.948   3.172 -14.662
   23    HE1  MET   4          1HE       MET   4   4.511   2.040 -15.911
   24    HE2  MET   4          2HE       MET   4   2.825   2.285 -16.360
   25    HE3  MET   4          3HE       MET   4   3.262   0.979 -15.260
   26    H    GLY   5           H        GLY   5   2.929   5.519 -10.681
   27    HA2  GLY   5          2HA       GLY   5   1.470   5.658  -8.135
   28    HA3  GLY   5          1HA       GLY   5   3.009   6.430  -8.468
   29    H    HIS   6           H        HIS   6   1.147   7.877  -7.286
   30    HA   HIS   6           HA       HIS   6   0.460   9.843  -9.342
   31    HB2  HIS   6          2HB       HIS   6  -1.643   8.751  -8.898
   32    HB3  HIS   6          1HB       HIS   6  -1.373   8.809  -7.162
   33    HD1  HIS   6          1HD       HIS   6  -2.382  10.726  -5.960
   34    HD2  HIS   6          2HD       HIS   6  -2.070  11.441 -10.042
   35    HE1  HIS   6          1HE       HIS   6  -3.527  12.931  -6.354
   36    HE2  HIS   6          2HE       HIS   6  -3.195  13.409  -8.802
   37    H    MET   7           H        MET   7   0.999  11.882  -8.761
   38    HA   MET   7           HA       MET   7   2.701  12.246  -6.540
   39    HB2  MET   7          2HB       MET   7   2.958  13.551  -8.588
   40    HB3  MET   7          1HB       MET   7   1.391  14.301  -8.325
   41    HG2  MET   7          2HG       MET   7   3.248  15.767  -7.703
   42    HG3  MET   7          1HG       MET   7   2.196  15.398  -6.339
   43    HE1  MET   7          1HE       MET   7   4.946  13.036  -7.937
   44    HE2  MET   7          2HE       MET   7   6.357  13.509  -6.991
   45    HE3  MET   7          3HE       MET   7   5.606  14.666  -8.090
   46    H    VAL   8           H        VAL   8   2.268  12.662  -4.531
   47    HA   VAL   8           HA       VAL   8   0.197  14.379  -3.635
   48    HB   VAL   8           HB       VAL   8  -1.075  12.259  -4.172
   49   HG11  VAL   8          1HG1      VAL   8  -0.922  10.365  -2.636
   50   HG12  VAL   8          2HG1      VAL   8   0.489  11.107  -1.880
   51   HG13  VAL   8          3HG1      VAL   8   0.556  10.602  -3.568
   52   HG21  VAL   8          1HG2      VAL   8  -2.310  12.193  -1.997
   53   HG22  VAL   8          2HG2      VAL   8  -2.095  13.795  -2.694
   54   HG23  VAL   8          3HG2      VAL   8  -1.090  13.282  -1.344
   55    H    LYS   9           H        LYS   9   0.344  12.784  -0.978
   56    HA   LYS   9           HA       LYS   9   2.897  13.775  -0.145
   57    HB2  LYS   9          2HB       LYS   9   0.864  12.048   1.294
   58    HB3  LYS   9          1HB       LYS   9   2.364  12.613   2.021
   59    HG2  LYS   9          2HG       LYS   9   0.131  14.325   0.985
   60    HG3  LYS   9          1HG       LYS   9   0.517  14.015   2.674
   61    HD2  LYS   9          2HD       LYS   9   2.688  15.107   2.374
   62    HD3  LYS   9          1HD       LYS   9   2.291  15.428   0.684
   63    HE2  LYS   9          2HE       LYS   9   0.367  16.763   1.402
   64    HE3  LYS   9          1HE       LYS   9   0.797  16.465   3.086
   65    HZ1  LYS   9          1HZ       LYS   9   2.438  17.925   1.090
   66    HZ2  LYS   9          2HZ       LYS   9   2.925  17.577   2.670
   67    HZ3  LYS   9          3HZ       LYS   9   1.609  18.604   2.398
   68    H    ILE  10           H        ILE  10   3.555  12.273  -2.210
   69    HA   ILE  10           HA       ILE  10   4.803   9.943  -0.956
   70    HB   ILE  10           HB       ILE  10   3.819  10.101  -3.809
   71   HG12  ILE  10          2HG1      ILE  10   2.971   8.358  -1.485
   72   HG13  ILE  10          1HG1      ILE  10   2.026   9.660  -2.201
   73   HG21  ILE  10          1HG2      ILE  10   5.948   8.916  -3.671
   74   HG22  ILE  10          2HG2      ILE  10   4.631   7.791  -4.006
   75   HG23  ILE  10          3HG2      ILE  10   5.307   7.895  -2.382
   76   HD11  ILE  10          1HD1      ILE  10   1.320   7.397  -2.896
   77   HD12  ILE  10          2HD1      ILE  10   2.887   7.183  -3.672
   78   HD13  ILE  10          3HD1      ILE  10   1.784   8.435  -4.243
   79    H    SER  11           H        SER  11   6.717  10.901  -0.550
   80    HA   SER  11           HA       SER  11   8.324  11.852  -2.797
   81    HB2  SER  11          2HB       SER  11   9.265  11.467   0.045
   82    HB3  SER  11          1HB       SER  11   9.855  12.614  -1.163
   83    HG   SER  11           HG       SER  11   7.374  12.668   0.230
   84    H    HIS  12           H        HIS  12  10.802  10.791  -2.308
   85    HA   HIS  12           HA       HIS  12  10.721   8.157  -3.227
   86    HB2  HIS  12          2HB       HIS  12  12.853   9.399  -1.478
   87    HB3  HIS  12          1HB       HIS  12  13.055   7.970  -2.485
   88    HD1  HIS  12          1HD       HIS  12  12.302   8.713  -5.201
   89    HD2  HIS  12          2HD       HIS  12  14.069  11.479  -2.655
   90    HE1  HIS  12          1HE       HIS  12  13.312  10.455  -6.697
   91    HE2  HIS  12          2HE       HIS  12  14.532  12.012  -5.140
   92    H    GLU  13           H        GLU  13  11.237   9.419   0.004
   93    HA   GLU  13           HA       GLU  13  11.377   7.012   1.395
   94    HB2  GLU  13          2HB       GLU  13  10.882   8.392   3.386
   95    HB3  GLU  13          1HB       GLU  13  12.116   9.098   2.351
   96    HG2  GLU  13          2HG       GLU  13  10.561  10.685   1.468
   97    HG3  GLU  13          1HG       GLU  13   9.220   9.913   2.313
   98    H    ASP  14           H        ASP  14   8.570   8.918   0.377
   99    HA   ASP  14           HA       ASP  14   6.819   7.708   2.234
  100    HB2  ASP  14          2HB       ASP  14   6.312   9.297  -0.249
  101    HB3  ASP  14          1HB       ASP  14   5.016   8.710   0.800
  102    H    THR  15           H        THR  15   7.355   7.152  -1.239
  103    HA   THR  15           HA       THR  15   5.411   5.150  -1.518
  104    HB   THR  15           HB       THR  15   7.697   4.548  -3.141
  105    HG1  THR  15          1HG       THR  15   6.845   7.269  -3.243
  106   HG21  THR  15          1HG2      THR  15   6.133   5.191  -4.950
  107   HG22  THR  15          2HG2      THR  15   5.001   5.759  -3.720
  108   HG23  THR  15          3HG2      THR  15   5.438   4.053  -3.796
  109    H    GLN  16           H        GLN  16   8.766   5.040  -0.452
  110    HA   GLN  16           HA       GLN  16   9.146   2.280  -0.464
  111    HB2  GLN  16          2HB       GLN  16  10.325   4.410   1.308
  112    HB3  GLN  16          1HB       GLN  16  10.863   2.735   1.325
  113    HG2  GLN  16          2HG       GLN  16  11.434   2.940  -1.072
  114    HG3  GLN  16          1HG       GLN  16  10.981   4.639  -0.999
  115   HE21  GLN  16          1HE2      GLN  16  12.322   6.096  -0.035
  116   HE22  GLN  16          2HE2      GLN  16  13.926   5.717   0.484
  117    H    ARG  17           H        ARG  17   7.860   4.342   2.174
  118    HA   ARG  17           HA       ARG  17   7.743   2.200   4.016
  119    HB2  ARG  17          2HB       ARG  17   6.278   3.604   5.399
  120    HB3  ARG  17          1HB       ARG  17   7.720   4.423   4.883
  121    HG2  ARG  17          2HG       ARG  17   5.665   4.971   3.024
  122    HG3  ARG  17          1HG       ARG  17   5.100   5.300   4.666
  123    HD2  ARG  17          2HD       ARG  17   7.556   6.392   3.309
  124    HD3  ARG  17          1HD       ARG  17   6.127   7.285   3.836
  125    HE   ARG  17           HE       ARG  17   7.364   5.999   6.035
  126   HH11  ARG  17          1HH1      ARG  17   7.657   8.731   3.880
  127   HH12  ARG  17          2HH1      ARG  17   8.621   9.677   4.972
  128   HH21  ARG  17          1HH2      ARG  17   8.604   7.263   7.527
  129   HH22  ARG  17          2HH2      ARG  17   9.134   8.844   7.056
  130    H    ILE  18           H        ILE  18   5.304   3.628   1.901
  131    HA   ILE  18           HA       ILE  18   3.087   2.243   2.820
  132    HB   ILE  18           HB       ILE  18   3.654   2.984  -0.044
  133   HG12  ILE  18          2HG1      ILE  18   1.766   4.582   1.513
  134   HG13  ILE  18          1HG1      ILE  18   3.410   4.640   2.146
  135   HG21  ILE  18          1HG2      ILE  18   1.077   2.303   1.373
  136   HG22  ILE  18          2HG2      ILE  18   1.877   1.350   0.119
  137   HG23  ILE  18          3HG2      ILE  18   1.197   2.931  -0.274
  138   HD11  ILE  18          1HD1      ILE  18   2.919   6.424   0.530
  139   HD12  ILE  18          2HD1      ILE  18   2.661   5.193  -0.710
  140   HD13  ILE  18          3HD1      ILE  18   4.249   5.372   0.046
  141    H    LYS  19           H        LYS  19   5.312   1.203   0.210
  142    HA   LYS  19           HA       LYS  19   3.989  -1.225  -0.330
  143    HB2  LYS  19          2HB       LYS  19   6.975  -0.893  -0.482
  144    HB3  LYS  19          1HB       LYS  19   5.944  -1.949  -1.433
  145    HG2  LYS  19          2HG       LYS  19   4.964  -0.025  -2.576
  146    HG3  LYS  19          1HG       LYS  19   5.999   1.055  -1.639
  147    HD2  LYS  19          2HD       LYS  19   6.926   0.654  -3.865
  148    HD3  LYS  19          1HD       LYS  19   7.982   0.000  -2.610
  149    HE2  LYS  19          2HE       LYS  19   6.757  -2.216  -3.013
  150    HE3  LYS  19          1HE       LYS  19   6.157  -1.468  -4.489
  151    HZ1  LYS  19          1HZ       LYS  19   9.040  -1.524  -3.867
  152    HZ2  LYS  19          2HZ       LYS  19   8.282  -1.348  -5.377
  153    HZ3  LYS  19          3HZ       LYS  19   8.284  -2.851  -4.594
  154    H    THR  20           H        THR  20   6.821  -0.515   1.658
  155    HA   THR  20           HA       THR  20   7.415  -3.146   2.194
  156    HB   THR  20           HB       THR  20   9.033  -1.298   2.486
  157    HG1  THR  20          1HG       THR  20   9.106  -3.452   3.644
  158   HG21  THR  20          1HG2      THR  20   7.450   0.246   3.649
  159   HG22  THR  20          2HG2      THR  20   9.011   0.087   4.457
  160   HG23  THR  20          3HG2      THR  20   7.600  -0.756   5.089
  161    H    ALA  21           H        ALA  21   5.351  -0.892   3.922
  162    HA   ALA  21           HA       ALA  21   5.134  -2.554   6.214
  163    HB1  ALA  21          1HB       ALA  21   3.413  -0.263   5.285
  164    HB2  ALA  21          2HB       ALA  21   4.792  -0.162   6.385
  165    HB3  ALA  21          3HB       ALA  21   3.332  -1.018   6.877
  166    H    PHE  22           H        PHE  22   2.782  -1.653   3.723
  167    HA   PHE  22           HA       PHE  22   0.667  -3.258   4.308
  168    HB2  PHE  22          2HB       PHE  22   0.211  -1.960   2.559
  169    HB3  PHE  22          1HB       PHE  22   1.863  -1.954   1.991
  170    HD1  PHE  22          1HD       PHE  22  -1.222  -3.979   1.967
  171    HD2  PHE  22          2HD       PHE  22   2.400  -2.983   0.018
  172    HE1  PHE  22          1HE       PHE  22  -1.992  -5.212  -0.078
  173    HE2  PHE  22          2HE       PHE  22   1.691  -4.222  -1.974
  174    HZ   PHE  22           HZ       PHE  22  -0.500  -5.330  -2.025
  175    H    LEU  23           H        LEU  23   3.348  -4.370   2.168
  176    HA   LEU  23           HA       LEU  23   2.366  -6.987   1.855
  177    HB2  LEU  23          2HB       LEU  23   5.244  -6.093   1.786
  178    HB3  LEU  23          1HB       LEU  23   4.569  -7.511   1.008
  179    HG   LEU  23           HG       LEU  23   3.573  -4.783   0.284
  180   HD11  LEU  23          1HD1      LEU  23   6.002  -4.682   0.118
  181   HD12  LEU  23          2HD1      LEU  23   5.252  -4.678  -1.480
  182   HD13  LEU  23          3HD1      LEU  23   6.002  -6.149  -0.862
  183   HD21  LEU  23          1HD2      LEU  23   3.170  -5.922  -1.875
  184   HD22  LEU  23          2HD2      LEU  23   2.301  -6.659  -0.525
  185   HD23  LEU  23          3HD2      LEU  23   3.762  -7.424  -1.158
  186    H    SER  24           H        SER  24   5.010  -5.820   3.935
  187    HA   SER  24           HA       SER  24   5.657  -8.310   5.035
  188    HB2  SER  24          2HB       SER  24   7.289  -6.683   5.044
  189    HB3  SER  24          1HB       SER  24   6.272  -5.504   5.870
  190    HG   SER  24           HG       SER  24   7.873  -7.478   6.884
  191    H    TYR  25           H        TYR  25   3.323  -5.938   5.905
  192    HA   TYR  25           HA       TYR  25   3.024  -6.694   8.622
  193    HB2  TYR  25          2HB       TYR  25   1.581  -4.883   6.732
  194    HB3  TYR  25          1HB       TYR  25   0.697  -5.470   8.154
  195    HD1  TYR  25          1HD       TYR  25   4.082  -4.081   7.389
  196    HD2  TYR  25          2HD       TYR  25   0.784  -4.175  10.065
  197    HE1  TYR  25          1HE       TYR  25   5.190  -2.405   8.780
  198    HE2  TYR  25          2HE       TYR  25   1.881  -2.492  11.480
  199    HH   TYR  25           HH       TYR  25   4.220  -1.691  11.920
  200    H    ALA  26           H        ALA  26   1.169  -7.441   5.672
  201    HA   ALA  26           HA       ALA  26  -0.760  -8.917   7.175
  202    HB1  ALA  26          1HB       ALA  26  -1.122  -7.845   4.945
  203    HB2  ALA  26          2HB       ALA  26  -1.721  -9.496   5.104
  204    HB3  ALA  26          3HB       ALA  26  -0.215  -9.183   4.237
  205    H    GLN  27           H        GLN  27   1.434 -10.174   4.629
  206    HA   GLN  27           HA       GLN  27   1.652 -12.581   6.307
  207    HB2  GLN  27          2HB       GLN  27   2.135 -12.816   3.389
  208    HB3  GLN  27          1HB       GLN  27   1.506 -14.009   4.522
  209    HG2  GLN  27          2HG       GLN  27  -0.347 -13.583   3.253
  210    HG3  GLN  27          1HG       GLN  27  -0.597 -12.409   4.555
  211   HE21  GLN  27          1HE2      GLN  27  -1.501 -12.386   1.756
  212   HE22  GLN  27          2HE2      GLN  27  -0.888 -10.899   1.102
  213    H    GLY  28           H        GLY  28   3.315 -10.156   4.520
  214    HA2  GLY  28          2HA       GLY  28   5.678  -9.937   4.339
  215    HA3  GLY  28          1HA       GLY  28   5.842 -11.639   4.739
  216    H    GLN  29           H        GLN  29   3.428 -11.946   2.769
  217    HA   GLN  29           HA       GLN  29   5.026 -12.632   0.493
  218    HB2  GLN  29          2HB       GLN  29   2.021 -12.602   0.744
  219    HB3  GLN  29          1HB       GLN  29   2.975 -13.496  -0.431
  220    HG2  GLN  29          2HG       GLN  29   3.922 -14.857   1.325
  221    HG3  GLN  29          1HG       GLN  29   3.053 -13.916   2.540
  222   HE21  GLN  29          1HE2      GLN  29   0.664 -13.734   0.815
  223   HE22  GLN  29          2HE2      GLN  29  -0.093 -15.283   0.905
  224    H    ASP  30           H        ASP  30   3.287 -12.104  -1.624
  225    HA   ASP  30           HA       ASP  30   4.136  -9.377  -2.187
  226    HB2  ASP  30          2HB       ASP  30   2.916 -11.449  -4.023
  227    HB3  ASP  30          1HB       ASP  30   3.626  -9.919  -4.521
  228    H    LYS  31           H        LYS  31   1.466 -10.558  -0.816
  229    HA   LYS  31           HA       LYS  31  -0.244  -8.468  -1.955
  230    HB2  LYS  31          2HB       LYS  31  -1.053 -11.345  -1.454
  231    HB3  LYS  31          1HB       LYS  31  -2.200 -10.039  -1.710
  232    HG2  LYS  31          2HG       LYS  31  -0.723  -9.720  -3.901
  233    HG3  LYS  31          1HG       LYS  31  -0.455 -11.433  -3.638
  234    HD2  LYS  31          2HD       LYS  31  -3.136 -10.077  -3.851
  235    HD3  LYS  31          1HD       LYS  31  -2.383 -11.067  -5.105
  236    HE2  LYS  31          2HE       LYS  31  -3.367 -11.881  -2.407
  237    HE3  LYS  31          1HE       LYS  31  -4.035 -12.354  -3.960
  238    HZ1  LYS  31          1HZ       LYS  31  -1.968 -13.544  -4.428
  239    HZ2  LYS  31          2HZ       LYS  31  -2.729 -14.141  -3.041
  240    HZ3  LYS  31          3HZ       LYS  31  -1.377 -13.139  -2.894
  241    H    VAL  32           H        VAL  32  -2.374  -8.624  -0.331
  242    HA   VAL  32           HA       VAL  32  -1.319  -9.045   2.365
  243    HB   VAL  32           HB       VAL  32  -2.505  -6.521   1.313
  244   HG11  VAL  32          1HG1      VAL  32  -2.784  -5.824   3.716
  245   HG12  VAL  32          2HG1      VAL  32  -2.740  -7.541   4.128
  246   HG13  VAL  32          3HG1      VAL  32  -4.014  -6.916   3.087
  247   HG21  VAL  32          1HG2      VAL  32  -0.749  -5.635   2.798
  248   HG22  VAL  32          2HG2      VAL  32  -0.152  -6.674   1.505
  249   HG23  VAL  32          3HG2      VAL  32  -0.273  -7.295   3.151
  250    H    THR  33           H        THR  33  -2.576 -10.061   3.716
  251    HA   THR  33           HA       THR  33  -5.143 -11.000   2.962
  252    HB   THR  33           HB       THR  33  -5.279 -11.641   5.416
  253    HG1  THR  33          1HG       THR  33  -3.725 -10.997   6.747
  254   HG21  THR  33          1HG2      THR  33  -4.406 -13.192   3.731
  255   HG22  THR  33          2HG2      THR  33  -3.545 -13.365   5.262
  256   HG23  THR  33          3HG2      THR  33  -2.797 -12.495   3.923
  257    H    GLU  34           H        GLU  34  -7.070 -10.473   4.238
  258    HA   GLU  34           HA       GLU  34  -7.561  -7.818   3.540
  259    HB2  GLU  34          2HB       GLU  34  -9.219  -9.437   3.207
  260    HB3  GLU  34          1HB       GLU  34  -9.320  -9.803   4.934
  261    HG2  GLU  34          2HG       GLU  34 -10.319  -7.691   5.394
  262    HG3  GLU  34          1HG       GLU  34  -9.988  -7.114   3.760
  263    H    ALA  35           H        ALA  35  -6.611  -9.074   6.547
  264    HA   ALA  35           HA       ALA  35  -7.815  -7.349   8.389
  265    HB1  ALA  35          1HB       ALA  35  -5.076  -8.603   8.560
  266    HB2  ALA  35          2HB       ALA  35  -6.587  -9.394   9.018
  267    HB3  ALA  35          3HB       ALA  35  -6.027  -7.975   9.907
  268    H    MET  36           H        MET  36  -4.546  -7.173   6.958
  269    HA   MET  36           HA       MET  36  -4.015  -4.573   7.907
  270    HB2  MET  36          2HB       MET  36  -2.783  -6.401   5.905
  271    HB3  MET  36          1HB       MET  36  -2.337  -4.711   5.864
  272    HG2  MET  36          2HG       MET  36  -2.156  -6.456   8.298
  273    HG3  MET  36          1HG       MET  36  -0.809  -6.095   7.215
  274    HE1  MET  36          1HE       MET  36  -1.979  -2.973   6.587
  275    HE2  MET  36          2HE       MET  36  -0.300  -3.512   6.560
  276    HE3  MET  36          3HE       MET  36  -0.771  -2.139   7.562
  277    H    ILE  37           H        ILE  37  -5.788  -5.846   5.248
  278    HA   ILE  37           HA       ILE  37  -5.661  -3.512   3.606
  279    HB   ILE  37           HB       ILE  37  -7.170  -6.012   3.628
  280   HG12  ILE  37          2HG1      ILE  37  -5.691  -6.330   1.989
  281   HG13  ILE  37          1HG1      ILE  37  -6.450  -5.030   1.107
  282   HG21  ILE  37          1HG2      ILE  37  -8.682  -5.237   1.861
  283   HG22  ILE  37          2HG2      ILE  37  -8.140  -3.583   2.136
  284   HG23  ILE  37          3HG2      ILE  37  -9.005  -4.451   3.405
  285   HD11  ILE  37          1HD1      ILE  37  -4.029  -4.772   1.333
  286   HD12  ILE  37          2HD1      ILE  37  -4.250  -4.598   3.073
  287   HD13  ILE  37          3HD1      ILE  37  -4.958  -3.419   1.964
  288    H    ASP  38           H        ASP  38  -7.933  -4.737   6.035
  289    HA   ASP  38           HA       ASP  38  -9.827  -2.732   6.060
  290    HB2  ASP  38          2HB       ASP  38  -9.686  -4.988   7.222
  291    HB3  ASP  38          1HB       ASP  38  -8.738  -4.179   8.459
  292    H    GLN  39           H        GLN  39  -6.642  -2.898   7.597
  293    HA   GLN  39           HA       GLN  39  -6.791  -0.655   9.235
  294    HB2  GLN  39          2HB       GLN  39  -4.861  -1.928   9.540
  295    HB3  GLN  39          1HB       GLN  39  -4.563  -2.077   7.817
  296    HG2  GLN  39          2HG       GLN  39  -4.328   0.619   9.051
  297    HG3  GLN  39          1HG       GLN  39  -3.069  -0.565   9.369
  298   HE21  GLN  39          1HE2      GLN  39  -3.107   1.977   7.804
  299   HE22  GLN  39          2HE2      GLN  39  -2.486   1.551   6.253
  300    H    LEU  40           H        LEU  40  -5.734  -0.936   5.877
  301    HA   LEU  40           HA       LEU  40  -5.293   1.833   5.550
  302    HB2  LEU  40          2HB       LEU  40  -4.194   0.247   4.134
  303    HB3  LEU  40          1HB       LEU  40  -5.734  -0.366   3.519
  304    HG   LEU  40           HG       LEU  40  -5.810   2.335   2.913
  305   HD11  LEU  40          1HD1      LEU  40  -3.192   1.629   1.844
  306   HD12  LEU  40          2HD1      LEU  40  -3.219   1.825   3.597
  307   HD13  LEU  40          3HD1      LEU  40  -3.760   3.145   2.554
  308   HD21  LEU  40          1HD2      LEU  40  -6.545   0.570   1.433
  309   HD22  LEU  40          2HD2      LEU  40  -4.888  -0.001   1.241
  310   HD23  LEU  40          3HD2      LEU  40  -5.355   1.573   0.601
  311    H    ILE  41           H        ILE  41  -7.999  -0.272   4.595
  312    HA   ILE  41           HA       ILE  41  -9.475   1.728   3.297
  313    HB   ILE  41           HB       ILE  41 -10.334  -0.858   4.573
  314   HG12  ILE  41          2HG1      ILE  41  -8.797  -0.779   2.542
  315   HG13  ILE  41          1HG1      ILE  41 -10.259  -1.741   2.366
  316   HG21  ILE  41          1HG2      ILE  41 -12.004   0.915   2.797
  317   HG22  ILE  41          2HG2      ILE  41 -12.235   0.716   4.535
  318   HG23  ILE  41          3HG2      ILE  41 -12.466  -0.656   3.451
  319   HD11  ILE  41          1HD1      ILE  41  -9.785   1.032   1.297
  320   HD12  ILE  41          2HD1      ILE  41 -11.291   0.123   1.140
  321   HD13  ILE  41          3HD1      ILE  41  -9.818  -0.465   0.367
  322    H    CYS  42           H        CYS  42  -9.590   0.672   6.697
  323    HA   CYS  42           HA       CYS  42 -11.731   2.459   7.378
  324    HB2  CYS  42          2HB       CYS  42 -11.220   0.360   8.593
  325    HB3  CYS  42          1HB       CYS  42  -9.753   1.096   9.205
  326    HG   CYS  42           HG       CYS  42 -11.574   3.284  10.232
  327    H    GLY  43           H        GLY  43  -8.438   2.759   6.880
  328    HA2  GLY  43          2HA       GLY  43  -7.653   4.894   8.466
  329    HA3  GLY  43          1HA       GLY  43  -7.096   4.626   6.823
  330    H    ALA  44           H        ALA  44  -9.153   5.172   5.220
  331    HA   ALA  44           HA       ALA  44  -9.587   8.034   5.696
  332    HB1  ALA  44          1HB       ALA  44 -10.099   8.200   3.352
  333    HB2  ALA  44          2HB       ALA  44 -10.177   6.441   3.199
  334    HB3  ALA  44          3HB       ALA  44  -8.627   7.233   3.517
  335    H    PHE  45           H        PHE  45 -11.400   5.265   4.492
  336    HA   PHE  45           HA       PHE  45 -13.949   6.503   5.089
  337    HB2  PHE  45          2HB       PHE  45 -13.871   3.657   4.444
  338    HB3  PHE  45          1HB       PHE  45 -14.857   4.952   3.769
  339    HD1  PHE  45          1HD       PHE  45 -12.064   2.835   3.192
  340    HD2  PHE  45          2HD       PHE  45 -13.772   6.562   2.103
  341    HE1  PHE  45          1HE       PHE  45 -10.678   2.863   1.168
  342    HE2  PHE  45          2HE       PHE  45 -12.377   6.611   0.076
  343    HZ   PHE  45           HZ       PHE  45 -10.817   4.754  -0.389
  344    HA   PRO  46           HA       PRO  46 -14.386   4.616   8.962
  345    HB2  PRO  46          2HB       PRO  46 -16.909   3.784   9.179
  346    HB3  PRO  46          1HB       PRO  46 -16.497   5.491   9.024
  347    HG2  PRO  46          2HG       PRO  46 -17.334   3.561   6.886
  348    HG3  PRO  46          1HG       PRO  46 -17.990   5.180   7.223
  349    HD2  PRO  46          2HD       PRO  46 -16.144   4.748   5.302
  350    HD3  PRO  46          1HD       PRO  46 -16.165   6.244   6.261
  351    H    GLY  47           H        GLY  47 -15.455   2.594  10.151
  352    HA2  GLY  47          2HA       GLY  47 -14.117   0.272   9.201
  353    HA3  GLY  47          1HA       GLY  47 -15.199   0.357  10.586
  354    H    LEU  48           H        LEU  48 -15.087   0.206   7.107
  355    HA   LEU  48           HA       LEU  48 -17.787  -0.150   6.548
  356    HB2  LEU  48          2HB       LEU  48 -15.375  -1.233   5.104
  357    HB3  LEU  48          1HB       LEU  48 -16.992  -1.201   4.439
  358    HG   LEU  48           HG       LEU  48 -15.285   1.191   5.125
  359   HD11  LEU  48          1HD1      LEU  48 -15.255   1.562   2.730
  360   HD12  LEU  48          2HD1      LEU  48 -16.266   0.138   2.478
  361   HD13  LEU  48          3HD1      LEU  48 -14.629  -0.047   3.101
  362   HD21  LEU  48          1HD2      LEU  48 -17.088   2.520   4.129
  363   HD22  LEU  48          2HD2      LEU  48 -17.630   1.668   5.574
  364   HD23  LEU  48          3HD2      LEU  48 -18.073   1.064   3.978
  365    H    SER  49           H        SER  49 -19.149  -1.836   6.568
  366    HA   SER  49           HA       SER  49 -18.480  -4.320   7.759
  367    HB2  SER  49          2HB       SER  49 -20.709  -5.044   6.794
  368    HB3  SER  49          1HB       SER  49 -20.780  -3.611   7.820
  369    HG   SER  49           HG       SER  49 -21.568  -2.587   6.178
  370    H    TRP  50           H        TRP  50 -18.592  -6.457   6.526
  371    HA   TRP  50           HA       TRP  50 -16.536  -6.337   4.645
  372    HB2  TRP  50          2HB       TRP  50 -17.114  -8.357   6.030
  373    HB3  TRP  50          1HB       TRP  50 -18.434  -8.662   4.901
  374    HD1  TRP  50           HD       TRP  50 -14.603  -8.204   4.735
  375    HE1  TRP  50          1HE       TRP  50 -13.742  -9.694   2.826
  376    HE3  TRP  50          3HE       TRP  50 -19.074  -9.996   3.062
  377    HZ2  TRP  50          2HZ       TRP  50 -14.844 -11.403   0.888
  378    HZ3  TRP  50          3HZ       TRP  50 -19.081 -11.557   1.167
  379    HH2  TRP  50           HH       TRP  50 -17.001 -12.252   0.097
  380    H    GLU  51           H        GLU  51 -20.008  -6.381   4.197
  381    HA   GLU  51           HA       GLU  51 -20.074  -6.948   1.450
  382    HB2  GLU  51          2HB       GLU  51 -21.926  -5.186   3.066
  383    HB3  GLU  51          1HB       GLU  51 -22.272  -5.826   1.464
  384    HG2  GLU  51          2HG       GLU  51 -21.796  -7.484   3.925
  385    HG3  GLU  51          1HG       GLU  51 -23.363  -7.098   3.258
  386    H    GLN  52           H        GLN  52 -20.048  -3.794   3.104
  387    HA   GLN  52           HA       GLN  52 -19.832  -2.318   0.679
  388    HB2  GLN  52          2HB       GLN  52 -19.687  -1.651   3.582
  389    HB3  GLN  52          1HB       GLN  52 -19.095  -0.477   2.414
  390    HG2  GLN  52          2HG       GLN  52 -21.860  -1.663   2.484
  391    HG3  GLN  52          1HG       GLN  52 -21.407  -0.041   3.005
  392   HE21  GLN  52          1HE2      GLN  52 -19.472   0.235   0.799
  393   HE22  GLN  52          2HE2      GLN  52 -20.423   0.530  -0.620
  394    H    LEU  53           H        LEU  53 -17.527  -3.703   2.880
  395    HA   LEU  53           HA       LEU  53 -15.371  -2.081   1.928
  396    HB2  LEU  53          2HB       LEU  53 -15.394  -3.005   4.206
  397    HB3  LEU  53          1HB       LEU  53 -15.314  -4.624   3.548
  398    HG   LEU  53           HG       LEU  53 -13.133  -2.840   2.689
  399   HD11  LEU  53          1HD1      LEU  53 -13.383  -2.095   4.998
  400   HD12  LEU  53          2HD1      LEU  53 -11.922  -3.065   4.812
  401   HD13  LEU  53          3HD1      LEU  53 -13.358  -3.769   5.553
  402   HD21  LEU  53          1HD2      LEU  53 -13.267  -5.251   2.151
  403   HD22  LEU  53          2HD2      LEU  53 -13.165  -5.617   3.873
  404   HD23  LEU  53          3HD2      LEU  53 -11.812  -4.834   3.056
  405    H    GLN  54           H        GLN  54 -16.624  -5.315   1.264
  406    HA   GLN  54           HA       GLN  54 -14.496  -6.174  -0.358
  407    HB2  GLN  54          2HB       GLN  54 -15.843  -7.964  -1.018
  408    HB3  GLN  54          1HB       GLN  54 -16.390  -7.572   0.594
  409    HG2  GLN  54          2HG       GLN  54 -18.371  -6.607  -0.173
  410    HG3  GLN  54          1HG       GLN  54 -17.769  -6.478  -1.824
  411   HE21  GLN  54          1HE2      GLN  54 -19.154  -8.573   0.567
  412   HE22  GLN  54          2HE2      GLN  54 -19.527  -9.873  -0.504
  413    H    GLU  55           H        GLU  55 -17.437  -4.335  -1.084
  414    HA   GLU  55           HA       GLU  55 -16.986  -4.307  -3.887
  415    HB2  GLU  55          2HB       GLU  55 -18.685  -2.553  -3.998
  416    HB3  GLU  55          1HB       GLU  55 -19.217  -3.916  -3.033
  417    HG2  GLU  55          2HG       GLU  55 -19.874  -2.347  -1.600
  418    HG3  GLU  55          1HG       GLU  55 -18.203  -2.303  -1.122
  419    H    LYS  56           H        LYS  56 -15.853  -2.353  -1.239
  420    HA   LYS  56           HA       LYS  56 -14.840  -0.148  -2.571
  421    HB2  LYS  56          2HB       LYS  56 -14.656  -1.079  -0.012
  422    HB3  LYS  56          1HB       LYS  56 -13.007  -1.350  -0.581
  423    HG2  LYS  56          2HG       LYS  56 -13.116   0.804   0.457
  424    HG3  LYS  56          1HG       LYS  56 -12.937   1.040  -1.282
  425    HD2  LYS  56          2HD       LYS  56 -15.414   1.332  -1.423
  426    HD3  LYS  56          1HD       LYS  56 -15.468   1.274   0.339
  427    HE2  LYS  56          2HE       LYS  56 -15.481   3.566  -0.362
  428    HE3  LYS  56          1HE       LYS  56 -13.934   3.214   0.403
  429    HZ1  LYS  56          1HZ       LYS  56 -12.947   2.982  -1.797
  430    HZ2  LYS  56          2HZ       LYS  56 -13.645   4.509  -1.614
  431    HZ3  LYS  56          3HZ       LYS  56 -14.433   3.325  -2.526
  432    H    LYS  57           H        LYS  57 -13.189  -3.239  -1.952
  433    HA   LYS  57           HA       LYS  57 -11.061  -2.392  -3.784
  434    HB2  LYS  57          2HB       LYS  57 -10.532  -4.874  -2.402
  435    HB3  LYS  57          1HB       LYS  57  -9.618  -3.375  -2.392
  436    HG2  LYS  57          2HG       LYS  57 -10.147  -3.384  -0.215
  437    HG3  LYS  57          1HG       LYS  57 -11.654  -2.694  -0.795
  438    HD2  LYS  57          2HD       LYS  57 -12.298  -4.418   0.641
  439    HD3  LYS  57          1HD       LYS  57 -12.507  -5.070  -0.983
  440    HE2  LYS  57          2HE       LYS  57 -10.192  -6.097  -0.705
  441    HE3  LYS  57          1HE       LYS  57 -10.323  -5.650   0.987
  442    HZ1  LYS  57          1HZ       LYS  57 -12.093  -7.092   1.342
  443    HZ2  LYS  57          2HZ       LYS  57 -11.069  -7.982   0.328
  444    HZ3  LYS  57          3HZ       LYS  57 -12.438  -7.232  -0.311
  445    H    LYS  58           H        LYS  58 -13.807  -3.773  -4.323
  446    HA   LYS  58           HA       LYS  58 -13.414  -6.338  -5.306
  447    HB2  LYS  58          2HB       LYS  58 -15.404  -6.012  -6.650
  448    HB3  LYS  58          1HB       LYS  58 -15.630  -5.277  -5.072
  449    HG2  LYS  58          2HG       LYS  58 -15.209  -3.078  -6.014
  450    HG3  LYS  58          1HG       LYS  58 -14.916  -3.800  -7.598
  451    HD2  LYS  58          2HD       LYS  58 -17.213  -4.627  -7.651
  452    HD3  LYS  58          1HD       LYS  58 -17.507  -3.938  -6.056
  453    HE2  LYS  58          2HE       LYS  58 -16.692  -2.330  -8.467
  454    HE3  LYS  58          1HE       LYS  58 -18.363  -2.562  -7.957
  455    HZ1  LYS  58          1HZ       LYS  58 -17.301  -0.462  -7.188
  456    HZ2  LYS  58          2HZ       LYS  58 -16.279  -1.386  -6.203
  457    HZ3  LYS  58          3HZ       LYS  58 -17.951  -1.412  -5.952
  458    H    GLY  59           H        GLY  59 -12.807  -7.217  -7.233
  459    HA2  GLY  59          2HA       GLY  59 -12.353  -7.029  -9.594
  460    HA3  GLY  59          1HA       GLY  59 -11.814  -5.382  -9.315
  461    H    ARG  60           H        ARG  60 -10.178  -5.869  -7.059
  462    HA   ARG  60           HA       ARG  60  -8.043  -7.364  -8.411
  463    HB2  ARG  60          2HB       ARG  60  -8.006  -4.842  -8.747
  464    HB3  ARG  60          1HB       ARG  60  -7.597  -4.726  -7.041
  465    HG2  ARG  60          2HG       ARG  60  -5.621  -4.604  -8.455
  466    HG3  ARG  60          1HG       ARG  60  -5.585  -6.029  -7.411
  467    HD2  ARG  60          2HD       ARG  60  -6.268  -7.436  -9.239
  468    HD3  ARG  60          1HD       ARG  60  -6.483  -6.031 -10.288
  469    HE   ARG  60           HE       ARG  60  -3.852  -6.009  -9.339
  470   HH11  ARG  60          1HH1      ARG  60  -5.861  -7.990 -11.417
  471   HH12  ARG  60          2HH1      ARG  60  -4.524  -8.597 -12.337
  472   HH21  ARG  60          1HH2      ARG  60  -2.094  -6.817 -10.543
  473   HH22  ARG  60          2HH2      ARG  60  -2.381  -7.936 -11.837
  474    H    ALA  61           H        ALA  61  -9.707  -6.797  -5.509
  475    HA   ALA  61           HA       ALA  61  -7.463  -7.821  -3.914
  476    HB1  ALA  61          1HB       ALA  61  -8.648  -7.129  -1.957
  477    HB2  ALA  61          2HB       ALA  61 -10.104  -6.792  -2.895
  478    HB3  ALA  61          3HB       ALA  61  -8.669  -5.788  -3.104
  479    H    ALA  62           H        ALA  62  -9.962  -8.927  -5.671
  480    HA   ALA  62           HA       ALA  62 -11.100 -10.916  -5.798
  481    HB1  ALA  62          1HB       ALA  62  -8.806 -11.524  -6.353
  482    HB2  ALA  62          2HB       ALA  62  -9.644 -12.849  -5.546
  483    HB3  ALA  62          3HB       ALA  62  -8.483 -11.867  -4.654
  484    H    ALA  63           H        ALA  63 -12.178  -9.759  -3.736
  485    HA   ALA  63           HA       ALA  63 -13.248  -9.944  -1.759
  486    HB1  ALA  63          1HB       ALA  63 -12.565 -12.871  -1.912
  487    HB2  ALA  63          2HB       ALA  63 -13.988 -12.110  -2.623
  488    HB3  ALA  63          3HB       ALA  63 -13.779 -12.128  -0.873
  489    H    ASN  64           H        ASN  64 -10.552 -12.279  -1.393
  490    HA   ASN  64           HA       ASN  64  -9.571 -10.560   0.770
  491    HB2  ASN  64          2HB       ASN  64  -9.886 -13.551   0.813
  492    HB3  ASN  64          1HB       ASN  64  -8.759 -12.724   1.882
  493   HD21  ASN  64          1HD2      ASN  64 -10.433 -10.381   2.136
  494   HD22  ASN  64          2HD2      ASN  64 -11.740 -10.815   3.179
  495    H    GLY  65           H        GLY  65  -7.770  -9.726   0.213
  496    HA2  GLY  65          2HA       GLY  65  -5.348 -10.436  -0.023
  497    HA3  GLY  65          1HA       GLY  65  -5.911 -11.336  -1.420
  498    H    TYR  66           H        TYR  66  -5.832  -7.990  -0.118
  499    HA   TYR  66           HA       TYR  66  -5.751  -6.754  -2.682
  500    HB2  TYR  66          2HB       TYR  66  -5.477  -5.859  -0.024
  501    HB3  TYR  66          1HB       TYR  66  -4.041  -5.341  -0.884
  502    HD1  TYR  66          1HD       TYR  66  -5.084  -3.134  -0.044
  503    HD2  TYR  66          2HD       TYR  66  -6.771  -5.440  -3.179
  504    HE1  TYR  66          1HE       TYR  66  -6.240  -1.132  -0.861
  505    HE2  TYR  66          2HE       TYR  66  -7.945  -3.455  -4.011
  506    HH   TYR  66           HH       TYR  66  -7.214  -0.320  -3.008
  507    H    ASP  67           H        ASP  67  -3.839  -5.715  -3.617
  508    HA   ASP  67           HA       ASP  67  -1.347  -7.074  -3.069
  509    HB2  ASP  67          2HB       ASP  67  -1.141  -8.096  -5.127
  510    HB3  ASP  67          1HB       ASP  67  -2.887  -8.225  -4.869
  511    H    ARG  68           H        ARG  68   0.359  -6.067  -4.496
  512    HA   ARG  68           HA       ARG  68   0.418  -3.475  -3.470
  513    HB2  ARG  68          2HB       ARG  68   2.630  -3.273  -4.471
  514    HB3  ARG  68          1HB       ARG  68   2.430  -4.839  -3.700
  515    HG2  ARG  68          2HG       ARG  68   2.058  -5.867  -5.886
  516    HG3  ARG  68          1HG       ARG  68   2.268  -4.293  -6.658
  517    HD2  ARG  68          2HD       ARG  68   4.544  -4.163  -5.746
  518    HD3  ARG  68          1HD       ARG  68   4.329  -5.747  -5.004
  519    HE   ARG  68           HE       ARG  68   3.895  -5.730  -7.849
  520   HH11  ARG  68          1HH1      ARG  68   6.320  -5.945  -5.334
  521   HH12  ARG  68          2HH1      ARG  68   7.425  -6.867  -6.301
  522   HH21  ARG  68          1HH2      ARG  68   5.360  -6.925  -9.133
  523   HH22  ARG  68          2HH2      ARG  68   6.887  -7.408  -8.469
  524    H    SER  69           H        SER  69  -0.513  -4.585  -6.654
  525    HA   SER  69           HA       SER  69  -0.231  -2.017  -7.884
  526    HB2  SER  69          2HB       SER  69  -1.572  -2.968  -9.722
  527    HB3  SER  69          1HB       SER  69  -0.246  -4.028  -9.250
  528    HG   SER  69           HG       SER  69  -1.764  -5.286  -8.066
  529    H    ALA  70           H        ALA  70  -2.971  -3.806  -6.538
  530    HA   ALA  70           HA       ALA  70  -4.909  -1.778  -6.994
  531    HB1  ALA  70          1HB       ALA  70  -5.353  -4.225  -6.545
  532    HB2  ALA  70          2HB       ALA  70  -6.365  -3.087  -5.661
  533    HB3  ALA  70          3HB       ALA  70  -5.020  -3.883  -4.845
  534    H    PHE  71           H        PHE  71  -3.053  -2.799  -4.197
  535    HA   PHE  71           HA       PHE  71  -4.142  -1.029  -2.340
  536    HB2  PHE  71          2HB       PHE  71  -2.820  -3.005  -1.714
  537    HB3  PHE  71          1HB       PHE  71  -1.382  -2.275  -2.420
  538    HD1  PHE  71          1HD       PHE  71  -3.715  -2.193   0.382
  539    HD2  PHE  71          2HD       PHE  71  -0.202  -0.502  -1.299
  540    HE1  PHE  71          1HE       PHE  71  -3.203  -1.144   2.540
  541    HE2  PHE  71          2HE       PHE  71   0.316   0.551   0.858
  542    HZ   PHE  71           HZ       PHE  71  -1.184   0.242   2.773
  543    H    PHE  72           H        PHE  72  -1.262  -0.728  -4.420
  544    HA   PHE  72           HA       PHE  72  -0.471   1.754  -3.321
  545    HB2  PHE  72          2HB       PHE  72   1.081   0.266  -4.539
  546    HB3  PHE  72          1HB       PHE  72   0.226   0.636  -6.033
  547    HD1  PHE  72          1HD       PHE  72   1.544   2.652  -3.184
  548    HD2  PHE  72          2HD       PHE  72   1.415   2.042  -7.392
  549    HE1  PHE  72          1HE       PHE  72   2.969   4.625  -3.508
  550    HE2  PHE  72          2HE       PHE  72   2.843   4.015  -7.724
  551    HZ   PHE  72           HZ       PHE  72   3.620   5.310  -5.783
  552    H    SER  73           H        SER  73  -2.536   0.875  -5.985
  553    HA   SER  73           HA       SER  73  -2.746   3.401  -7.203
  554    HB2  SER  73          2HB       SER  73  -3.510   1.215  -8.194
  555    HB3  SER  73          1HB       SER  73  -4.895   1.268  -7.104
  556    HG   SER  73           HG       SER  73  -4.245   3.263  -9.019
  557    H    LEU  74           H        LEU  74  -4.405   1.941  -4.480
  558    HA   LEU  74           HA       LEU  74  -6.308   4.060  -4.176
  559    HB2  LEU  74          2HB       LEU  74  -6.759   1.785  -3.372
  560    HB3  LEU  74          1HB       LEU  74  -5.423   1.917  -2.247
  561    HG   LEU  74           HG       LEU  74  -6.590   3.517  -0.919
  562   HD11  LEU  74          1HD1      LEU  74  -8.815   4.347  -1.518
  563   HD12  LEU  74          2HD1      LEU  74  -8.702   3.523  -3.073
  564   HD13  LEU  74          3HD1      LEU  74  -7.598   4.843  -2.691
  565   HD21  LEU  74          1HD2      LEU  74  -8.658   2.246  -0.376
  566   HD22  LEU  74          2HD2      LEU  74  -7.209   1.248  -0.489
  567   HD23  LEU  74          3HD2      LEU  74  -8.368   1.266  -1.815
  568    H    VAL  75           H        VAL  75  -3.299   3.153  -2.524
  569    HA   VAL  75           HA       VAL  75  -3.394   5.214  -0.594
  570    HB   VAL  75           HB       VAL  75  -0.885   3.881  -1.626
  571   HG11  VAL  75          1HG1      VAL  75  -0.383   4.086   0.903
  572   HG12  VAL  75          2HG1      VAL  75  -1.573   5.391   0.826
  573   HG13  VAL  75          3HG1      VAL  75  -0.127   5.453  -0.182
  574   HG21  VAL  75          1HG2      VAL  75  -2.235   2.050  -1.113
  575   HG22  VAL  75          2HG2      VAL  75  -2.978   2.875   0.258
  576   HG23  VAL  75          3HG2      VAL  75  -1.301   2.332   0.363
  577    H    ALA  76           H        ALA  76  -1.918   5.046  -3.808
  578    HA   ALA  76           HA       ALA  76  -0.456   7.461  -3.621
  579    HB1  ALA  76          1HB       ALA  76  -0.220   7.307  -6.031
  580    HB2  ALA  76          2HB       ALA  76  -1.502   6.099  -6.098
  581    HB3  ALA  76          3HB       ALA  76   0.021   5.725  -5.290
  582    H    SER  77           H        SER  77  -3.762   6.911  -3.827
  583    HA   SER  77           HA       SER  77  -4.274   9.549  -5.001
  584    HB2  SER  77          2HB       SER  77  -5.439   7.460  -5.882
  585    HB3  SER  77          1HB       SER  77  -6.307   7.408  -4.350
  586    HG   SER  77           HG       SER  77  -7.538   8.983  -5.002
  587    H    ASP  78           H        ASP  78  -3.908   8.041  -2.033
  588    HA   ASP  78           HA       ASP  78  -5.613  10.038  -0.712
  589    HB2  ASP  78          2HB       ASP  78  -5.465   7.080  -0.268
  590    HB3  ASP  78          1HB       ASP  78  -5.886   8.147   1.071
  591    H    GLU  79           H        GLU  79  -4.303  11.396   0.265
  592    HA   GLU  79           HA       GLU  79  -1.686  10.836   1.144
  593    HB2  GLU  79          2HB       GLU  79  -2.057  13.071   0.737
  594    HB3  GLU  79          1HB       GLU  79  -3.624  13.082   1.524
  595    HG2  GLU  79          2HG       GLU  79  -1.173  12.689   3.172
  596    HG3  GLU  79          1HG       GLU  79  -1.557  14.298   2.568
  597    H    GLN  80           H        GLN  80  -4.784  10.629   2.792
  598    HA   GLN  80           HA       GLN  80  -3.832  10.373   5.415
  599    HB2  GLN  80          2HB       GLN  80  -6.123   8.712   4.396
  600    HB3  GLN  80          1HB       GLN  80  -5.901   9.400   5.992
  601    HG2  GLN  80          2HG       GLN  80  -7.529  10.755   5.157
  602    HG3  GLN  80          1HG       GLN  80  -6.087  11.669   4.727
  603   HE21  GLN  80          1HE2      GLN  80  -7.019   8.746   3.053
  604   HE22  GLN  80          2HE2      GLN  80  -7.497   9.507   1.572
  605    H    TYR  81           H        TYR  81  -3.649   8.317   2.700
  606    HA   TYR  81           HA       TYR  81  -3.435   5.871   4.217
  607    HB2  TYR  81          2HB       TYR  81  -3.728   6.511   1.301
  608    HB3  TYR  81          1HB       TYR  81  -3.253   4.900   1.834
  609    HD1  TYR  81          1HD       TYR  81  -5.637   4.886   0.348
  610    HD2  TYR  81          2HD       TYR  81  -5.171   5.959   4.423
  611    HE1  TYR  81          1HE       TYR  81  -7.974   4.214   0.779
  612    HE2  TYR  81          2HE       TYR  81  -7.479   5.339   4.854
  613    HH   TYR  81           HH       TYR  81  -9.329   3.520   2.717
  614    H    VAL  82           H        VAL  82  -1.460   7.853   2.024
  615    HA   VAL  82           HA       VAL  82   0.731   6.142   2.006
  616    HB   VAL  82           HB       VAL  82   1.930   8.195   1.370
  617   HG11  VAL  82          1HG1      VAL  82   1.034   6.889  -0.389
  618   HG12  VAL  82          2HG1      VAL  82   0.685   8.579  -0.758
  619   HG13  VAL  82          3HG1      VAL  82  -0.578   7.542  -0.094
  620   HG21  VAL  82          1HG2      VAL  82   0.536  10.189   0.803
  621   HG22  VAL  82          2HG2      VAL  82   0.962   9.931   2.495
  622   HG23  VAL  82          3HG2      VAL  82  -0.649   9.499   1.915
  623    H    ARG  83           H        ARG  83   0.038   9.012   3.888
  624    HA   ARG  83           HA       ARG  83   2.233   8.739   5.638
  625    HB2  ARG  83          2HB       ARG  83  -0.259  10.194   6.395
  626    HB3  ARG  83          1HB       ARG  83   1.388  10.542   6.856
  627    HG2  ARG  83          2HG       ARG  83   1.886  11.267   4.561
  628    HG3  ARG  83          1HG       ARG  83   0.204  10.954   4.128
  629    HD2  ARG  83          2HD       ARG  83   0.788  13.326   4.633
  630    HD3  ARG  83          1HD       ARG  83  -0.600  12.617   5.439
  631    HE   ARG  83           HE       ARG  83   1.900  12.546   6.912
  632   HH11  ARG  83          1HH1      ARG  83  -1.143  14.186   6.352
  633   HH12  ARG  83          2HH1      ARG  83  -1.072  15.083   7.840
  634   HH21  ARG  83          1HH2      ARG  83   1.999  13.716   8.867
  635   HH22  ARG  83          2HH2      ARG  83   0.720  14.820   9.271
  636    H    PHE  84           H        PHE  84  -0.992   7.373   5.607
  637    HA   PHE  84           HA       PHE  84  -1.212   6.743   8.343
  638    HB2  PHE  84          2HB       PHE  84  -2.807   6.144   6.257
  639    HB3  PHE  84          1HB       PHE  84  -1.986   4.590   6.432
  640    HD1  PHE  84          1HD       PHE  84  -2.126   3.353   8.544
  641    HD2  PHE  84          2HD       PHE  84  -4.481   6.811   7.804
  642    HE1  PHE  84          1HE       PHE  84  -3.639   2.707  10.377
  643    HE2  PHE  84          2HE       PHE  84  -5.998   6.177   9.632
  644    HZ   PHE  84           HZ       PHE  84  -5.579   4.122  10.924
  645    H    ILE  85           H        ILE  85   0.401   5.021   5.717
  646    HA   ILE  85           HA       ILE  85   1.393   2.991   7.503
  647    HB   ILE  85           HB       ILE  85   1.854   3.573   4.595
  648   HG12  ILE  85          2HG1      ILE  85   0.861   1.190   6.178
  649   HG13  ILE  85          1HG1      ILE  85  -0.115   2.285   5.209
  650   HG21  ILE  85          1HG2      ILE  85   3.423   1.609   4.578
  651   HG22  ILE  85          2HG2      ILE  85   3.488   1.741   6.335
  652   HG23  ILE  85          3HG2      ILE  85   4.063   3.072   5.330
  653   HD11  ILE  85          1HD1      ILE  85   1.965   0.364   4.150
  654   HD12  ILE  85          2HD1      ILE  85   0.969   1.462   3.185
  655   HD13  ILE  85          3HD1      ILE  85   0.214   0.157   4.096
  656    H    ALA  86           H        ALA  86   2.815   5.760   5.799
  657    HA   ALA  86           HA       ALA  86   5.404   5.679   6.681
  658    HB1  ALA  86          1HB       ALA  86   3.825   8.237   6.625
  659    HB2  ALA  86          2HB       ALA  86   4.268   7.369   5.155
  660    HB3  ALA  86          3HB       ALA  86   5.527   7.981   6.230
  661    H    GLN  87           H        GLN  87   2.577   6.736   8.452
  662    HA   GLN  87           HA       GLN  87   4.012   7.814  10.658
  663    HB2  GLN  87          2HB       GLN  87   1.752   8.566   9.963
  664    HB3  GLN  87          1HB       GLN  87   1.108   7.012  10.462
  665    HG2  GLN  87          2HG       GLN  87   1.735   7.460  12.758
  666    HG3  GLN  87          1HG       GLN  87   2.459   8.995  12.276
  667   HE21  GLN  87          1HE2      GLN  87  -0.502   7.252  12.775
  668   HE22  GLN  87          2HE2      GLN  87  -1.550   8.630  12.746
  669    H    HIS  88           H        HIS  88   2.409   4.748   9.944
  670    HA   HIS  88           HA       HIS  88   2.923   3.832  12.656
  671    HB2  HIS  88          2HB       HIS  88   1.395   2.109  12.313
  672    HB3  HIS  88          1HB       HIS  88   0.734   3.423  11.361
  673    HD1  HIS  88          1HD       HIS  88   3.066   0.487  10.607
  674    HD2  HIS  88          2HD       HIS  88  -0.238   2.485   9.049
  675    HE1  HIS  88          1HE       HIS  88   2.431  -0.756   8.525
  676    HE2  HIS  88          2HE       HIS  88   0.289   0.310   7.774
  677    H    PHE  89           H        PHE  89   4.579   3.840   9.760
  678    HA   PHE  89           HA       PHE  89   6.580   2.078  10.819
  679    HB2  PHE  89          2HB       PHE  89   4.876   0.549   9.743
  680    HB3  PHE  89          1HB       PHE  89   5.297   1.296   8.206
  681    HD1  PHE  89          1HD       PHE  89   6.966   0.330   6.923
  682    HD2  PHE  89          2HD       PHE  89   6.881  -0.399  11.114
  683    HE1  PHE  89          1HE       PHE  89   8.825  -1.263   6.682
  684    HE2  PHE  89          2HE       PHE  89   8.741  -1.989  10.878
  685    HZ   PHE  89           HZ       PHE  89   9.716  -2.422   8.663
  686    HA   PRO  90           HA       PRO  90   8.902   5.294   8.578
  687    HB2  PRO  90          2HB       PRO  90  10.959   3.361   9.562
  688    HB3  PRO  90          1HB       PRO  90  10.968   5.129   9.605
  689    HG2  PRO  90          2HG       PRO  90  10.429   3.728  11.800
  690    HG3  PRO  90          1HG       PRO  90   9.550   5.225  11.438
  691    HD2  PRO  90          2HD       PRO  90   8.642   2.401  11.230
  692    HD3  PRO  90          1HD       PRO  90   7.713   3.865  11.613
  693    H    CYS  91           H        CYS  91  10.223   5.259   6.714
  694    HA   CYS  91           HA       CYS  91   9.437   3.205   4.879
  695    HB2  CYS  91          2HB       CYS  91  10.789   4.580   3.248
  696    HB3  CYS  91          1HB       CYS  91   9.485   5.445   4.060
  697    HG   CYS  91           HG       CYS  91  12.764   5.622   5.030
  698    H    ALA  92           H        ALA  92  10.408   1.462   4.358
  699    HA   ALA  92           HA       ALA  92  13.282   1.159   4.937
  700    HB1  ALA  92          1HB       ALA  92  11.902  -0.303   6.332
  701    HB2  ALA  92          2HB       ALA  92  12.882  -1.236   5.197
  702    HB3  ALA  92          3HB       ALA  92  11.162  -0.989   4.884
  703    HA   PRO  93           HA       PRO  93  13.813   0.358   0.617
  704    HB2  PRO  93          2HB       PRO  93  16.215  -0.772   0.631
  705    HB3  PRO  93          1HB       PRO  93  16.004   0.888   1.182
  706    HG2  PRO  93          2HG       PRO  93  16.271  -1.622   2.796
  707    HG3  PRO  93          1HG       PRO  93  17.040  -0.045   3.053
  708    HD2  PRO  93          2HD       PRO  93  14.787  -0.911   4.375
  709    HD3  PRO  93          1HD       PRO  93  15.209   0.796   4.128
  710    H    GLU  94           H        GLU  94  12.731  -1.923   2.524
  711    HA   GLU  94           HA       GLU  94  11.993  -4.044   2.363
  712    HB2  GLU  94          2HB       GLU  94  11.188  -3.465   0.139
  713    HB3  GLU  94          1HB       GLU  94  12.771  -3.808  -0.545
  714    HG2  GLU  94          2HG       GLU  94  12.545  -6.155   0.136
  715    HG3  GLU  94          1HG       GLU  94  10.945  -5.801   0.782
  716    H    GLU  95           H        GLU  95  12.996  -5.613   3.331
  717    HA   GLU  95           HA       GLU  95  14.392  -7.296   3.825
  718    HB2  GLU  95          2HB       GLU  95  13.997  -7.813   1.400
  719    HB3  GLU  95          1HB       GLU  95  15.524  -7.018   1.051
  720    HG2  GLU  95          2HG       GLU  95  16.636  -8.626   2.551
  721    HG3  GLU  95          1HG       GLU  95  15.075  -9.415   2.767
  722    H    GLU  96           H        GLU  96  16.668  -5.676   1.601
  723    HA   GLU  96           HA       GLU  96  18.258  -4.578   3.677
  724    HB2  GLU  96          2HB       GLU  96  18.535  -7.045   4.072
  725    HB3  GLU  96          1HB       GLU  96  19.312  -7.147   2.499
  726    HG2  GLU  96          2HG       GLU  96  21.109  -5.749   3.226
  727    HG3  GLU  96          1HG       GLU  96  20.291  -5.419   4.755
  728    H    LYS  97           H        LYS  97  18.462  -6.114   0.454
  729    HA   LYS  97           HA       LYS  97  20.363  -4.015  -0.336
  730    HB2  LYS  97          2HB       LYS  97  21.190  -6.287  -0.620
  731    HB3  LYS  97          1HB       LYS  97  19.786  -6.706  -1.585
  732    HG2  LYS  97          2HG       LYS  97  21.651  -6.374  -3.040
  733    HG3  LYS  97          1HG       LYS  97  20.509  -5.056  -3.282
  734    HD2  LYS  97          2HD       LYS  97  22.575  -3.986  -3.239
  735    HD3  LYS  97          1HD       LYS  97  21.966  -3.762  -1.603
  736    HE2  LYS  97          2HE       LYS  97  23.859  -5.967  -2.400
  737    HE3  LYS  97          1HE       LYS  97  24.389  -4.411  -1.778
  738    HZ1  LYS  97          1HZ       LYS  97  22.993  -4.918   0.228
  739    HZ2  LYS  97          2HZ       LYS  97  24.361  -5.888   0.031
  740    HZ3  LYS  97          3HZ       LYS  97  22.835  -6.498  -0.357
  741    HA   PRO  98           HA       PRO  98  16.820  -2.634  -2.781
  742    HB2  PRO  98          2HB       PRO  98  17.362  -0.014  -2.649
  743    HB3  PRO  98          1HB       PRO  98  16.642  -0.878  -1.289
  744    HG2  PRO  98          2HG       PRO  98  19.436   0.060  -1.672
  745    HG3  PRO  98          1HG       PRO  98  18.485  -0.063  -0.183
  746    HD2  PRO  98          2HD       PRO  98  20.415  -1.896  -1.086
  747    HD3  PRO  98          1HD       PRO  98  19.235  -2.165   0.212
  748    HA   PRO  99           HA       PRO  99  19.142  -2.192  -6.606
  749    HB2  PRO  99          2HB       PRO  99  17.041  -1.732  -8.239
  750    HB3  PRO  99          1HB       PRO  99  17.388  -3.335  -7.588
  751    HG2  PRO  99          2HG       PRO  99  15.385  -1.309  -6.667
  752    HG3  PRO  99          1HG       PRO  99  15.201  -3.063  -6.848
  753    HD2  PRO  99          2HD       PRO  99  15.662  -1.853  -4.453
  754    HD3  PRO  99          1HD       PRO  99  16.202  -3.502  -4.828
  755    H    GLU 100           H        GLU 100  17.184   0.089  -5.055
  756    HA   GLU 100           HA       GLU 100  18.680   2.331  -5.975
  757    HB2  GLU 100          2HB       GLU 100  17.114   2.072  -7.881
  758    HB3  GLU 100          1HB       GLU 100  15.758   2.154  -6.775
  759    HG2  GLU 100          2HG       GLU 100  16.038   4.242  -7.882
  760    HG3  GLU 100          1HG       GLU 100  16.389   4.425  -6.168
  761    H    ILE 101           H        ILE 101  15.375   1.732  -4.877
  762    HA   ILE 101           HA       ILE 101  16.118   2.370  -2.144
  763    HB   ILE 101           HB       ILE 101  13.812   3.691  -2.078
  764   HG12  ILE 101          2HG1      ILE 101  14.829   4.286  -4.868
  765   HG13  ILE 101          1HG1      ILE 101  13.323   3.482  -4.475
  766   HG21  ILE 101          1HG2      ILE 101  15.904   4.566  -1.272
  767   HG22  ILE 101          2HG2      ILE 101  15.084   5.793  -2.237
  768   HG23  ILE 101          3HG2      ILE 101  16.440   4.894  -2.920
  769   HD11  ILE 101          1HD1      ILE 101  12.602   5.516  -3.299
  770   HD12  ILE 101          2HD1      ILE 101  12.815   5.681  -5.036
  771   HD13  ILE 101          3HD1      ILE 101  14.034   6.323  -3.936
  772    H    ASP 102           H        ASP 102  13.116   2.035  -3.934
  773    HA   ASP 102           HA       ASP 102  12.510  -0.565  -3.887
  774    HB2  ASP 102          2HB       ASP 102  12.727  -0.587  -1.391
  775    HB3  ASP 102          1HB       ASP 102  11.434   0.590  -1.299
  776    H    ALA 103           H        ALA 103  11.381   2.591  -2.982
  777    HA   ALA 103           HA       ALA 103   8.802   2.573  -3.989
  778    HB1  ALA 103          1HB       ALA 103  10.834   4.804  -4.101
  779    HB2  ALA 103          2HB       ALA 103   9.753   4.459  -2.750
  780    HB3  ALA 103          3HB       ALA 103   9.090   4.995  -4.305
  781    H    LEU 104           H        LEU 104   8.011   2.312  -5.951
  782    HA   LEU 104           HA       LEU 104   7.837   1.842  -8.125
  783    HB2  LEU 104          2HB       LEU 104   9.904   3.570  -9.173
  784    HB3  LEU 104          1HB       LEU 104   8.171   3.618  -9.380
  785    HG   LEU 104           HG       LEU 104   9.628   4.848  -7.040
  786   HD11  LEU 104          1HD1      LEU 104  10.195   5.992  -9.102
  787   HD12  LEU 104          2HD1      LEU 104   9.121   6.989  -8.121
  788   HD13  LEU 104          3HD1      LEU 104   8.486   6.125  -9.521
  789   HD21  LEU 104          1HD2      LEU 104   7.299   4.206  -6.554
  790   HD22  LEU 104          2HD2      LEU 104   6.760   5.156  -7.941
  791   HD23  LEU 104          3HD2      LEU 104   7.521   5.955  -6.563
  792    H    GLU 105           H        GLU 105  10.049   0.639  -6.432
  793    HA   GLU 105           HA       GLU 105  11.569  -0.997  -6.575
  794    HB2  GLU 105          2HB       GLU 105  10.569  -1.222  -9.416
  795    HB3  GLU 105          1HB       GLU 105  11.658  -2.370  -8.656
  796    HG2  GLU 105          2HG       GLU 105   9.535  -3.343  -8.512
  797    HG3  GLU 105          1HG       GLU 105   9.858  -2.706  -6.902
  798    H    LEU 106           H        LEU 106  12.038  -0.111  -9.934
  799    HA   LEU 106           HA       LEU 106  14.381   1.477  -9.430
  800    HB2  LEU 106          2HB       LEU 106  15.381  -0.704  -9.140
  801    HB3  LEU 106          1HB       LEU 106  14.618  -1.300 -10.598
  802    HG   LEU 106           HG       LEU 106  16.010   0.282 -11.924
  803   HD11  LEU 106          1HD1      LEU 106  17.922   1.347 -10.887
  804   HD12  LEU 106          2HD1      LEU 106  17.431   0.738  -9.309
  805   HD13  LEU 106          3HD1      LEU 106  16.426   1.921 -10.147
  806   HD21  LEU 106          1HD2      LEU 106  17.521  -1.645 -10.166
  807   HD22  LEU 106          2HD2      LEU 106  18.084  -0.994 -11.703
  808   HD23  LEU 106          3HD2      LEU 106  16.669  -2.045 -11.656
  809    H    LYS 107           H        LYS 107  12.876  -0.619 -11.854
  810    HA   LYS 107           HA       LYS 107  13.146   1.368 -13.932
  811    HB2  LYS 107          2HB       LYS 107  11.694  -1.289 -13.861
  812    HB3  LYS 107          1HB       LYS 107  11.877  -0.286 -15.294
  813    HG2  LYS 107          2HG       LYS 107  14.266  -0.594 -15.262
  814    HG3  LYS 107          1HG       LYS 107  14.163  -1.477 -13.738
  815    HD2  LYS 107          2HD       LYS 107  12.937  -3.258 -14.795
  816    HD3  LYS 107          1HD       LYS 107  12.837  -2.350 -16.302
  817    HE2  LYS 107          2HE       LYS 107  14.556  -4.071 -16.432
  818    HE3  LYS 107          1HE       LYS 107  15.265  -2.463 -16.537
  819    HZ1  LYS 107          1HZ       LYS 107  16.537  -3.924 -15.091
  820    HZ2  LYS 107          2HZ       LYS 107  15.193  -4.148 -14.095
  821    HZ3  LYS 107          3HZ       LYS 107  15.904  -2.620 -14.224
  822    H    THR 108           H        THR 108  11.772   3.025 -14.103
  823    HA   THR 108           HA       THR 108   9.408   3.265 -12.578
  824    HB   THR 108           HB       THR 108   8.958   5.214 -14.194
  825    HG1  THR 108          1HG       THR 108  10.581   5.715 -15.615
  826   HG21  THR 108          1HG2      THR 108   9.985   5.503 -11.986
  827   HG22  THR 108          2HG2      THR 108  10.710   6.590 -13.171
  828   HG23  THR 108          3HG2      THR 108  11.567   5.133 -12.671
  829    H    GLN 109           H        GLN 109  10.077   2.078 -15.769
  830    HA   GLN 109           HA       GLN 109   7.388   0.997 -15.951
  831    HB2  GLN 109          2HB       GLN 109   7.076   1.821 -18.255
  832    HB3  GLN 109          1HB       GLN 109   7.172   3.145 -17.103
  833    HG2  GLN 109          2HG       GLN 109   9.549   3.449 -17.725
  834    HG3  GLN 109          1HG       GLN 109   9.344   2.209 -18.959
  835   HE21  GLN 109          1HE2      GLN 109   6.609   3.098 -19.564
  836   HE22  GLN 109          2HE2      GLN 109   6.787   4.550 -20.487
  837    H    LYS 110           H        LYS 110   7.287  -0.526 -17.887
  838    HA   LYS 110           HA       LYS 110   9.820  -1.996 -17.998
  839    HB2  LYS 110          2HB       LYS 110   7.068  -2.860 -18.898
  840    HB3  LYS 110          1HB       LYS 110   8.488  -3.884 -18.756
  841    HG2  LYS 110          2HG       LYS 110   8.489  -3.545 -16.333
  842    HG3  LYS 110          1HG       LYS 110   7.058  -2.524 -16.481
  843    HD2  LYS 110          2HD       LYS 110   7.244  -5.434 -17.255
  844    HD3  LYS 110          1HD       LYS 110   6.466  -4.800 -15.806
  845    HE2  LYS 110          2HE       LYS 110   4.867  -3.580 -17.188
  846    HE3  LYS 110          1HE       LYS 110   5.654  -4.179 -18.649
  847    HZ1  LYS 110          1HZ       LYS 110   3.646  -5.429 -18.046
  848    HZ2  LYS 110          2HZ       LYS 110   4.376  -5.900 -16.594
  849    HZ3  LYS 110          3HZ       LYS 110   5.025  -6.407 -18.070
  850    H    GLY 111           H        GLY 111   9.505   0.404 -19.552
  851    HA2  GLY 111          2HA       GLY 111  10.115   1.081 -21.679
  852    HA3  GLY 111          1HA       GLY 111  10.173  -0.608 -22.158
  853    H    PHE 112           H        PHE 112   7.289  -0.527 -20.865
  854    HA   PHE 112           HA       PHE 112   5.911   0.535 -23.226
  855    HB2  PHE 112          2HB       PHE 112   6.146  -1.928 -23.440
  856    HB3  PHE 112          1HB       PHE 112   5.337  -2.127 -21.887
  857    HD1  PHE 112          1HD       PHE 112   4.879  -0.923 -25.353
  858    HD2  PHE 112          2HD       PHE 112   2.988  -2.144 -21.743
  859    HE1  PHE 112          1HE       PHE 112   2.708  -0.963 -26.507
  860    HE2  PHE 112          2HE       PHE 112   0.812  -2.185 -22.891
  861    HZ   PHE 112           HZ       PHE 112   0.670  -1.596 -25.279
  Start of MODEL   10
    1    H1   GLY   1          1HT       GLY   1   6.464  19.927  -6.448
    2    H2   GLY   1          2HT       GLY   1   5.602  18.583  -6.998
    3    H    GLY   1           H        GLY   1   4.945  18.839  -6.405
    4    H3   GLY   1          3HT       GLY   1   4.864  19.687  -5.954
    5    HA2  GLY   1          1HA       GLY   1   4.964  21.406  -7.629
    6    HA3  GLY   1          2HA       GLY   1   5.769  20.281  -8.713
    7    H    SER   2           H        SER   2   3.395  21.585  -9.403
    8    HA   SER   2           HA       SER   2   1.632  19.256  -9.673
    9    HB2  SER   2          2HB       SER   2   0.663  22.053  -9.037
   10    HB3  SER   2          1HB       SER   2  -0.351  20.634  -9.293
   11    HG   SER   2           HG       SER   2   1.159  19.796  -7.467
   12    H    ALA   3           H        ALA   3   3.570  21.184 -11.258
   13    HA   ALA   3           HA       ALA   3   1.857  22.051 -13.415
   14    HB1  ALA   3          1HB       ALA   3   4.870  21.984 -13.238
   15    HB2  ALA   3          2HB       ALA   3   3.846  23.352 -12.806
   16    HB3  ALA   3          3HB       ALA   3   3.921  22.800 -14.478
   17    H    MET   4           H        MET   4   0.898  20.225 -14.238
   18    HA   MET   4           HA       MET   4   0.627  18.267 -15.345
   19    HB2  MET   4          2HB       MET   4   2.033  19.328 -17.082
   20    HB3  MET   4          1HB       MET   4   3.474  18.721 -16.279
   21    HG2  MET   4          2HG       MET   4   2.720  16.425 -16.684
   22    HG3  MET   4          1HG       MET   4   1.299  17.049 -17.519
   23    HE1  MET   4          1HE       MET   4   1.378  18.356 -19.798
   24    HE2  MET   4          2HE       MET   4   2.858  18.732 -20.678
   25    HE3  MET   4          3HE       MET   4   2.521  19.530 -19.143
   26    H    GLY   5           H        GLY   5   0.588  17.491 -13.102
   27    HA2  GLY   5          2HA       GLY   5   1.916  15.089 -12.756
   28    HA3  GLY   5          1HA       GLY   5   2.868  16.300 -11.909
   29    H    HIS   6           H        HIS   6   1.512  14.100 -10.708
   30    HA   HIS   6           HA       HIS   6  -0.460  15.560  -9.092
   31    HB2  HIS   6          2HB       HIS   6  -1.657  13.340  -8.802
   32    HB3  HIS   6          1HB       HIS   6  -1.792  14.087 -10.387
   33    HD1  HIS   6          1HD       HIS   6  -0.445  12.952 -12.343
   34    HD2  HIS   6          2HD       HIS   6  -0.476  10.836  -8.764
   35    HE1  HIS   6          1HE       HIS   6   0.320  10.629 -12.923
   36    HE2  HIS   6          2HE       HIS   6   0.061   9.320 -10.788
   37    H    MET   7           H        MET   7   1.835  15.827  -8.128
   38    HA   MET   7           HA       MET   7   2.797  13.692  -6.484
   39    HB2  MET   7          2HB       MET   7   4.275  15.484  -7.287
   40    HB3  MET   7          1HB       MET   7   3.338  16.669  -6.390
   41    HG2  MET   7          2HG       MET   7   5.438  16.073  -5.278
   42    HG3  MET   7          1HG       MET   7   4.018  15.704  -4.299
   43    HE1  MET   7          1HE       MET   7   6.859  14.255  -6.579
   44    HE2  MET   7          2HE       MET   7   5.405  13.677  -7.392
   45    HE3  MET   7          3HE       MET   7   6.475  12.533  -6.586
   46    H    VAL   8           H        VAL   8   2.672  13.580  -4.142
   47    HA   VAL   8           HA       VAL   8   0.708  15.275  -2.858
   48    HB   VAL   8           HB       VAL   8  -0.528  13.342  -3.978
   49   HG11  VAL   8          1HG1      VAL   8   0.793  11.717  -1.822
   50   HG12  VAL   8          2HG1      VAL   8   1.016  11.546  -3.563
   51   HG13  VAL   8          3HG1      VAL   8  -0.550  11.182  -2.835
   52   HG21  VAL   8          1HG2      VAL   8  -1.994  12.924  -2.026
   53   HG22  VAL   8          2HG2      VAL   8  -1.624  14.626  -2.296
   54   HG23  VAL   8          3HG2      VAL   8  -0.813  13.742  -1.009
   55    H    LYS   9           H        LYS   9   0.601  13.290  -0.599
   56    HA   LYS   9           HA       LYS   9   3.080  14.020   0.616
   57    HB2  LYS   9          2HB       LYS   9   0.914  12.132   1.590
   58    HB3  LYS   9          1HB       LYS   9   2.250  12.751   2.560
   59    HG2  LYS   9          2HG       LYS   9   0.007  14.336   1.348
   60    HG3  LYS   9          1HG       LYS   9   0.240  13.971   3.055
   61    HD2  LYS   9          2HD       LYS   9   2.323  15.282   3.028
   62    HD3  LYS   9          1HD       LYS   9   2.041  15.671   1.329
   63    HE2  LYS   9          2HE       LYS   9  -0.107  16.720   1.978
   64    HE3  LYS   9          1HE       LYS   9   0.290  16.419   3.669
   65    HZ1  LYS   9          1HZ       LYS   9   2.339  17.771   3.275
   66    HZ2  LYS   9          2HZ       LYS   9   0.890  18.637   3.190
   67    HZ3  LYS   9          3HZ       LYS   9   1.702  18.208   1.770
   68    H    ILE  10           H        ILE  10   3.701  12.576  -1.694
   69    HA   ILE  10           HA       ILE  10   4.820  10.131  -0.516
   70    HB   ILE  10           HB       ILE  10   3.875  10.471  -3.366
   71   HG12  ILE  10          2HG1      ILE  10   2.908   8.631  -1.167
   72   HG13  ILE  10          1HG1      ILE  10   2.059  10.059  -1.749
   73   HG21  ILE  10          1HG2      ILE  10   5.954   9.164  -3.220
   74   HG22  ILE  10          2HG2      ILE  10   4.585   8.166  -3.709
   75   HG23  ILE  10          3HG2      ILE  10   5.184   8.087  -2.053
   76   HD11  ILE  10          1HD1      ILE  10   2.698   7.627  -3.401
   77   HD12  ILE  10          2HD1      ILE  10   1.773   9.036  -3.923
   78   HD13  ILE  10          3HD1      ILE  10   1.142   7.983  -2.656
   79    H    SER  11           H        SER  11   6.823  10.950  -0.081
   80    HA   SER  11           HA       SER  11   8.394  11.847  -2.380
   81    HB2  SER  11          2HB       SER  11   9.147  11.569   0.547
   82    HB3  SER  11          1HB       SER  11  10.172  12.257  -0.716
   83    HG   SER  11           HG       SER  11   7.929  13.551  -0.917
   84    H    HIS  12           H        HIS  12  10.796  10.669  -2.070
   85    HA   HIS  12           HA       HIS  12  10.468   8.098  -3.085
   86    HB2  HIS  12          2HB       HIS  12  12.827   9.140  -1.512
   87    HB3  HIS  12          1HB       HIS  12  12.842   7.728  -2.565
   88    HD1  HIS  12          1HD       HIS  12  14.700  10.229  -2.971
   89    HD2  HIS  12          2HD       HIS  12  11.147   9.493  -5.002
   90    HE1  HIS  12          1HE       HIS  12  14.869  11.520  -5.126
   91    HE2  HIS  12          2HE       HIS  12  12.776  10.933  -6.399
   92    H    GLU  13           H        GLU  13  11.078   9.212   0.175
   93    HA   GLU  13           HA       GLU  13  11.339   6.668   1.343
   94    HB2  GLU  13          2HB       GLU  13  11.187   7.815   3.466
   95    HB3  GLU  13          1HB       GLU  13  12.176   8.756   2.347
   96    HG2  GLU  13          2HG       GLU  13  10.270  10.230   1.913
   97    HG3  GLU  13          1HG       GLU  13   9.301   9.302   3.055
   98    H    ASP  14           H        ASP  14   8.488   8.715   0.712
   99    HA   ASP  14           HA       ASP  14   6.858   7.303   2.567
  100    HB2  ASP  14          2HB       ASP  14   6.084   9.081   0.266
  101    HB3  ASP  14          1HB       ASP  14   4.976   8.463   1.490
  102    H    THR  15           H        THR  15   7.278   7.084  -0.965
  103    HA   THR  15           HA       THR  15   5.331   5.073  -1.329
  104    HB   THR  15           HB       THR  15   7.399   4.625  -3.185
  105    HG1  THR  15          1HG       THR  15   6.889   7.324  -3.421
  106   HG21  THR  15          1HG2      THR  15   4.823   6.172  -3.376
  107   HG22  THR  15          2HG2      THR  15   5.059   4.450  -3.692
  108   HG23  THR  15          3HG2      THR  15   5.793   5.653  -4.755
  109    H    GLN  16           H        GLN  16   8.803   4.927  -0.610
  110    HA   GLN  16           HA       GLN  16   9.107   2.144  -0.557
  111    HB2  GLN  16          2HB       GLN  16  10.430   4.294   1.104
  112    HB3  GLN  16          1HB       GLN  16  10.907   2.604   1.170
  113    HG2  GLN  16          2HG       GLN  16  11.477   2.691  -1.214
  114    HG3  GLN  16          1HG       GLN  16  11.019   4.389  -1.240
  115   HE21  GLN  16          1HE2      GLN  16  12.345   5.912  -0.355
  116   HE22  GLN  16          2HE2      GLN  16  13.967   5.575   0.140
  117    H    ARG  17           H        ARG  17   7.927   4.416   1.843
  118    HA   ARG  17           HA       ARG  17   7.657   2.678   4.023
  119    HB2  ARG  17          2HB       ARG  17   6.402   5.271   3.222
  120    HB3  ARG  17          1HB       ARG  17   5.727   4.392   4.582
  121    HG2  ARG  17          2HG       ARG  17   7.422   4.935   5.934
  122    HG3  ARG  17          1HG       ARG  17   8.631   4.722   4.670
  123    HD2  ARG  17          2HD       ARG  17   8.298   6.874   3.820
  124    HD3  ARG  17          1HD       ARG  17   6.777   7.081   4.703
  125    HE   ARG  17           HE       ARG  17   9.061   6.698   6.409
  126   HH11  ARG  17          1HH1      ARG  17   7.182   9.104   4.668
  127   HH12  ARG  17          2HH1      ARG  17   7.717  10.407   5.682
  128   HH21  ARG  17          1HH2      ARG  17   9.732   8.420   7.731
  129   HH22  ARG  17          2HH2      ARG  17   9.161  10.028   7.402
  130    H    ILE  18           H        ILE  18   5.243   3.688   1.582
  131    HA   ILE  18           HA       ILE  18   3.105   2.343   2.763
  132    HB   ILE  18           HB       ILE  18   3.464   3.073  -0.138
  133   HG12  ILE  18          2HG1      ILE  18   1.567   4.595   1.445
  134   HG13  ILE  18          1HG1      ILE  18   3.187   4.680   2.130
  135   HG21  ILE  18          1HG2      ILE  18   0.967   2.935  -0.172
  136   HG22  ILE  18          2HG2      ILE  18   1.046   2.180   1.425
  137   HG23  ILE  18          3HG2      ILE  18   1.785   1.385   0.033
  138   HD11  ILE  18          1HD1      ILE  18   4.066   5.484   0.056
  139   HD12  ILE  18          2HD1      ILE  18   2.710   6.495   0.554
  140   HD13  ILE  18          3HD1      ILE  18   2.497   5.301  -0.727
  141    H    LYS  19           H        LYS  19   5.202   1.233   0.065
  142    HA   LYS  19           HA       LYS  19   3.778  -1.174  -0.349
  143    HB2  LYS  19          2HB       LYS  19   6.749  -0.917  -0.719
  144    HB3  LYS  19          1HB       LYS  19   5.623  -1.937  -1.603
  145    HG2  LYS  19          2HG       LYS  19   4.599   0.066  -2.607
  146    HG3  LYS  19          1HG       LYS  19   5.806   1.061  -1.790
  147    HD2  LYS  19          2HD       LYS  19   6.493   0.661  -4.072
  148    HD3  LYS  19          1HD       LYS  19   7.584  -0.184  -2.972
  149    HE2  LYS  19          2HE       LYS  19   6.211  -2.249  -3.362
  150    HE3  LYS  19          1HE       LYS  19   5.347  -1.353  -4.611
  151    HZ1  LYS  19          1HZ       LYS  19   8.255  -1.943  -4.565
  152    HZ2  LYS  19          2HZ       LYS  19   7.465  -1.015  -5.747
  153    HZ3  LYS  19          3HZ       LYS  19   7.099  -2.659  -5.580
  154    H    THR  20           H        THR  20   6.637  -0.394   1.554
  155    HA   THR  20           HA       THR  20   7.315  -3.030   2.039
  156    HB   THR  20           HB       THR  20   8.883  -1.097   2.223
  157    HG1  THR  20          1HG       THR  20   9.704  -2.939   3.058
  158   HG21  THR  20          1HG2      THR  20   9.014   0.094   4.373
  159   HG22  THR  20          2HG2      THR  20   7.547  -0.724   4.907
  160   HG23  THR  20          3HG2      THR  20   7.480   0.405   3.556
  161    H    ALA  21           H        ALA  21   5.341  -0.777   3.888
  162    HA   ALA  21           HA       ALA  21   5.207  -2.477   6.161
  163    HB1  ALA  21          1HB       ALA  21   3.403  -0.198   5.358
  164    HB2  ALA  21          2HB       ALA  21   4.862  -0.063   6.342
  165    HB3  ALA  21          3HB       ALA  21   3.466  -0.953   6.953
  166    H    PHE  22           H        PHE  22   2.820  -1.557   3.723
  167    HA   PHE  22           HA       PHE  22   0.702  -3.144   4.278
  168    HB2  PHE  22          2HB       PHE  22   0.316  -1.828   2.514
  169    HB3  PHE  22          1HB       PHE  22   1.964  -1.917   1.940
  170    HD1  PHE  22          1HD       PHE  22  -1.237  -3.750   1.952
  171    HD2  PHE  22          2HD       PHE  22   2.459  -3.064   0.016
  172    HE1  PHE  22          1HE       PHE  22  -2.069  -4.987  -0.039
  173    HE2  PHE  22          2HE       PHE  22   1.685  -4.325  -1.938
  174    HZ   PHE  22           HZ       PHE  22  -0.581  -5.282  -1.974
  175    H    LEU  23           H        LEU  23   3.395  -4.274   2.173
  176    HA   LEU  23           HA       LEU  23   2.410  -6.890   1.859
  177    HB2  LEU  23          2HB       LEU  23   5.286  -5.993   1.815
  178    HB3  LEU  23          1HB       LEU  23   4.622  -7.418   1.037
  179    HG   LEU  23           HG       LEU  23   3.635  -4.684   0.307
  180   HD11  LEU  23          1HD1      LEU  23   5.305  -4.644  -1.488
  181   HD12  LEU  23          2HD1      LEU  23   6.043  -6.107  -0.831
  182   HD13  LEU  23          3HD1      LEU  23   6.061  -4.611   0.107
  183   HD21  LEU  23          1HD2      LEU  23   3.250  -5.864  -1.860
  184   HD22  LEU  23          2HD2      LEU  23   2.309  -6.485  -0.502
  185   HD23  LEU  23          3HD2      LEU  23   3.738  -7.363  -1.063
  186    H    SER  24           H        SER  24   5.071  -5.746   3.943
  187    HA   SER  24           HA       SER  24   5.672  -8.234   5.093
  188    HB2  SER  24          2HB       SER  24   6.210  -5.586   6.374
  189    HB3  SER  24          1HB       SER  24   7.098  -7.102   6.516
  190    HG   SER  24           HG       SER  24   7.137  -5.208   4.481
  191    H    TYR  25           H        TYR  25   3.316  -5.857   5.876
  192    HA   TYR  25           HA       TYR  25   2.999  -6.606   8.592
  193    HB2  TYR  25          2HB       TYR  25   1.545  -4.788   6.699
  194    HB3  TYR  25          1HB       TYR  25   0.722  -5.319   8.183
  195    HD1  TYR  25          1HD       TYR  25   4.322  -4.550   7.603
  196    HD2  TYR  25          2HD       TYR  25   0.750  -3.495   9.653
  197    HE1  TYR  25          1HE       TYR  25   5.584  -2.927   8.930
  198    HE2  TYR  25          2HE       TYR  25   2.004  -1.862  10.997
  199    HH   TYR  25           HH       TYR  25   5.198  -0.918  10.256
  200    H    ALA  26           H        ALA  26   1.128  -7.349   5.637
  201    HA   ALA  26           HA       ALA  26  -0.734  -8.904   7.155
  202    HB1  ALA  26          1HB       ALA  26  -0.246  -9.117   4.209
  203    HB2  ALA  26          2HB       ALA  26  -1.155  -7.804   4.950
  204    HB3  ALA  26          3HB       ALA  26  -1.728  -9.466   5.103
  205    H    GLN  27           H        GLN  27   1.408 -10.071   4.532
  206    HA   GLN  27           HA       GLN  27   1.772 -12.504   6.150
  207    HB2  GLN  27          2HB       GLN  27   2.152 -12.721   3.223
  208    HB3  GLN  27          1HB       GLN  27   1.517 -13.901   4.365
  209    HG2  GLN  27          2HG       GLN  27  -0.327 -13.429   3.071
  210    HG3  GLN  27          1HG       GLN  27  -0.573 -12.313   4.423
  211   HE21  GLN  27          1HE2      GLN  27  -1.506 -12.133   1.646
  212   HE22  GLN  27          2HE2      GLN  27  -0.870 -10.626   1.060
  213    H    GLY  28           H        GLY  28   3.238 -10.001   4.317
  214    HA2  GLY  28          2HA       GLY  28   5.566  -9.653   4.032
  215    HA3  GLY  28          1HA       GLY  28   5.843 -11.344   4.408
  216    H    GLN  29           H        GLN  29   3.359 -11.760   2.515
  217    HA   GLN  29           HA       GLN  29   4.857 -12.311   0.153
  218    HB2  GLN  29          2HB       GLN  29   1.868 -12.247   0.556
  219    HB3  GLN  29          1HB       GLN  29   2.722 -13.036  -0.762
  220    HG2  GLN  29          2HG       GLN  29   3.796 -14.536   0.829
  221    HG3  GLN  29          1HG       GLN  29   2.933 -13.735   2.147
  222   HE21  GLN  29          1HE2      GLN  29   0.491 -13.437   0.563
  223   HE22  GLN  29          2HE2      GLN  29  -0.231 -15.006   0.500
  224    H    ASP  30           H        ASP  30   3.324 -11.677  -1.959
  225    HA   ASP  30           HA       ASP  30   3.983  -8.887  -2.342
  226    HB2  ASP  30          2HB       ASP  30   2.885 -10.959  -4.251
  227    HB3  ASP  30          1HB       ASP  30   3.342  -9.320  -4.708
  228    H    LYS  31           H        LYS  31   1.441 -10.155  -0.913
  229    HA   LYS  31           HA       LYS  31  -0.378  -8.113  -1.929
  230    HB2  LYS  31          2HB       LYS  31  -1.077 -11.028  -1.529
  231    HB3  LYS  31          1HB       LYS  31  -2.274  -9.752  -1.693
  232    HG2  LYS  31          2HG       LYS  31  -0.859  -9.291  -3.903
  233    HG3  LYS  31          1HG       LYS  31  -0.556 -11.014  -3.735
  234    HD2  LYS  31          2HD       LYS  31  -3.262  -9.673  -3.807
  235    HD3  LYS  31          1HD       LYS  31  -2.535 -10.613  -5.106
  236    HE2  LYS  31          2HE       LYS  31  -2.999 -11.778  -2.393
  237    HE3  LYS  31          1HE       LYS  31  -4.284 -11.689  -3.591
  238    HZ1  LYS  31          1HZ       LYS  31  -2.875 -12.955  -5.113
  239    HZ2  LYS  31          2HZ       LYS  31  -3.171 -13.816  -3.689
  240    HZ3  LYS  31          3HZ       LYS  31  -1.674 -13.067  -3.928
  241    H    VAL  32           H        VAL  32  -2.450  -8.359  -0.303
  242    HA   VAL  32           HA       VAL  32  -1.418  -8.907   2.379
  243    HB   VAL  32           HB       VAL  32  -2.630  -6.359   1.425
  244   HG11  VAL  32          1HG1      VAL  32  -4.107  -6.948   3.226
  245   HG12  VAL  32          2HG1      VAL  32  -2.980  -5.721   3.798
  246   HG13  VAL  32          3HG1      VAL  32  -2.750  -7.411   4.240
  247   HG21  VAL  32          1HG2      VAL  32  -0.262  -6.501   1.589
  248   HG22  VAL  32          2HG2      VAL  32  -0.373  -7.135   3.231
  249   HG23  VAL  32          3HG2      VAL  32  -0.865  -5.476   2.890
  250    H    THR  33           H        THR  33  -2.755  -9.801   3.767
  251    HA   THR  33           HA       THR  33  -5.190 -10.948   2.933
  252    HB   THR  33           HB       THR  33  -5.426 -11.498   5.398
  253    HG1  THR  33          1HG       THR  33  -3.464 -11.090   6.627
  254   HG21  THR  33          1HG2      THR  33  -2.819 -12.232   4.065
  255   HG22  THR  33          2HG2      THR  33  -4.367 -13.039   3.812
  256   HG23  THR  33          3HG2      THR  33  -3.583 -13.107   5.391
  257    H    GLU  34           H        GLU  34  -7.132 -10.639   4.534
  258    HA   GLU  34           HA       GLU  34  -8.207  -8.131   3.909
  259    HB2  GLU  34          2HB       GLU  34  -9.778  -9.766   4.100
  260    HB3  GLU  34          1HB       GLU  34  -9.105 -10.418   5.593
  261    HG2  GLU  34          2HG       GLU  34 -10.251  -7.694   5.717
  262    HG3  GLU  34          1HG       GLU  34 -11.381  -9.024   5.478
  263    H    ALA  35           H        ALA  35  -6.320  -9.045   6.630
  264    HA   ALA  35           HA       ALA  35  -7.547  -7.447   8.617
  265    HB1  ALA  35          1HB       ALA  35  -6.179  -9.397   9.159
  266    HB2  ALA  35          2HB       ALA  35  -5.561  -7.944   9.947
  267    HB3  ALA  35          3HB       ALA  35  -4.755  -8.577   8.514
  268    H    MET  36           H        MET  36  -4.413  -7.073   6.952
  269    HA   MET  36           HA       MET  36  -4.034  -4.422   7.858
  270    HB2  MET  36          2HB       MET  36  -2.743  -6.176   5.822
  271    HB3  MET  36          1HB       MET  36  -2.358  -4.471   5.845
  272    HG2  MET  36          2HG       MET  36  -2.073  -6.348   8.174
  273    HG3  MET  36          1HG       MET  36  -0.758  -5.817   7.122
  274    HE1  MET  36          1HE       MET  36  -0.921  -1.912   7.775
  275    HE2  MET  36          2HE       MET  36  -1.989  -2.771   6.662
  276    HE3  MET  36          3HE       MET  36  -0.275  -3.184   6.734
  277    H    ILE  37           H        ILE  37  -5.778  -5.871   5.260
  278    HA   ILE  37           HA       ILE  37  -5.870  -3.573   3.572
  279    HB   ILE  37           HB       ILE  37  -7.284  -6.153   3.702
  280   HG12  ILE  37          2HG1      ILE  37  -5.625  -6.478   2.225
  281   HG13  ILE  37          1HG1      ILE  37  -6.530  -5.456   1.148
  282   HG21  ILE  37          1HG2      ILE  37  -8.778  -5.504   1.890
  283   HG22  ILE  37          2HG2      ILE  37  -8.231  -3.833   2.033
  284   HG23  ILE  37          3HG2      ILE  37  -9.111  -4.591   3.361
  285   HD11  ILE  37          1HD1      ILE  37  -5.302  -3.513   1.864
  286   HD12  ILE  37          2HD1      ILE  37  -4.233  -4.766   1.245
  287   HD13  ILE  37          3HD1      ILE  37  -4.376  -4.517   2.982
  288    H    ASP  38           H        ASP  38  -7.798  -4.749   6.271
  289    HA   ASP  38           HA       ASP  38  -9.893  -2.867   6.125
  290    HB2  ASP  38          2HB       ASP  38 -10.305  -4.724   7.427
  291    HB3  ASP  38          1HB       ASP  38  -8.707  -4.700   8.141
  292    H    GLN  39           H        GLN  39  -6.748  -2.932   7.670
  293    HA   GLN  39           HA       GLN  39  -6.960  -0.732   9.337
  294    HB2  GLN  39          2HB       GLN  39  -5.012  -1.956   9.661
  295    HB3  GLN  39          1HB       GLN  39  -4.684  -2.085   7.942
  296    HG2  GLN  39          2HG       GLN  39  -4.486   0.590   9.242
  297    HG3  GLN  39          1HG       GLN  39  -3.209  -0.588   9.501
  298   HE21  GLN  39          1HE2      GLN  39  -3.206   1.992   8.064
  299   HE22  GLN  39          2HE2      GLN  39  -2.630   1.632   6.477
  300    H    LEU  40           H        LEU  40  -5.843  -0.896   5.997
  301    HA   LEU  40           HA       LEU  40  -5.450   1.894   5.761
  302    HB2  LEU  40          2HB       LEU  40  -4.244   0.361   4.365
  303    HB3  LEU  40          1HB       LEU  40  -5.743  -0.268   3.680
  304    HG   LEU  40           HG       LEU  40  -5.781   2.486   3.165
  305   HD11  LEU  40          1HD1      LEU  40  -3.705   3.183   2.700
  306   HD12  LEU  40          2HD1      LEU  40  -3.237   1.627   2.016
  307   HD13  LEU  40          3HD1      LEU  40  -3.208   1.864   3.766
  308   HD21  LEU  40          1HD2      LEU  40  -5.458   1.766   0.833
  309   HD22  LEU  40          2HD2      LEU  40  -6.644   0.771   1.681
  310   HD23  LEU  40          3HD2      LEU  40  -5.012   0.158   1.405
  311    H    ILE  41           H        ILE  41  -8.017  -0.279   4.582
  312    HA   ILE  41           HA       ILE  41  -9.442   1.719   3.219
  313    HB   ILE  41           HB       ILE  41 -10.375  -0.902   4.372
  314   HG12  ILE  41          2HG1      ILE  41  -8.615  -0.683   2.473
  315   HG13  ILE  41          1HG1      ILE  41  -9.943  -1.812   2.262
  316   HG21  ILE  41          1HG2      ILE  41 -12.301   0.559   4.166
  317   HG22  ILE  41          2HG2      ILE  41 -12.343  -0.680   2.913
  318   HG23  ILE  41          3HG2      ILE  41 -11.845   0.962   2.512
  319   HD11  ILE  41          1HD1      ILE  41  -9.390  -0.473   0.258
  320   HD12  ILE  41          2HD1      ILE  41  -9.884   0.975   1.136
  321   HD13  ILE  41          3HD1      ILE  41 -11.056  -0.298   0.795
  322    H    CYS  42           H        CYS  42  -9.773   0.557   6.567
  323    HA   CYS  42           HA       CYS  42 -12.014   2.254   7.129
  324    HB2  CYS  42          2HB       CYS  42 -11.449   0.138   8.380
  325    HB3  CYS  42          1HB       CYS  42 -10.106   1.003   9.115
  326    HG   CYS  42           HG       CYS  42 -13.432   1.686   9.524
  327    H    GLY  43           H        GLY  43  -8.644   2.636   6.929
  328    HA2  GLY  43          2HA       GLY  43  -8.057   4.716   8.655
  329    HA3  GLY  43          1HA       GLY  43  -7.296   4.468   7.092
  330    H    ALA  44           H        ALA  44  -9.207   5.069   5.264
  331    HA   ALA  44           HA       ALA  44  -9.548   7.927   5.776
  332    HB1  ALA  44          1HB       ALA  44  -9.805   8.241   3.450
  333    HB2  ALA  44          2HB       ALA  44 -10.114   6.530   3.176
  334    HB3  ALA  44          3HB       ALA  44  -8.498   7.068   3.640
  335    H    PHE  45           H        PHE  45 -11.547   5.188   4.653
  336    HA   PHE  45           HA       PHE  45 -13.881   6.730   5.549
  337    HB2  PHE  45          2HB       PHE  45 -14.891   4.732   3.966
  338    HB3  PHE  45          1HB       PHE  45 -14.771   6.451   3.578
  339    HD1  PHE  45          1HD       PHE  45 -12.535   3.493   3.627
  340    HD2  PHE  45          2HD       PHE  45 -13.868   6.902   1.481
  341    HE1  PHE  45          1HE       PHE  45 -11.038   2.892   1.763
  342    HE2  PHE  45          2HE       PHE  45 -12.363   6.329  -0.380
  343    HZ   PHE  45           HZ       PHE  45 -10.933   4.320  -0.236
  344    HA   PRO  46           HA       PRO  46 -14.239   3.201   8.174
  345    HB2  PRO  46          2HB       PRO  46 -15.083   4.553  10.330
  346    HB3  PRO  46          1HB       PRO  46 -13.392   4.503   9.846
  347    HG2  PRO  46          2HG       PRO  46 -15.370   6.697   9.552
  348    HG3  PRO  46          1HG       PRO  46 -13.615   6.791   9.769
  349    HD2  PRO  46          2HD       PRO  46 -15.045   7.007   7.314
  350    HD3  PRO  46          1HD       PRO  46 -13.285   6.875   7.519
  351    H    GLY  47           H        GLY  47 -16.089   2.291   9.353
  352    HA2  GLY  47          2HA       GLY  47 -18.364   2.038   9.808
  353    HA3  GLY  47          1HA       GLY  47 -18.692   3.473   8.847
  354    H    LEU  48           H        LEU  48 -16.712   0.887   7.614
  355    HA   LEU  48           HA       LEU  48 -18.777   0.378   5.599
  356    HB2  LEU  48          2HB       LEU  48 -15.879  -0.459   5.624
  357    HB3  LEU  48          1HB       LEU  48 -17.004  -0.720   4.310
  358    HG   LEU  48           HG       LEU  48 -15.724   1.839   5.209
  359   HD11  LEU  48          1HD1      LEU  48 -16.008   0.488   2.530
  360   HD12  LEU  48          2HD1      LEU  48 -14.581   0.441   3.563
  361   HD13  LEU  48          3HD1      LEU  48 -15.110   1.971   2.856
  362   HD21  LEU  48          1HD2      LEU  48 -18.102   2.345   5.001
  363   HD22  LEU  48          2HD2      LEU  48 -18.129   1.600   3.404
  364   HD23  LEU  48          3HD2      LEU  48 -17.187   3.064   3.676
  365    H    SER  49           H        SER  49 -20.013  -1.363   5.786
  366    HA   SER  49           HA       SER  49 -19.311  -3.613   7.410
  367    HB2  SER  49          2HB       SER  49 -21.433  -3.444   5.248
  368    HB3  SER  49          1HB       SER  49 -21.360  -4.603   6.579
  369    HG   SER  49           HG       SER  49 -22.551  -2.255   6.557
  370    H    TRP  50           H        TRP  50 -19.117  -5.885   6.354
  371    HA   TRP  50           HA       TRP  50 -16.832  -5.778   4.746
  372    HB2  TRP  50          2HB       TRP  50 -17.425  -7.716   6.200
  373    HB3  TRP  50          1HB       TRP  50 -18.644  -8.177   5.016
  374    HD1  TRP  50           HD       TRP  50 -14.803  -7.628   5.083
  375    HE1  TRP  50          1HE       TRP  50 -13.784  -9.302   3.409
  376    HE3  TRP  50          3HE       TRP  50 -19.105  -9.709   3.293
  377    HZ2  TRP  50          2HZ       TRP  50 -14.700 -11.227   1.604
  378    HZ3  TRP  50          3HZ       TRP  50 -18.944 -11.466   1.585
  379    HH2  TRP  50           HH       TRP  50 -16.774 -12.218   0.756
  380    H    GLU  51           H        GLU  51 -20.212  -6.151   3.843
  381    HA   GLU  51           HA       GLU  51 -19.867  -6.822   1.144
  382    HB2  GLU  51          2HB       GLU  51 -22.022  -5.059   2.322
  383    HB3  GLU  51          1HB       GLU  51 -22.097  -5.891   0.777
  384    HG2  GLU  51          2HG       GLU  51 -22.014  -7.167   3.490
  385    HG3  GLU  51          1HG       GLU  51 -23.400  -7.060   2.430
  386    H    GLN  52           H        GLN  52 -20.029  -3.667   2.722
  387    HA   GLN  52           HA       GLN  52 -19.791  -2.160   0.319
  388    HB2  GLN  52          2HB       GLN  52 -20.872  -1.238   2.296
  389    HB3  GLN  52          1HB       GLN  52 -19.377  -1.385   3.209
  390    HG2  GLN  52          2HG       GLN  52 -19.768   0.904   2.517
  391    HG3  GLN  52          1HG       GLN  52 -18.315   0.250   1.762
  392   HE21  GLN  52          1HE2      GLN  52 -18.298   1.596   0.047
  393   HE22  GLN  52          2HE2      GLN  52 -19.492   1.594  -1.197
  394    H    LEU  53           H        LEU  53 -17.544  -3.433   2.663
  395    HA   LEU  53           HA       LEU  53 -15.360  -1.842   1.710
  396    HB2  LEU  53          2HB       LEU  53 -15.465  -2.561   4.038
  397    HB3  LEU  53          1HB       LEU  53 -15.406  -4.235   3.545
  398    HG   LEU  53           HG       LEU  53 -13.144  -2.467   2.750
  399   HD11  LEU  53          1HD1      LEU  53 -12.044  -2.863   4.903
  400   HD12  LEU  53          2HD1      LEU  53 -13.512  -3.624   5.516
  401   HD13  LEU  53          3HD1      LEU  53 -13.515  -1.910   5.102
  402   HD21  LEU  53          1HD2      LEU  53 -13.238  -4.804   2.005
  403   HD22  LEU  53          2HD2      LEU  53 -13.302  -5.333   3.686
  404   HD23  LEU  53          3HD2      LEU  53 -11.864  -4.516   3.074
  405    H    GLN  54           H        GLN  54 -16.591  -5.101   1.176
  406    HA   GLN  54           HA       GLN  54 -14.367  -6.060  -0.269
  407    HB2  GLN  54          2HB       GLN  54 -15.669  -7.906  -0.869
  408    HB3  GLN  54          1HB       GLN  54 -16.252  -7.430   0.701
  409    HG2  GLN  54          2HG       GLN  54 -18.240  -6.563  -0.156
  410    HG3  GLN  54          1HG       GLN  54 -17.608  -6.516  -1.801
  411   HE21  GLN  54          1HE2      GLN  54 -18.957  -8.543   0.699
  412   HE22  GLN  54          2HE2      GLN  54 -19.272  -9.902  -0.316
  413    H    GLU  55           H        GLU  55 -17.223  -4.224  -1.207
  414    HA   GLU  55           HA       GLU  55 -16.639  -4.346  -3.998
  415    HB2  GLU  55          2HB       GLU  55 -18.396  -2.731  -4.310
  416    HB3  GLU  55          1HB       GLU  55 -18.924  -3.945  -3.160
  417    HG2  GLU  55          2HG       GLU  55 -19.649  -2.147  -2.043
  418    HG3  GLU  55          1HG       GLU  55 -18.014  -2.101  -1.454
  419    H    LYS  56           H        LYS  56 -15.676  -2.305  -1.362
  420    HA   LYS  56           HA       LYS  56 -14.659  -0.072  -2.632
  421    HB2  LYS  56          2HB       LYS  56 -14.608  -0.865  -0.096
  422    HB3  LYS  56          1HB       LYS  56 -12.982  -1.397  -0.535
  423    HG2  LYS  56          2HG       LYS  56 -12.440   0.689   0.129
  424    HG3  LYS  56          1HG       LYS  56 -12.930   1.114  -1.508
  425    HD2  LYS  56          2HD       LYS  56 -14.760   1.183   0.890
  426    HD3  LYS  56          1HD       LYS  56 -13.889   2.585   0.269
  427    HE2  LYS  56          2HE       LYS  56 -15.821   0.946  -1.357
  428    HE3  LYS  56          1HE       LYS  56 -16.273   2.389  -0.454
  429    HZ1  LYS  56          1HZ       LYS  56 -15.799   2.807  -2.827
  430    HZ2  LYS  56          2HZ       LYS  56 -14.197   2.333  -2.578
  431    HZ3  LYS  56          3HZ       LYS  56 -14.805   3.702  -1.793
  432    H    LYS  57           H        LYS  57 -12.956  -3.119  -1.978
  433    HA   LYS  57           HA       LYS  57 -10.803  -2.231  -3.746
  434    HB2  LYS  57          2HB       LYS  57 -10.045  -4.565  -2.384
  435    HB3  LYS  57          1HB       LYS  57  -9.448  -2.936  -2.134
  436    HG2  LYS  57          2HG       LYS  57 -10.150  -3.552  -0.036
  437    HG3  LYS  57          1HG       LYS  57 -11.554  -2.679  -0.646
  438    HD2  LYS  57          2HD       LYS  57 -12.626  -4.524   0.077
  439    HD3  LYS  57          1HD       LYS  57 -12.174  -5.113  -1.520
  440    HE2  LYS  57          2HE       LYS  57 -10.100  -6.107  -0.439
  441    HE3  LYS  57          1HE       LYS  57 -10.829  -5.695   1.106
  442    HZ1  LYS  57          1HZ       LYS  57 -11.364  -7.963   0.541
  443    HZ2  LYS  57          2HZ       LYS  57 -12.019  -7.487  -0.948
  444    HZ3  LYS  57          3HZ       LYS  57 -12.775  -7.031   0.494
  445    H    LYS  58           H        LYS  58 -13.458  -3.690  -4.368
  446    HA   LYS  58           HA       LYS  58 -12.992  -6.290  -5.229
  447    HB2  LYS  58          2HB       LYS  58 -14.936  -6.071  -6.614
  448    HB3  LYS  58          1HB       LYS  58 -15.218  -5.166  -5.135
  449    HG2  LYS  58          2HG       LYS  58 -14.747  -3.086  -6.279
  450    HG3  LYS  58          1HG       LYS  58 -14.355  -3.964  -7.758
  451    HD2  LYS  58          2HD       LYS  58 -16.655  -4.813  -7.853
  452    HD3  LYS  58          1HD       LYS  58 -17.040  -3.919  -6.382
  453    HE2  LYS  58          2HE       LYS  58 -16.139  -2.713  -8.994
  454    HE3  LYS  58          1HE       LYS  58 -17.793  -2.732  -8.387
  455    HZ1  LYS  58          1HZ       LYS  58 -17.046  -1.422  -6.482
  456    HZ2  LYS  58          2HZ       LYS  58 -16.755  -0.619  -7.938
  457    HZ3  LYS  58          3HZ       LYS  58 -15.481  -1.367  -7.121
  458    H    GLY  59           H        GLY  59 -13.096  -6.980  -7.588
  459    HA2  GLY  59          2HA       GLY  59 -12.260  -6.899  -9.768
  460    HA3  GLY  59          1HA       GLY  59 -11.568  -5.319  -9.424
  461    H    ARG  60           H        ARG  60  -9.918  -5.560  -7.472
  462    HA   ARG  60           HA       ARG  60  -7.945  -7.393  -8.620
  463    HB2  ARG  60          2HB       ARG  60  -7.637  -4.873  -8.726
  464    HB3  ARG  60          1HB       ARG  60  -7.354  -4.939  -6.992
  465    HG2  ARG  60          2HG       ARG  60  -5.290  -4.934  -8.338
  466    HG3  ARG  60          1HG       ARG  60  -5.451  -6.348  -7.293
  467    HD2  ARG  60          2HD       ARG  60  -6.094  -7.723  -9.119
  468    HD3  ARG  60          1HD       ARG  60  -6.253  -6.326 -10.192
  469    HE   ARG  60           HE       ARG  60  -3.618  -6.702  -9.045
  470   HH11  ARG  60          1HH1      ARG  60  -5.723  -7.445 -11.753
  471   HH12  ARG  60          2HH1      ARG  60  -4.412  -7.763 -12.841
  472   HH21  ARG  60          1HH2      ARG  60  -1.897  -7.149 -10.476
  473   HH22  ARG  60          2HH2      ARG  60  -2.239  -7.604 -12.114
  474    H    ALA  61           H        ALA  61  -9.148  -6.141  -5.510
  475    HA   ALA  61           HA       ALA  61  -7.531  -8.112  -4.098
  476    HB1  ALA  61          1HB       ALA  61  -8.049  -5.743  -3.227
  477    HB2  ALA  61          2HB       ALA  61  -8.150  -7.092  -2.099
  478    HB3  ALA  61          3HB       ALA  61  -9.620  -6.409  -2.795
  479    H    ALA  62           H        ALA  62 -10.701  -7.585  -5.280
  480    HA   ALA  62           HA       ALA  62 -12.622  -8.800  -5.286
  481    HB1  ALA  62          1HB       ALA  62 -12.381 -11.184  -5.510
  482    HB2  ALA  62          2HB       ALA  62 -10.781 -11.131  -4.768
  483    HB3  ALA  62          3HB       ALA  62 -11.041 -10.400  -6.353
  484    H    ALA  63           H        ALA  63 -12.705 -11.426  -3.615
  485    HA   ALA  63           HA       ALA  63 -13.652 -10.211  -1.188
  486    HB1  ALA  63          1HB       ALA  63 -14.171 -12.461  -0.456
  487    HB2  ALA  63          2HB       ALA  63 -13.289 -13.130  -1.831
  488    HB3  ALA  63          3HB       ALA  63 -14.757 -12.188  -2.098
  489    H    ASN  64           H        ASN  64 -11.175  -9.419  -1.430
  490    HA   ASN  64           HA       ASN  64  -9.709  -8.821   0.204
  491    HB2  ASN  64          2HB       ASN  64 -10.356 -11.461   1.496
  492    HB3  ASN  64          1HB       ASN  64  -9.170 -10.315   2.121
  493   HD21  ASN  64          1HD2      ASN  64  -9.950  -8.099   2.421
  494   HD22  ASN  64          2HD2      ASN  64 -11.550  -7.901   3.068
  495    H    GLY  65           H        GLY  65  -7.676  -8.737   0.026
  496    HA2  GLY  65          2HA       GLY  65  -5.552 -10.082  -0.290
  497    HA3  GLY  65          1HA       GLY  65  -6.382 -10.773  -1.679
  498    H    TYR  66           H        TYR  66  -5.762  -7.502  -0.350
  499    HA   TYR  66           HA       TYR  66  -5.584  -6.284  -2.923
  500    HB2  TYR  66          2HB       TYR  66  -5.330  -5.413  -0.205
  501    HB3  TYR  66          1HB       TYR  66  -3.940  -4.824  -1.128
  502    HD1  TYR  66          1HD       TYR  66  -5.306  -2.839   0.010
  503    HD2  TYR  66          2HD       TYR  66  -6.479  -4.887  -3.503
  504    HE1  TYR  66          1HE       TYR  66  -6.609  -0.868  -0.670
  505    HE2  TYR  66          2HE       TYR  66  -7.793  -2.940  -4.213
  506    HH   TYR  66           HH       TYR  66  -7.520   0.111  -2.704
  507    H    ASP  67           H        ASP  67  -3.937  -6.053  -4.249
  508    HA   ASP  67           HA       ASP  67  -1.470  -7.367  -3.462
  509    HB2  ASP  67          2HB       ASP  67  -1.258  -8.084  -5.630
  510    HB3  ASP  67          1HB       ASP  67  -3.019  -7.938  -5.530
  511    H    ARG  68           H        ARG  68   0.436  -6.302  -4.684
  512    HA   ARG  68           HA       ARG  68   0.750  -3.836  -3.445
  513    HB2  ARG  68          2HB       ARG  68   2.823  -3.616  -4.926
  514    HB3  ARG  68          1HB       ARG  68   2.735  -4.998  -3.845
  515    HG2  ARG  68          2HG       ARG  68   2.023  -6.404  -5.733
  516    HG3  ARG  68          1HG       ARG  68   2.180  -5.009  -6.804
  517    HD2  ARG  68          2HD       ARG  68   4.528  -4.867  -6.393
  518    HD3  ARG  68          1HD       ARG  68   4.431  -6.066  -5.106
  519    HE   ARG  68           HE       ARG  68   3.543  -7.097  -7.620
  520   HH11  ARG  68          1HH1      ARG  68   6.399  -6.316  -5.760
  521   HH12  ARG  68          2HH1      ARG  68   7.375  -7.551  -6.488
  522   HH21  ARG  68          1HH2      ARG  68   4.830  -8.733  -8.595
  523   HH22  ARG  68          2HH2      ARG  68   6.483  -8.921  -8.106
  524    H    SER  69           H        SER  69  -0.189  -4.537  -6.799
  525    HA   SER  69           HA       SER  69   0.033  -1.805  -7.603
  526    HB2  SER  69          2HB       SER  69  -1.153  -2.499  -9.642
  527    HB3  SER  69          1HB       SER  69   0.166  -3.600  -9.256
  528    HG   SER  69           HG       SER  69  -1.452  -4.988  -8.284
  529    H    ALA  70           H        ALA  70  -2.682  -3.843  -6.563
  530    HA   ALA  70           HA       ALA  70  -4.747  -1.984  -7.018
  531    HB1  ALA  70          1HB       ALA  70  -4.810  -3.958  -4.766
  532    HB2  ALA  70          2HB       ALA  70  -4.884  -4.491  -6.449
  533    HB3  ALA  70          3HB       ALA  70  -6.127  -3.416  -5.810
  534    H    PHE  71           H        PHE  71  -3.028  -2.826  -4.059
  535    HA   PHE  71           HA       PHE  71  -4.436  -0.968  -2.469
  536    HB2  PHE  71          2HB       PHE  71  -3.633  -2.789  -1.307
  537    HB3  PHE  71          1HB       PHE  71  -2.060  -2.758  -2.058
  538    HD1  PHE  71          1HD       PHE  71  -3.957  -1.995   0.800
  539    HD2  PHE  71          2HD       PHE  71  -0.544  -0.720  -1.386
  540    HE1  PHE  71          1HE       PHE  71  -3.101  -0.887   2.803
  541    HE2  PHE  71          2HE       PHE  71   0.311   0.402   0.623
  542    HZ   PHE  71           HZ       PHE  71  -0.966   0.325   2.716
  543    H    PHE  72           H        PHE  72  -1.306  -0.857  -4.130
  544    HA   PHE  72           HA       PHE  72  -0.516   1.638  -3.068
  545    HB2  PHE  72          2HB       PHE  72   1.107   0.200  -4.146
  546    HB3  PHE  72          1HB       PHE  72   0.243   0.321  -5.674
  547    HD1  PHE  72          1HD       PHE  72   1.661   2.637  -3.118
  548    HD2  PHE  72          2HD       PHE  72   1.180   1.696  -7.239
  549    HE1  PHE  72          1HE       PHE  72   3.009   4.599  -3.718
  550    HE2  PHE  72          2HE       PHE  72   2.530   3.658  -7.851
  551    HZ   PHE  72           HZ       PHE  72   3.447   5.116  -6.089
  552    H    SER  73           H        SER  73  -2.470   0.730  -5.807
  553    HA   SER  73           HA       SER  73  -2.637   3.205  -7.098
  554    HB2  SER  73          2HB       SER  73  -3.454   0.956  -7.952
  555    HB3  SER  73          1HB       SER  73  -4.872   1.173  -6.929
  556    HG   SER  73           HG       SER  73  -4.087   2.563  -9.234
  557    H    LEU  74           H        LEU  74  -4.459   1.860  -4.395
  558    HA   LEU  74           HA       LEU  74  -6.274   4.053  -4.187
  559    HB2  LEU  74          2HB       LEU  74  -6.771   1.812  -3.287
  560    HB3  LEU  74          1HB       LEU  74  -5.476   2.004  -2.123
  561    HG   LEU  74           HG       LEU  74  -6.679   3.736  -0.972
  562   HD11  LEU  74          1HD1      LEU  74  -8.753   3.481  -3.149
  563   HD12  LEU  74          2HD1      LEU  74  -7.686   4.862  -2.882
  564   HD13  LEU  74          3HD1      LEU  74  -8.913   4.450  -1.684
  565   HD21  LEU  74          1HD2      LEU  74  -7.249   1.506  -0.332
  566   HD22  LEU  74          2HD2      LEU  74  -8.372   1.359  -1.681
  567   HD23  LEU  74          3HD2      LEU  74  -8.731   2.463  -0.351
  568    H    VAL  75           H        VAL  75  -3.322   3.152  -2.418
  569    HA   VAL  75           HA       VAL  75  -3.423   5.296  -0.588
  570    HB   VAL  75           HB       VAL  75  -0.912   3.883  -1.490
  571   HG11  VAL  75          1HG1      VAL  75  -0.176   5.520  -0.114
  572   HG12  VAL  75          2HG1      VAL  75  -0.477   4.216   1.038
  573   HG13  VAL  75          3HG1      VAL  75  -1.646   5.524   0.855
  574   HG21  VAL  75          1HG2      VAL  75  -2.332   2.104  -0.922
  575   HG22  VAL  75          2HG2      VAL  75  -3.058   3.005   0.409
  576   HG23  VAL  75          3HG2      VAL  75  -1.396   2.425   0.544
  577    H    ALA  76           H        ALA  76  -1.869   4.971  -3.753
  578    HA   ALA  76           HA       ALA  76  -0.396   7.381  -3.657
  579    HB1  ALA  76          1HB       ALA  76   0.098   5.599  -5.250
  580    HB2  ALA  76          2HB       ALA  76  -0.179   7.133  -6.075
  581    HB3  ALA  76          3HB       ALA  76  -1.436   5.897  -6.066
  582    H    SER  77           H        SER  77  -3.699   6.879  -3.803
  583    HA   SER  77           HA       SER  77  -4.185   9.473  -5.092
  584    HB2  SER  77          2HB       SER  77  -6.172   7.275  -4.474
  585    HB3  SER  77          1HB       SER  77  -6.453   8.707  -5.464
  586    HG   SER  77           HG       SER  77  -4.899   6.418  -6.031
  587    H    ASP  78           H        ASP  78  -3.832   8.095  -2.093
  588    HA   ASP  78           HA       ASP  78  -5.566  10.097  -0.822
  589    HB2  ASP  78          2HB       ASP  78  -5.473   7.143  -0.351
  590    HB3  ASP  78          1HB       ASP  78  -5.860   8.222   0.988
  591    H    GLU  79           H        GLU  79  -4.160  11.462   0.121
  592    HA   GLU  79           HA       GLU  79  -1.561  10.748   0.973
  593    HB2  GLU  79          2HB       GLU  79  -1.291  12.932   1.518
  594    HB3  GLU  79          1HB       GLU  79  -2.729  13.115   0.531
  595    HG2  GLU  79          2HG       GLU  79  -4.118  13.145   2.523
  596    HG3  GLU  79          1HG       GLU  79  -2.691  12.883   3.534
  597    H    GLN  80           H        GLN  80  -4.664  10.652   2.615
  598    HA   GLN  80           HA       GLN  80  -3.702  10.536   5.262
  599    HB2  GLN  80          2HB       GLN  80  -6.084   8.938   4.345
  600    HB3  GLN  80          1HB       GLN  80  -5.812   9.693   5.903
  601    HG2  GLN  80          2HG       GLN  80  -7.384  11.074   4.988
  602    HG3  GLN  80          1HG       GLN  80  -5.894  11.907   4.556
  603   HE21  GLN  80          1HE2      GLN  80  -6.944   8.975   2.960
  604   HE22  GLN  80          2HE2      GLN  80  -7.355   9.712   1.449
  605    H    TYR  81           H        TYR  81  -3.636   8.344   2.669
  606    HA   TYR  81           HA       TYR  81  -3.445   5.964   4.284
  607    HB2  TYR  81          2HB       TYR  81  -3.710   6.508   1.348
  608    HB3  TYR  81          1HB       TYR  81  -3.207   4.921   1.922
  609    HD1  TYR  81          1HD       TYR  81  -5.602   5.032   0.343
  610    HD2  TYR  81          2HD       TYR  81  -5.158   5.765   4.502
  611    HE1  TYR  81          1HE       TYR  81  -7.940   4.309   0.720
  612    HE2  TYR  81          2HE       TYR  81  -7.466   5.086   4.869
  613    HH   TYR  81           HH       TYR  81  -9.603   4.949   3.472
  614    H    VAL  82           H        VAL  82  -1.452   7.923   2.113
  615    HA   VAL  82           HA       VAL  82   0.750   6.237   2.117
  616    HB   VAL  82           HB       VAL  82   1.934   8.244   1.420
  617   HG11  VAL  82          1HG1      VAL  82   0.892   6.974  -0.295
  618   HG12  VAL  82          2HG1      VAL  82   0.632   8.684  -0.651
  619   HG13  VAL  82          3HG1      VAL  82  -0.664   7.722   0.065
  620   HG21  VAL  82          1HG2      VAL  82  -0.570   9.642   2.074
  621   HG22  VAL  82          2HG2      VAL  82   0.593  10.292   0.918
  622   HG23  VAL  82          3HG2      VAL  82   1.074  10.017   2.593
  623    H    ARG  83           H        ARG  83   0.062   9.124   4.003
  624    HA   ARG  83           HA       ARG  83   2.197   8.761   5.793
  625    HB2  ARG  83          2HB       ARG  83   1.087  10.431   7.237
  626    HB3  ARG  83          1HB       ARG  83   1.353  10.963   5.594
  627    HG2  ARG  83          2HG       ARG  83  -1.053  10.235   5.171
  628    HG3  ARG  83          1HG       ARG  83  -1.220  10.188   6.925
  629    HD2  ARG  83          2HD       ARG  83  -0.838  12.443   5.054
  630    HD3  ARG  83          1HD       ARG  83  -1.956  12.294   6.403
  631    HE   ARG  83           HE       ARG  83   0.461  12.340   7.622
  632   HH11  ARG  83          1HH1      ARG  83  -1.090  14.477   5.307
  633   HH12  ARG  83          2HH1      ARG  83  -0.279  15.890   5.899
  634   HH21  ARG  83          1HH2      ARG  83   1.525  14.188   8.378
  635   HH22  ARG  83          2HH2      ARG  83   1.216  15.728   7.639
  636    H    PHE  84           H        PHE  84  -1.029   7.446   5.704
  637    HA   PHE  84           HA       PHE  84  -1.256   6.692   8.396
  638    HB2  PHE  84          2HB       PHE  84  -2.666   6.079   6.089
  639    HB3  PHE  84          1HB       PHE  84  -1.983   4.522   6.561
  640    HD1  PHE  84          1HD       PHE  84  -2.566   3.509   8.687
  641    HD2  PHE  84          2HD       PHE  84  -4.385   7.119   7.381
  642    HE1  PHE  84          1HE       PHE  84  -4.360   3.197  10.342
  643    HE2  PHE  84          2HE       PHE  84  -6.182   6.820   9.033
  644    HZ   PHE  84           HZ       PHE  84  -6.169   4.853  10.515
  645    H    ILE  85           H        ILE  85   0.339   5.044   5.698
  646    HA   ILE  85           HA       ILE  85   1.398   3.011   7.437
  647    HB   ILE  85           HB       ILE  85   1.678   3.553   4.515
  648   HG12  ILE  85          2HG1      ILE  85   0.802   1.219   6.230
  649   HG13  ILE  85          1HG1      ILE  85  -0.217   2.245   5.230
  650   HG21  ILE  85          1HG2      ILE  85   3.465   1.806   6.182
  651   HG22  ILE  85          2HG2      ILE  85   3.931   3.084   5.061
  652   HG23  ILE  85          3HG2      ILE  85   3.251   1.575   4.450
  653   HD11  ILE  85          1HD1      ILE  85   1.880   0.329   4.207
  654   HD12  ILE  85          2HD1      ILE  85   0.806   1.333   3.226
  655   HD13  ILE  85          3HD1      ILE  85   0.138   0.052   4.236
  656    H    ALA  86           H        ALA  86   2.805   5.765   5.658
  657    HA   ALA  86           HA       ALA  86   5.424   5.605   6.454
  658    HB1  ALA  86          1HB       ALA  86   3.859   8.178   6.355
  659    HB2  ALA  86          2HB       ALA  86   4.430   7.318   4.926
  660    HB3  ALA  86          3HB       ALA  86   5.588   7.966   6.090
  661    H    GLN  87           H        GLN  87   2.678   6.749   8.322
  662    HA   GLN  87           HA       GLN  87   4.167   7.761  10.513
  663    HB2  GLN  87          2HB       GLN  87   1.884   8.488  10.096
  664    HB3  GLN  87          1HB       GLN  87   1.293   6.845  10.288
  665    HG2  GLN  87          2HG       GLN  87   2.052   6.927  12.660
  666    HG3  GLN  87          1HG       GLN  87   2.432   8.633  12.421
  667   HE21  GLN  87          1HE2      GLN  87   0.919   9.312  13.924
  668   HE22  GLN  87          2HE2      GLN  87  -0.781   9.253  13.622
  669    H    HIS  88           H        HIS  88   2.634   4.691   9.751
  670    HA   HIS  88           HA       HIS  88   3.153   3.534  12.328
  671    HB2  HIS  88          2HB       HIS  88   2.187   2.343   9.727
  672    HB3  HIS  88          1HB       HIS  88   2.399   1.401  11.198
  673    HD1  HIS  88          1HD       HIS  88   1.190   3.522  13.175
  674    HD2  HIS  88          2HD       HIS  88  -0.565   2.275   9.615
  675    HE1  HIS  88          1HE       HIS  88  -1.257   3.994  13.428
  676    HE2  HIS  88          2HE       HIS  88  -2.312   2.990  11.381
  677    H    PHE  89           H        PHE  89   4.839   3.630   9.262
  678    HA   PHE  89           HA       PHE  89   7.051   2.156  10.428
  679    HB2  PHE  89          2HB       PHE  89   5.443   0.470   9.466
  680    HB3  PHE  89          1HB       PHE  89   5.763   1.167   7.886
  681    HD1  PHE  89          1HD       PHE  89   7.413   0.247   6.588
  682    HD2  PHE  89          2HD       PHE  89   7.576  -0.280  10.805
  683    HE1  PHE  89          1HE       PHE  89   9.330  -1.276   6.318
  684    HE2  PHE  89          2HE       PHE  89   9.506  -1.785  10.549
  685    HZ   PHE  89           HZ       PHE  89  10.385  -2.285   8.302
  686    HA   PRO  90           HA       PRO  90   9.216   5.321   7.968
  687    HB2  PRO  90          2HB       PRO  90  11.340   3.490   9.010
  688    HB3  PRO  90          1HB       PRO  90  11.312   5.257   8.947
  689    HG2  PRO  90          2HG       PRO  90  10.853   3.999  11.235
  690    HG3  PRO  90          1HG       PRO  90   9.906   5.431  10.789
  691    HD2  PRO  90          2HD       PRO  90   9.120   2.559  10.764
  692    HD3  PRO  90          1HD       PRO  90   8.137   4.000  11.105
  693    H    CYS  91           H        CYS  91  10.687   5.195   6.160
  694    HA   CYS  91           HA       CYS  91   9.788   3.305   4.262
  695    HB2  CYS  91          2HB       CYS  91  11.412   4.461   2.752
  696    HB3  CYS  91          1HB       CYS  91  10.354   5.579   3.634
  697    HG   CYS  91           HG       CYS  91  13.422   4.874   4.930
  698    H    ALA  92           H        ALA  92  10.617   1.611   3.390
  699    HA   ALA  92           HA       ALA  92  12.239  -0.110   4.826
  700    HB1  ALA  92          1HB       ALA  92  10.659  -0.836   3.119
  701    HB2  ALA  92          2HB       ALA  92  12.264  -1.512   2.843
  702    HB3  ALA  92          3HB       ALA  92  11.695  -0.157   1.865
  703    HA   PRO  93           HA       PRO  93  16.390   1.049   3.894
  704    HB2  PRO  93          2HB       PRO  93  17.656  -1.224   4.397
  705    HB3  PRO  93          1HB       PRO  93  16.826  -0.359   5.690
  706    HG2  PRO  93          2HG       PRO  93  15.846  -2.669   4.045
  707    HG3  PRO  93          1HG       PRO  93  15.851  -2.508   5.818
  708    HD2  PRO  93          2HD       PRO  93  13.654  -1.983   4.346
  709    HD3  PRO  93          1HD       PRO  93  14.049  -1.040   5.799
  710    H    GLU  94           H        GLU  94  15.656   1.187   1.547
  711    HA   GLU  94           HA       GLU  94  16.500  -0.893  -0.230
  712    HB2  GLU  94          2HB       GLU  94  15.587   1.934  -0.602
  713    HB3  GLU  94          1HB       GLU  94  16.336   1.074  -1.939
  714    HG2  GLU  94          2HG       GLU  94  13.919   0.121  -0.423
  715    HG3  GLU  94          1HG       GLU  94  13.875   0.976  -1.965
  716    H    GLU  95           H        GLU  95  18.534  -0.303   1.565
  717    HA   GLU  95           HA       GLU  95  20.603   0.701  -0.265
  718    HB2  GLU  95          2HB       GLU  95  20.634   0.704   2.759
  719    HB3  GLU  95          1HB       GLU  95  21.945   1.248   1.732
  720    HG2  GLU  95          2HG       GLU  95  20.972   3.195   2.339
  721    HG3  GLU  95          1HG       GLU  95  20.212   2.895   0.784
  722    H    GLU  96           H        GLU  96  19.421  -1.907   1.628
  723    HA   GLU  96           HA       GLU  96  21.944  -3.263   1.852
  724    HB2  GLU  96          2HB       GLU  96  20.481  -5.177   2.680
  725    HB3  GLU  96          1HB       GLU  96  20.495  -3.704   3.636
  726    HG2  GLU  96          2HG       GLU  96  18.363  -3.044   2.665
  727    HG3  GLU  96          1HG       GLU  96  18.354  -4.508   1.684
  728    H    LYS  97           H        LYS  97  18.922  -3.994   0.069
  729    HA   LYS  97           HA       LYS  97  20.580  -4.938  -2.125
  730    HB2  LYS  97          2HB       LYS  97  19.198  -6.998  -2.401
  731    HB3  LYS  97          1HB       LYS  97  20.218  -7.003  -0.973
  732    HG2  LYS  97          2HG       LYS  97  18.326  -6.534   0.439
  733    HG3  LYS  97          1HG       LYS  97  17.277  -6.352  -0.968
  734    HD2  LYS  97          2HD       LYS  97  17.656  -8.695  -1.559
  735    HD3  LYS  97          1HD       LYS  97  18.723  -8.880  -0.169
  736    HE2  LYS  97          2HE       LYS  97  16.540  -9.783   0.346
  737    HE3  LYS  97          1HE       LYS  97  16.836  -8.345   1.321
  738    HZ1  LYS  97          1HZ       LYS  97  15.194  -8.453  -1.151
  739    HZ2  LYS  97          2HZ       LYS  97  15.481  -7.070  -0.225
  740    HZ3  LYS  97          3HZ       LYS  97  14.601  -8.354   0.428
  741    HA   PRO  98           HA       PRO  98  16.818  -2.531  -3.322
  742    HB2  PRO  98          2HB       PRO  98  18.005  -0.356  -4.338
  743    HB3  PRO  98          1HB       PRO  98  17.773  -0.555  -2.598
  744    HG2  PRO  98          2HG       PRO  98  20.237  -0.919  -4.237
  745    HG3  PRO  98          1HG       PRO  98  20.061  -0.254  -2.605
  746    HD2  PRO  98          2HD       PRO  98  20.863  -2.846  -3.217
  747    HD3  PRO  98          1HD       PRO  98  20.249  -2.304  -1.644
  748    HA   PRO  99           HA       PRO  99  17.426  -3.991  -7.578
  749    HB2  PRO  99          2HB       PRO  99  14.795  -3.824  -8.244
  750    HB3  PRO  99          1HB       PRO  99  15.476  -5.206  -7.378
  751    HG2  PRO  99          2HG       PRO  99  13.949  -2.866  -6.311
  752    HG3  PRO  99          1HG       PRO  99  13.826  -4.579  -5.869
  753    HD2  PRO  99          2HD       PRO  99  15.180  -2.762  -4.374
  754    HD3  PRO  99          1HD       PRO  99  15.642  -4.473  -4.461
  755    H    GLU 100           H        GLU 100  15.771  -1.223  -6.278
  756    HA   GLU 100           HA       GLU 100  16.946   0.549  -8.166
  757    HB2  GLU 100          2HB       GLU 100  15.027  -0.375  -9.496
  758    HB3  GLU 100          1HB       GLU 100  13.932   0.263  -8.285
  759    HG2  GLU 100          2HG       GLU 100  14.097   1.667 -10.270
  760    HG3  GLU 100          1HG       GLU 100  14.606   2.514  -8.810
  761    H    ILE 101           H        ILE 101  13.775   0.984  -6.750
  762    HA   ILE 101           HA       ILE 101  14.882   2.382  -4.433
  763    HB   ILE 101           HB       ILE 101  13.166   4.211  -4.770
  764   HG12  ILE 101          2HG1      ILE 101  13.104   3.069  -7.567
  765   HG13  ILE 101          1HG1      ILE 101  11.765   3.093  -6.433
  766   HG21  ILE 101          1HG2      ILE 101  14.569   5.486  -6.331
  767   HG22  ILE 101          2HG2      ILE 101  15.400   3.997  -6.779
  768   HG23  ILE 101          3HG2      ILE 101  15.523   4.615  -5.133
  769   HD11  ILE 101          1HD1      ILE 101  11.620   4.775  -8.183
  770   HD12  ILE 101          2HD1      ILE 101  13.117   5.493  -7.604
  771   HD13  ILE 101          3HD1      ILE 101  11.685   5.490  -6.573
  772    H    ASP 102           H        ASP 102  12.687   0.305  -5.809
  773    HA   ASP 102           HA       ASP 102  10.895  -0.885  -5.147
  774    HB2  ASP 102          2HB       ASP 102  12.137  -1.080  -2.974
  775    HB3  ASP 102          1HB       ASP 102  11.259   0.325  -2.396
  776    H    ALA 103           H        ALA 103  10.811   2.203  -3.478
  777    HA   ALA 103           HA       ALA 103   8.251   2.875  -3.217
  778    HB1  ALA 103          1HB       ALA 103   8.963   5.249  -3.844
  779    HB2  ALA 103          2HB       ALA 103  10.545   4.546  -4.199
  780    HB3  ALA 103          3HB       ALA 103   9.872   4.436  -2.576
  781    H    LEU 104           H        LEU 104   9.866   4.085  -6.139
  782    HA   LEU 104           HA       LEU 104   7.280   3.911  -7.493
  783    HB2  LEU 104          2HB       LEU 104   9.717   5.541  -8.218
  784    HB3  LEU 104          1HB       LEU 104   8.214   5.523  -9.116
  785    HG   LEU 104           HG       LEU 104   7.241   6.245  -6.736
  786   HD11  LEU 104          1HD1      LEU 104   9.413   6.169  -5.622
  787   HD12  LEU 104          2HD1      LEU 104   8.734   7.795  -5.619
  788   HD13  LEU 104          3HD1      LEU 104  10.030   7.381  -6.742
  789   HD21  LEU 104          1HD2      LEU 104   7.355   8.564  -7.519
  790   HD22  LEU 104          2HD2      LEU 104   6.922   7.448  -8.815
  791   HD23  LEU 104          3HD2      LEU 104   8.560   8.092  -8.717
  792    H    GLU 105           H        GLU 105   8.587   1.527  -7.226
  793    HA   GLU 105           HA       GLU 105  10.039   0.918  -9.648
  794    HB2  GLU 105          2HB       GLU 105  10.433  -0.283  -7.498
  795    HB3  GLU 105          1HB       GLU 105   8.812  -0.949  -7.600
  796    HG2  GLU 105          2HG       GLU 105  10.311  -2.623  -8.321
  797    HG3  GLU 105          1HG       GLU 105   9.475  -2.027  -9.750
  798    H    LEU 106           H        LEU 106   7.891   2.153 -10.443
  799    HA   LEU 106           HA       LEU 106   6.517   0.593 -12.242
  800    HB2  LEU 106          2HB       LEU 106   5.473  -0.495 -10.276
  801    HB3  LEU 106          1HB       LEU 106   4.897   1.067  -9.726
  802    HG   LEU 106           HG       LEU 106   3.530   1.232 -11.815
  803   HD11  LEU 106          1HD1      LEU 106   4.396  -1.634 -12.169
  804   HD12  LEU 106          2HD1      LEU 106   4.786  -0.280 -13.231
  805   HD13  LEU 106          3HD1      LEU 106   3.118  -0.830 -13.080
  806   HD21  LEU 106          1HD2      LEU 106   1.823  -0.371 -11.071
  807   HD22  LEU 106          2HD2      LEU 106   2.522   0.530  -9.727
  808   HD23  LEU 106          3HD2      LEU 106   3.016  -1.137 -10.023
  809    H    LYS 107           H        LYS 107   5.284   2.936  -9.890
  810    HA   LYS 107           HA       LYS 107   4.457   5.026 -10.045
  811    HB2  LYS 107          2HB       LYS 107   6.688   5.694 -10.655
  812    HB3  LYS 107          1HB       LYS 107   6.436   5.195 -12.321
  813    HG2  LYS 107          2HG       LYS 107   4.755   6.961 -12.589
  814    HG3  LYS 107          1HG       LYS 107   5.032   7.465 -10.921
  815    HD2  LYS 107          2HD       LYS 107   7.283   8.104 -11.418
  816    HD3  LYS 107          1HD       LYS 107   7.185   7.392 -13.028
  817    HE2  LYS 107          2HE       LYS 107   5.484   9.692 -12.082
  818    HE3  LYS 107          1HE       LYS 107   6.980   9.874 -12.994
  819    HZ1  LYS 107          1HZ       LYS 107   4.970   9.968 -14.387
  820    HZ2  LYS 107          2HZ       LYS 107   4.611   8.366 -13.965
  821    HZ3  LYS 107          3HZ       LYS 107   6.016   8.718 -14.832
  822    H    THR 108           H        THR 108   4.957   4.600 -13.514
  823    HA   THR 108           HA       THR 108   2.078   4.358 -13.926
  824    HB   THR 108           HB       THR 108   2.408   6.058 -15.867
  825    HG1  THR 108          1HG       THR 108   4.803   6.094 -15.186
  826   HG21  THR 108          1HG2      THR 108   0.952   6.486 -13.957
  827   HG22  THR 108          2HG2      THR 108   1.846   7.945 -14.383
  828   HG23  THR 108          3HG2      THR 108   2.340   6.984 -12.990
  829    H    GLN 109           H        GLN 109   1.739   2.714 -15.283
  830    HA   GLN 109           HA       GLN 109   3.807   1.399 -16.670
  831    HB2  GLN 109          2HB       GLN 109   0.812   1.280 -17.048
  832    HB3  GLN 109          1HB       GLN 109   1.948   0.195 -17.838
  833    HG2  GLN 109          2HG       GLN 109   2.702  -0.597 -15.646
  834    HG3  GLN 109          1HG       GLN 109   1.539   0.473 -14.868
  835   HE21  GLN 109          1HE2      GLN 109  -0.516   0.015 -16.879
  836   HE22  GLN 109          2HE2      GLN 109  -1.133  -1.572 -16.584
  837    H    LYS 110           H        LYS 110   4.885   2.123 -18.336
  838    HA   LYS 110           HA       LYS 110   5.546   3.402 -20.079
  839    HB2  LYS 110          2HB       LYS 110   2.705   2.921 -20.996
  840    HB3  LYS 110          1HB       LYS 110   3.994   3.569 -22.003
  841    HG2  LYS 110          2HG       LYS 110   3.959   0.840 -20.731
  842    HG3  LYS 110          1HG       LYS 110   3.624   1.197 -22.423
  843    HD2  LYS 110          2HD       LYS 110   6.234   1.793 -21.032
  844    HD3  LYS 110          1HD       LYS 110   5.928   0.361 -22.011
  845    HE2  LYS 110          2HE       LYS 110   5.759   3.212 -22.987
  846    HE3  LYS 110          1HE       LYS 110   7.118   2.124 -23.252
  847    HZ1  LYS 110          1HZ       LYS 110   5.690   2.173 -25.175
  848    HZ2  LYS 110          2HZ       LYS 110   4.350   1.732 -24.249
  849    HZ3  LYS 110          3HZ       LYS 110   5.623   0.643 -24.463
  850    H    GLY 111           H        GLY 111   5.544   5.083 -18.314
  851    HA2  GLY 111          2HA       GLY 111   3.546   7.159 -18.501
  852    HA3  GLY 111          1HA       GLY 111   5.029   7.214 -17.557
  853    H    PHE 112           H        PHE 112   4.725   6.574 -20.988
  854    HA   PHE 112           HA       PHE 112   6.430   8.896 -21.537
  855    HB2  PHE 112          2HB       PHE 112   5.925   6.388 -23.158
  856    HB3  PHE 112          1HB       PHE 112   6.954   7.719 -23.667
  857    HD1  PHE 112          1HD       PHE 112   6.674   4.769 -21.586
  858    HD2  PHE 112          2HD       PHE 112   9.065   8.172 -22.479
  859    HE1  PHE 112          1HE       PHE 112   8.583   3.730 -20.433
  860    HE2  PHE 112          2HE       PHE 112  10.976   7.139 -21.329
  861    HZ   PHE 112           HZ       PHE 112  10.736   4.914 -20.303
  Start of MODEL   11
    1    H1   GLY   1          1HT       GLY   1   1.241   1.941 -15.820
    2    H2   GLY   1          2HT       GLY   1   2.601   1.667 -16.786
    3    H    GLY   1           H        GLY   1   1.565   2.795 -15.711
    4    H3   GLY   1          3HT       GLY   1   2.453   3.116 -15.925
    5    HA2  GLY   1          1HA       GLY   1   2.790   0.414 -14.755
    6    HA3  GLY   1          2HA       GLY   1   4.023   1.664 -14.834
    7    H    SER   2           H        SER   2   2.741   0.278 -12.519
    8    HA   SER   2           HA       SER   2   1.034   2.188 -11.245
    9    HB2  SER   2          2HB       SER   2   1.397   0.710  -9.227
   10    HB3  SER   2          1HB       SER   2   0.762  -0.112 -10.650
   11    HG   SER   2           HG       SER   2   2.465  -1.330 -10.646
   12    H    ALA   3           H        ALA   3   4.360   2.025 -11.713
   13    HA   ALA   3           HA       ALA   3   5.338   3.120  -9.303
   14    HB1  ALA   3          1HB       ALA   3   7.358   3.621 -10.573
   15    HB2  ALA   3          2HB       ALA   3   6.499   3.298 -12.080
   16    HB3  ALA   3          3HB       ALA   3   6.775   1.995 -10.921
   17    H    MET   4           H        MET   4   3.389   4.523 -11.651
   18    HA   MET   4           HA       MET   4   4.014   7.182 -10.595
   19    HB2  MET   4          2HB       MET   4   3.621   8.142 -12.878
   20    HB3  MET   4          1HB       MET   4   5.093   7.197 -12.724
   21    HG2  MET   4          2HG       MET   4   3.989   5.300 -13.792
   22    HG3  MET   4          1HG       MET   4   2.511   6.248 -13.942
   23    HE1  MET   4          1HE       MET   4   6.436   7.372 -16.094
   24    HE2  MET   4          2HE       MET   4   6.302   6.056 -14.927
   25    HE3  MET   4          3HE       MET   4   6.134   7.728 -14.394
   26    H    GLY   5           H        GLY   5   2.018   5.647  -9.601
   27    HA2  GLY   5          2HA       GLY   5  -0.469   6.256 -10.968
   28    HA3  GLY   5          1HA       GLY   5  -0.294   5.348  -9.477
   29    H    HIS   6           H        HIS   6   0.681   8.624 -10.435
   30    HA   HIS   6           HA       HIS   6   0.211  10.686  -9.613
   31    HB2  HIS   6          2HB       HIS   6  -1.995   9.287  -8.092
   32    HB3  HIS   6          1HB       HIS   6  -1.712  11.022  -8.030
   33    HD1  HIS   6          1HD       HIS   6  -2.507  12.421 -10.014
   34    HD2  HIS   6          2HD       HIS   6  -3.035   8.334 -10.551
   35    HE1  HIS   6          1HE       HIS   6  -3.987  12.192 -12.027
   36    HE2  HIS   6          2HE       HIS   6  -4.102   9.715 -12.457
   37    H    MET   7           H        MET   7   1.083  11.925  -8.031
   38    HA   MET   7           HA       MET   7   1.990  10.524  -5.603
   39    HB2  MET   7          2HB       MET   7   3.377  12.708  -7.167
   40    HB3  MET   7          1HB       MET   7   3.880  12.190  -5.568
   41    HG2  MET   7          2HG       MET   7   5.311  11.099  -7.057
   42    HG3  MET   7          1HG       MET   7   4.152   9.874  -6.547
   43    HE1  MET   7          1HE       MET   7   6.118   9.686  -9.082
   44    HE2  MET   7          2HE       MET   7   5.049   8.971 -10.289
   45    HE3  MET   7          3HE       MET   7   5.026   8.379  -8.627
   46    H    VAL   8           H        VAL   8   2.204  11.881  -3.688
   47    HA   VAL   8           HA       VAL   8   1.004  14.471  -3.662
   48    HB   VAL   8           HB       VAL   8  -1.042  13.253  -3.661
   49   HG11  VAL   8          1HG1      VAL   8  -0.370  11.064  -3.031
   50   HG12  VAL   8          2HG1      VAL   8  -1.617  11.601  -1.903
   51   HG13  VAL   8          3HG1      VAL   8   0.076  11.598  -1.413
   52   HG21  VAL   8          1HG2      VAL   8  -0.999  15.190  -2.212
   53   HG22  VAL   8          2HG2      VAL   8  -0.448  14.200  -0.863
   54   HG23  VAL   8          3HG2      VAL   8  -2.054  13.945  -1.545
   55    H    LYS   9           H        LYS   9   0.646  12.890  -0.741
   56    HA   LYS   9           HA       LYS   9   3.088  13.918   0.353
   57    HB2  LYS   9          2HB       LYS   9   1.023  12.021   1.533
   58    HB3  LYS   9          1HB       LYS   9   2.389  12.702   2.415
   59    HG2  LYS   9          2HG       LYS   9   0.247  14.353   1.107
   60    HG3  LYS   9          1HG       LYS   9   0.228  13.855   2.796
   61    HD2  LYS   9          2HD       LYS   9   2.401  15.013   3.104
   62    HD3  LYS   9          1HD       LYS   9   2.291  15.587   1.442
   63    HE2  LYS   9          2HE       LYS   9   0.321  16.171   3.647
   64    HE3  LYS   9          1HE       LYS   9   1.546  17.283   3.045
   65    HZ1  LYS   9          1HZ       LYS   9  -0.837  16.253   1.604
   66    HZ2  LYS   9          2HZ       LYS   9   0.430  17.067   0.828
   67    HZ3  LYS   9          3HZ       LYS   9  -0.477  17.858   2.011
   68    H    ILE  10           H        ILE  10   3.853  12.486  -1.752
   69    HA   ILE  10           HA       ILE  10   4.938  10.003  -0.667
   70    HB   ILE  10           HB       ILE  10   3.823  10.291  -3.459
   71   HG12  ILE  10          2HG1      ILE  10   2.718   8.541  -1.276
   72   HG13  ILE  10          1HG1      ILE  10   2.122  10.178  -1.534
   73   HG21  ILE  10          1HG2      ILE  10   4.178   7.833  -3.526
   74   HG22  ILE  10          2HG2      ILE  10   5.001   7.951  -1.969
   75   HG23  ILE  10          3HG2      ILE  10   5.672   8.758  -3.385
   76   HD11  ILE  10          1HD1      ILE  10   2.013   7.865  -3.447
   77   HD12  ILE  10          2HD1      ILE  10   1.594   9.523  -3.878
   78   HD13  ILE  10          3HD1      ILE  10   0.668   8.674  -2.643
   79    H    SER  11           H        SER  11   7.000  10.837  -0.473
   80    HA   SER  11           HA       SER  11   8.347  11.589  -2.963
   81    HB2  SER  11          2HB       SER  11   9.478  11.415  -0.155
   82    HB3  SER  11          1HB       SER  11  10.228  12.186  -1.557
   83    HG   SER  11           HG       SER  11   7.797  12.979  -0.315
   84    H    HIS  12           H        HIS  12  10.803  10.436  -2.724
   85    HA   HIS  12           HA       HIS  12  10.473   7.801  -3.538
   86    HB2  HIS  12          2HB       HIS  12  12.876   8.995  -2.138
   87    HB3  HIS  12          1HB       HIS  12  12.885   7.519  -3.097
   88    HD1  HIS  12          1HD       HIS  12  14.077  10.721  -3.411
   89    HD2  HIS  12          2HD       HIS  12  11.639   8.414  -5.865
   90    HE1  HIS  12          1HE       HIS  12  14.275  11.732  -5.706
   91    HE2  HIS  12          2HE       HIS  12  12.654  10.432  -7.126
   92    H    GLU  13           H        GLU  13  11.465   9.051  -0.398
   93    HA   GLU  13           HA       GLU  13  11.600   6.636   0.990
   94    HB2  GLU  13          2HB       GLU  13  12.554   8.769   1.761
   95    HB3  GLU  13          1HB       GLU  13  10.929   9.383   2.041
   96    HG2  GLU  13          2HG       GLU  13  10.550   7.689   3.732
   97    HG3  GLU  13          1HG       GLU  13  12.145   7.006   3.426
   98    H    ASP  14           H        ASP  14   8.851   8.797   0.369
   99    HA   ASP  14           HA       ASP  14   7.214   7.545   2.317
  100    HB2  ASP  14          2HB       ASP  14   6.433   9.301   0.011
  101    HB3  ASP  14          1HB       ASP  14   5.378   8.844   1.351
  102    H    THR  15           H        THR  15   7.490   7.264  -1.189
  103    HA   THR  15           HA       THR  15   5.385   5.504  -1.632
  104    HB   THR  15           HB       THR  15   7.945   5.045  -3.086
  105    HG1  THR  15          1HG       THR  15   7.883   7.311  -2.953
  106   HG21  THR  15          1HG2      THR  15   6.028   3.792  -3.779
  107   HG22  THR  15          2HG2      THR  15   6.354   5.016  -5.010
  108   HG23  THR  15          3HG2      THR  15   5.044   5.255  -3.847
  109    H    GLN  16           H        GLN  16   8.662   4.942  -0.490
  110    HA   GLN  16           HA       GLN  16   8.663   2.143  -0.744
  111    HB2  GLN  16          2HB       GLN  16  10.304   3.949   1.028
  112    HB3  GLN  16          1HB       GLN  16  10.635   2.245   0.744
  113    HG2  GLN  16          2HG       GLN  16  10.949   2.703  -1.629
  114    HG3  GLN  16          1HG       GLN  16  10.613   4.403  -1.341
  115   HE21  GLN  16          1HE2      GLN  16  12.173   5.699  -0.570
  116   HE22  GLN  16          2HE2      GLN  16  13.797   5.198  -0.268
  117    H    ARG  17           H        ARG  17   7.887   4.266   2.037
  118    HA   ARG  17           HA       ARG  17   7.704   2.152   3.878
  119    HB2  ARG  17          2HB       ARG  17   6.230   3.657   5.243
  120    HB3  ARG  17          1HB       ARG  17   7.802   4.265   4.856
  121    HG2  ARG  17          2HG       ARG  17   6.119   5.185   2.847
  122    HG3  ARG  17          1HG       ARG  17   5.294   5.440   4.390
  123    HD2  ARG  17          2HD       ARG  17   8.058   6.369   3.602
  124    HD3  ARG  17          1HD       ARG  17   6.625   7.364   3.941
  125    HE   ARG  17           HE       ARG  17   7.468   5.740   6.161
  126   HH11  ARG  17          1HH1      ARG  17   7.807   8.811   4.497
  127   HH12  ARG  17          2HH1      ARG  17   8.377   9.653   5.903
  128   HH21  ARG  17          1HH2      ARG  17   8.204   6.883   8.032
  129   HH22  ARG  17          2HH2      ARG  17   8.619   8.559   7.894
  130    H    ILE  18           H        ILE  18   5.229   3.713   1.899
  131    HA   ILE  18           HA       ILE  18   3.000   2.352   2.844
  132    HB   ILE  18           HB       ILE  18   3.514   3.019  -0.048
  133   HG12  ILE  18          2HG1      ILE  18   1.786   4.778   1.517
  134   HG13  ILE  18          1HG1      ILE  18   3.459   4.775   2.073
  135   HG21  ILE  18          1HG2      ILE  18   1.016   3.140  -0.103
  136   HG22  ILE  18          2HG2      ILE  18   1.010   2.444   1.522
  137   HG23  ILE  18          3HG2      ILE  18   1.673   1.526   0.169
  138   HD11  ILE  18          1HD1      ILE  18   2.586   5.244  -0.761
  139   HD12  ILE  18          2HD1      ILE  18   4.229   5.341  -0.112
  140   HD13  ILE  18          3HD1      ILE  18   3.004   6.505   0.400
  141    H    LYS  19           H        LYS  19   5.139   1.356   0.172
  142    HA   LYS  19           HA       LYS  19   3.828  -1.079  -0.376
  143    HB2  LYS  19          2HB       LYS  19   6.795  -0.651  -0.636
  144    HB3  LYS  19          1HB       LYS  19   5.755  -1.687  -1.608
  145    HG2  LYS  19          2HG       LYS  19   4.757   0.122  -2.729
  146    HG3  LYS  19          1HG       LYS  19   5.418   1.294  -1.594
  147    HD2  LYS  19          2HD       LYS  19   6.544   1.255  -3.811
  148    HD3  LYS  19          1HD       LYS  19   7.632   0.980  -2.454
  149    HE2  LYS  19          2HE       LYS  19   6.401  -1.270  -3.971
  150    HE3  LYS  19          1HE       LYS  19   7.846  -0.466  -4.573
  151    HZ1  LYS  19          1HZ       LYS  19   7.537  -2.045  -2.094
  152    HZ2  LYS  19          2HZ       LYS  19   8.795  -0.929  -2.262
  153    HZ3  LYS  19          3HZ       LYS  19   8.670  -2.237  -3.334
  154    H    THR  20           H        THR  20   6.675  -0.320   1.570
  155    HA   THR  20           HA       THR  20   7.349  -2.968   2.000
  156    HB   THR  20           HB       THR  20   8.904  -1.002   2.231
  157    HG1  THR  20          1HG       THR  20   9.992  -2.641   3.029
  158   HG21  THR  20          1HG2      THR  20   7.291   0.232   3.781
  159   HG22  THR  20          2HG2      THR  20   9.002   0.256   4.221
  160   HG23  THR  20          3HG2      THR  20   7.889  -0.827   5.058
  161    H    ALA  21           H        ALA  21   5.340  -0.765   3.862
  162    HA   ALA  21           HA       ALA  21   5.259  -2.454   6.147
  163    HB1  ALA  21          1HB       ALA  21   4.886  -0.046   6.324
  164    HB2  ALA  21          2HB       ALA  21   3.500  -0.945   6.944
  165    HB3  ALA  21          3HB       ALA  21   3.425  -0.197   5.343
  166    H    PHE  22           H        PHE  22   2.799  -1.561   3.762
  167    HA   PHE  22           HA       PHE  22   0.713  -3.175   4.428
  168    HB2  PHE  22          2HB       PHE  22   0.130  -1.936   2.686
  169    HB3  PHE  22          1HB       PHE  22   1.772  -1.823   2.093
  170    HD1  PHE  22          1HD       PHE  22  -1.208  -3.984   2.085
  171    HD2  PHE  22          2HD       PHE  22   2.376  -2.866   0.133
  172    HE1  PHE  22          1HE       PHE  22  -1.927  -5.258   0.065
  173    HE2  PHE  22          2HE       PHE  22   1.718  -4.151  -1.850
  174    HZ   PHE  22           HZ       PHE  22  -0.436  -5.344  -1.891
  175    H    LEU  23           H        LEU  23   3.406  -4.226   2.306
  176    HA   LEU  23           HA       LEU  23   2.444  -6.839   1.907
  177    HB2  LEU  23          2HB       LEU  23   5.305  -5.892   1.912
  178    HB3  LEU  23          1HB       LEU  23   4.690  -7.337   1.131
  179    HG   LEU  23           HG       LEU  23   3.658  -4.630   0.367
  180   HD11  LEU  23          1HD1      LEU  23   6.093  -4.530   0.212
  181   HD12  LEU  23          2HD1      LEU  23   5.353  -4.556  -1.391
  182   HD13  LEU  23          3HD1      LEU  23   6.100  -6.015  -0.742
  183   HD21  LEU  23          1HD2      LEU  23   2.382  -6.469  -0.448
  184   HD22  LEU  23          2HD2      LEU  23   3.836  -7.315  -0.985
  185   HD23  LEU  23          3HD2      LEU  23   3.329  -5.833  -1.793
  186    H    SER  24           H        SER  24   5.061  -5.722   4.060
  187    HA   SER  24           HA       SER  24   5.629  -8.263   5.139
  188    HB2  SER  24          2HB       SER  24   6.208  -5.701   6.567
  189    HB3  SER  24          1HB       SER  24   7.118  -7.211   6.527
  190    HG   SER  24           HG       SER  24   7.061  -5.120   4.695
  191    H    TYR  25           H        TYR  25   3.333  -5.834   5.969
  192    HA   TYR  25           HA       TYR  25   2.959  -6.557   8.672
  193    HB2  TYR  25          2HB       TYR  25   1.540  -4.815   6.698
  194    HB3  TYR  25          1HB       TYR  25   0.641  -5.323   8.133
  195    HD1  TYR  25          1HD       TYR  25   4.222  -4.352   7.644
  196    HD2  TYR  25          2HD       TYR  25   0.549  -3.560   9.632
  197    HE1  TYR  25          1HE       TYR  25   5.328  -2.609   8.961
  198    HE2  TYR  25          2HE       TYR  25   1.642  -1.810  10.965
  199    HH   TYR  25           HH       TYR  25   3.977  -1.285  11.736
  200    H    ALA  26           H        ALA  26   1.010  -7.248   5.745
  201    HA   ALA  26           HA       ALA  26  -0.734  -8.945   7.278
  202    HB1  ALA  26          1HB       ALA  26  -0.508  -8.991   4.298
  203    HB2  ALA  26          2HB       ALA  26  -1.276  -7.654   5.161
  204    HB3  ALA  26          3HB       ALA  26  -1.922  -9.290   5.315
  205    H    GLN  27           H        GLN  27   1.287  -9.785   4.446
  206    HA   GLN  27           HA       GLN  27   1.331 -12.501   5.547
  207    HB2  GLN  27          2HB       GLN  27   1.588 -11.946   2.609
  208    HB3  GLN  27          1HB       GLN  27   1.113 -13.431   3.427
  209    HG2  GLN  27          2HG       GLN  27  -0.986 -12.317   4.178
  210    HG3  GLN  27          1HG       GLN  27  -0.539 -10.928   3.192
  211   HE21  GLN  27          1HE2      GLN  27  -0.796 -11.005   0.993
  212   HE22  GLN  27          2HE2      GLN  27  -1.583 -12.333   0.184
  213    H    GLY  28           H        GLY  28   3.221  -9.925   4.267
  214    HA2  GLY  28          2HA       GLY  28   5.536  -9.809   3.996
  215    HA3  GLY  28          1HA       GLY  28   5.647 -11.529   4.355
  216    H    GLN  29           H        GLN  29   3.233 -11.560   2.262
  217    HA   GLN  29           HA       GLN  29   4.950 -12.230   0.025
  218    HB2  GLN  29          2HB       GLN  29   1.951 -12.265  -0.056
  219    HB3  GLN  29          1HB       GLN  29   3.092 -13.306  -0.897
  220    HG2  GLN  29          2HG       GLN  29   3.690 -14.335   1.261
  221    HG3  GLN  29          1HG       GLN  29   2.461 -13.329   2.039
  222   HE21  GLN  29          1HE2      GLN  29   0.663 -13.600  -0.301
  223   HE22  GLN  29          2HE2      GLN  29  -0.011 -15.185  -0.175
  224    H    ASP  30           H        ASP  30   3.301 -11.635  -2.130
  225    HA   ASP  30           HA       ASP  30   3.914  -8.840  -2.487
  226    HB2  ASP  30          2HB       ASP  30   2.582 -10.805  -4.361
  227    HB3  ASP  30          1HB       ASP  30   3.086  -9.179  -4.797
  228    H    LYS  31           H        LYS  31   1.359 -10.300  -1.016
  229    HA   LYS  31           HA       LYS  31  -0.447  -8.136  -1.744
  230    HB2  LYS  31          2HB       LYS  31  -1.304 -11.038  -1.755
  231    HB3  LYS  31          1HB       LYS  31  -2.345  -9.648  -2.028
  232    HG2  LYS  31          2HG       LYS  31  -0.619  -9.184  -3.971
  233    HG3  LYS  31          1HG       LYS  31  -0.357 -10.911  -3.830
  234    HD2  LYS  31          2HD       LYS  31  -3.034  -9.597  -4.252
  235    HD3  LYS  31          1HD       LYS  31  -2.065 -10.360  -5.508
  236    HE2  LYS  31          2HE       LYS  31  -2.991 -11.801  -3.049
  237    HE3  LYS  31          1HE       LYS  31  -3.955 -11.686  -4.518
  238    HZ1  LYS  31          1HZ       LYS  31  -1.230 -12.857  -4.332
  239    HZ2  LYS  31          2HZ       LYS  31  -2.172 -12.773  -5.734
  240    HZ3  LYS  31          3HZ       LYS  31  -2.670 -13.739  -4.439
  241    H    VAL  32           H        VAL  32  -2.553  -8.565  -0.265
  242    HA   VAL  32           HA       VAL  32  -1.546  -9.163   2.420
  243    HB   VAL  32           HB       VAL  32  -2.625  -6.597   1.390
  244   HG11  VAL  32          1HG1      VAL  32  -2.831  -7.536   4.241
  245   HG12  VAL  32          2HG1      VAL  32  -4.147  -7.038   3.190
  246   HG13  VAL  32          3HG1      VAL  32  -2.964  -5.852   3.736
  247   HG21  VAL  32          1HG2      VAL  32  -0.413  -7.400   3.239
  248   HG22  VAL  32          2HG2      VAL  32  -0.830  -5.740   2.829
  249   HG23  VAL  32          3HG2      VAL  32  -0.268  -6.842   1.574
  250    H    THR  33           H        THR  33  -2.942  -9.887   3.896
  251    HA   THR  33           HA       THR  33  -5.413 -11.006   3.064
  252    HB   THR  33           HB       THR  33  -5.659 -11.486   5.542
  253    HG1  THR  33          1HG       THR  33  -3.695 -11.093   6.760
  254   HG21  THR  33          1HG2      THR  33  -3.830 -13.135   5.579
  255   HG22  THR  33          2HG2      THR  33  -3.096 -12.336   4.189
  256   HG23  THR  33          3HG2      THR  33  -4.667 -13.120   4.027
  257    H    GLU  34           H        GLU  34  -7.361 -10.608   4.637
  258    HA   GLU  34           HA       GLU  34  -8.400  -8.102   3.998
  259    HB2  GLU  34          2HB       GLU  34  -9.698 -10.141   4.460
  260    HB3  GLU  34          1HB       GLU  34  -9.345  -9.962   6.178
  261    HG2  GLU  34          2HG       GLU  34 -11.520  -9.112   5.820
  262    HG3  GLU  34          1HG       GLU  34 -10.466  -7.712   6.043
  263    H    ALA  35           H        ALA  35  -6.448  -9.001   6.702
  264    HA   ALA  35           HA       ALA  35  -7.607  -7.323   8.674
  265    HB1  ALA  35          1HB       ALA  35  -4.853  -8.544   8.601
  266    HB2  ALA  35          2HB       ALA  35  -6.303  -9.315   9.247
  267    HB3  ALA  35          3HB       ALA  35  -5.653  -7.868  10.018
  268    H    MET  36           H        MET  36  -4.482  -7.091   6.960
  269    HA   MET  36           HA       MET  36  -3.997  -4.443   7.831
  270    HB2  MET  36          2HB       MET  36  -2.782  -6.271   5.820
  271    HB3  MET  36          1HB       MET  36  -2.347  -4.578   5.800
  272    HG2  MET  36          2HG       MET  36  -2.093  -6.423   8.153
  273    HG3  MET  36          1HG       MET  36  -0.776  -5.915   7.093
  274    HE1  MET  36          1HE       MET  36  -0.878  -2.002   7.711
  275    HE2  MET  36          2HE       MET  36  -1.970  -2.842   6.609
  276    HE3  MET  36          3HE       MET  36  -0.266  -3.292   6.676
  277    H    ILE  37           H        ILE  37  -5.798  -5.873   5.269
  278    HA   ILE  37           HA       ILE  37  -5.810  -3.626   3.527
  279    HB   ILE  37           HB       ILE  37  -7.369  -6.114   3.760
  280   HG12  ILE  37          2HG1      ILE  37  -5.679  -6.583   2.361
  281   HG13  ILE  37          1HG1      ILE  37  -6.559  -5.620   1.211
  282   HG21  ILE  37          1HG2      ILE  37  -8.693  -5.366   1.790
  283   HG22  ILE  37          2HG2      ILE  37  -8.136  -3.722   2.106
  284   HG23  ILE  37          3HG2      ILE  37  -9.120  -4.568   3.301
  285   HD11  ILE  37          1HD1      ILE  37  -5.287  -3.653   1.797
  286   HD12  ILE  37          2HD1      ILE  37  -4.254  -4.966   1.245
  287   HD13  ILE  37          3HD1      ILE  37  -4.368  -4.609   2.963
  288    H    ASP  38           H        ASP  38  -7.834  -4.720   6.200
  289    HA   ASP  38           HA       ASP  38  -9.851  -2.769   6.002
  290    HB2  ASP  38          2HB       ASP  38 -10.279  -4.724   7.205
  291    HB3  ASP  38          1HB       ASP  38  -8.784  -4.603   8.102
  292    H    GLN  39           H        GLN  39  -6.746  -2.925   7.629
  293    HA   GLN  39           HA       GLN  39  -7.062  -0.703   9.295
  294    HB2  GLN  39          2HB       GLN  39  -4.895  -1.034   9.896
  295    HB3  GLN  39          1HB       GLN  39  -5.068  -2.513   8.974
  296    HG2  GLN  39          2HG       GLN  39  -3.045  -1.685   8.251
  297    HG3  GLN  39          1HG       GLN  39  -4.132  -1.127   6.994
  298   HE21  GLN  39          1HE2      GLN  39  -2.905   0.602   6.345
  299   HE22  GLN  39          2HE2      GLN  39  -2.623   1.984   7.345
  300    H    LEU  40           H        LEU  40  -5.855  -0.990   6.000
  301    HA   LEU  40           HA       LEU  40  -5.432   1.796   5.656
  302    HB2  LEU  40          2HB       LEU  40  -4.248   0.227   4.280
  303    HB3  LEU  40          1HB       LEU  40  -5.755  -0.428   3.628
  304    HG   LEU  40           HG       LEU  40  -5.895   2.271   3.029
  305   HD11  LEU  40          1HD1      LEU  40  -3.227   1.621   2.030
  306   HD12  LEU  40          2HD1      LEU  40  -3.319   1.862   3.776
  307   HD13  LEU  40          3HD1      LEU  40  -3.862   3.140   2.680
  308   HD21  LEU  40          1HD2      LEU  40  -6.548   0.466   1.543
  309   HD22  LEU  40          2HD2      LEU  40  -4.861  -0.015   1.351
  310   HD23  LEU  40          3HD2      LEU  40  -5.411   1.540   0.726
  311    H    ILE  41           H        ILE  41  -8.027  -0.387   4.502
  312    HA   ILE  41           HA       ILE  41  -9.448   1.615   3.148
  313    HB   ILE  41           HB       ILE  41 -10.341  -1.029   4.270
  314   HG12  ILE  41          2HG1      ILE  41  -8.723  -0.799   2.295
  315   HG13  ILE  41          1HG1      ILE  41 -10.134  -1.816   2.051
  316   HG21  ILE  41          1HG2      ILE  41 -11.953   0.909   2.614
  317   HG22  ILE  41          2HG2      ILE  41 -12.296   0.390   4.264
  318   HG23  ILE  41          3HG2      ILE  41 -12.402  -0.765   2.935
  319   HD11  ILE  41          1HD1      ILE  41  -9.809   1.021   1.110
  320   HD12  ILE  41          2HD1      ILE  41 -11.225  -0.001   0.841
  321   HD13  ILE  41          3HD1      ILE  41  -9.674  -0.428   0.114
  322    H    CYS  42           H        CYS  42  -9.900   0.399   6.473
  323    HA   CYS  42           HA       CYS  42 -12.107   2.155   6.978
  324    HB2  CYS  42          2HB       CYS  42 -11.800   0.012   8.191
  325    HB3  CYS  42          1HB       CYS  42 -10.350   0.665   8.946
  326    HG   CYS  42           HG       CYS  42 -11.924   2.827  10.109
  327    H    GLY  43           H        GLY  43  -8.723   2.436   6.935
  328    HA2  GLY  43          2HA       GLY  43  -8.122   4.468   8.687
  329    HA3  GLY  43          1HA       GLY  43  -7.383   4.269   7.108
  330    H    ALA  44           H        ALA  44  -9.298   4.940   5.316
  331    HA   ALA  44           HA       ALA  44  -9.691   7.771   5.932
  332    HB1  ALA  44          1HB       ALA  44 -10.201   6.372   3.313
  333    HB2  ALA  44          2HB       ALA  44  -8.651   7.080   3.768
  334    HB3  ALA  44          3HB       ALA  44 -10.077   8.110   3.593
  335    H    PHE  45           H        PHE  45 -11.616   5.083   4.601
  336    HA   PHE  45           HA       PHE  45 -13.999   6.484   5.591
  337    HB2  PHE  45          2HB       PHE  45 -14.956   4.588   3.891
  338    HB3  PHE  45          1HB       PHE  45 -14.804   6.320   3.574
  339    HD1  PHE  45          1HD       PHE  45 -12.639   3.307   3.553
  340    HD2  PHE  45          2HD       PHE  45 -13.799   6.857   1.538
  341    HE1  PHE  45          1HE       PHE  45 -11.097   2.753   1.708
  342    HE2  PHE  45          2HE       PHE  45 -12.251   6.329  -0.304
  343    HZ   PHE  45           HZ       PHE  45 -10.889   4.272  -0.216
  344    HA   PRO  46           HA       PRO  46 -14.451   2.786   7.970
  345    HB2  PRO  46          2HB       PRO  46 -15.254   4.008  10.209
  346    HB3  PRO  46          1HB       PRO  46 -13.560   3.958   9.729
  347    HG2  PRO  46          2HG       PRO  46 -15.498   6.206   9.572
  348    HG3  PRO  46          1HG       PRO  46 -13.747   6.253   9.825
  349    HD2  PRO  46          2HD       PRO  46 -15.123   6.664   7.365
  350    HD3  PRO  46          1HD       PRO  46 -13.371   6.486   7.597
  351    H    GLY  47           H        GLY  47 -16.505   2.560   9.705
  352    HA2  GLY  47          2HA       GLY  47 -18.784   2.287   9.882
  353    HA3  GLY  47          1HA       GLY  47 -18.969   3.633   8.765
  354    H    LEU  48           H        LEU  48 -17.021   0.945   7.846
  355    HA   LEU  48           HA       LEU  48 -18.980   0.303   5.771
  356    HB2  LEU  48          2HB       LEU  48 -16.075  -0.481   6.023
  357    HB3  LEU  48          1HB       LEU  48 -17.112  -0.877   4.669
  358    HG   LEU  48           HG       LEU  48 -16.062   1.833   5.462
  359   HD11  LEU  48          1HD1      LEU  48 -15.794   0.144   2.980
  360   HD12  LEU  48          2HD1      LEU  48 -14.542   0.462   4.181
  361   HD13  LEU  48          3HD1      LEU  48 -15.152   1.776   3.174
  362   HD21  LEU  48          1HD2      LEU  48 -18.393   2.121   4.849
  363   HD22  LEU  48          2HD2      LEU  48 -18.143   1.181   3.380
  364   HD23  LEU  48          3HD2      LEU  48 -17.347   2.741   3.574
  365    H    SER  49           H        SER  49 -20.234  -1.425   6.033
  366    HA   SER  49           HA       SER  49 -19.617  -3.580   7.793
  367    HB2  SER  49          2HB       SER  49 -21.533  -3.604   5.447
  368    HB3  SER  49          1HB       SER  49 -21.580  -4.642   6.872
  369    HG   SER  49           HG       SER  49 -21.885  -2.635   8.092
  370    H    TRP  50           H        TRP  50 -19.182  -5.871   6.945
  371    HA   TRP  50           HA       TRP  50 -16.779  -5.700   5.545
  372    HB2  TRP  50          2HB       TRP  50 -17.309  -7.572   7.077
  373    HB3  TRP  50          1HB       TRP  50 -18.420  -8.210   5.867
  374    HD1  TRP  50           HD       TRP  50 -14.658  -7.260   5.985
  375    HE1  TRP  50          1HE       TRP  50 -13.404  -8.964   4.506
  376    HE3  TRP  50          3HE       TRP  50 -18.645 -10.002   4.368
  377    HZ2  TRP  50          2HZ       TRP  50 -14.049 -11.168   2.915
  378    HZ3  TRP  50          3HZ       TRP  50 -18.235 -11.894   2.857
  379    HH2  TRP  50           HH       TRP  50 -15.975 -12.475   2.145
  380    H    GLU  51           H        GLU  51 -20.008  -6.438   4.330
  381    HA   GLU  51           HA       GLU  51 -19.126  -7.272   1.764
  382    HB2  GLU  51          2HB       GLU  51 -21.793  -6.203   2.675
  383    HB3  GLU  51          1HB       GLU  51 -21.489  -6.819   1.057
  384    HG2  GLU  51          2HG       GLU  51 -20.851  -8.984   2.055
  385    HG3  GLU  51          1HG       GLU  51 -21.283  -8.356   3.628
  386    H    GLN  52           H        GLN  52 -20.108  -4.123   3.044
  387    HA   GLN  52           HA       GLN  52 -19.881  -2.697   0.617
  388    HB2  GLN  52          2HB       GLN  52 -21.032  -1.764   2.557
  389    HB3  GLN  52          1HB       GLN  52 -19.534  -1.765   3.477
  390    HG2  GLN  52          2HG       GLN  52 -20.069   0.464   2.720
  391    HG3  GLN  52          1HG       GLN  52 -18.594  -0.110   1.944
  392   HE21  GLN  52          1HE2      GLN  52 -18.597  -0.535  -0.245
  393   HE22  GLN  52          2HE2      GLN  52 -19.869  -0.016  -1.298
  394    H    LEU  53           H        LEU  53 -17.564  -3.651   3.061
  395    HA   LEU  53           HA       LEU  53 -15.442  -2.070   1.971
  396    HB2  LEU  53          2HB       LEU  53 -15.504  -2.653   4.345
  397    HB3  LEU  53          1HB       LEU  53 -15.374  -4.351   3.945
  398    HG   LEU  53           HG       LEU  53 -13.197  -2.556   2.995
  399   HD11  LEU  53          1HD1      LEU  53 -13.473  -3.467   5.858
  400   HD12  LEU  53          2HD1      LEU  53 -13.542  -1.799   5.290
  401   HD13  LEU  53          3HD1      LEU  53 -12.044  -2.716   5.146
  402   HD21  LEU  53          1HD2      LEU  53 -11.833  -4.505   3.429
  403   HD22  LEU  53          2HD2      LEU  53 -13.243  -4.965   2.471
  404   HD23  LEU  53          3HD2      LEU  53 -13.197  -5.320   4.198
  405    H    GLN  54           H        GLN  54 -16.508  -5.428   1.688
  406    HA   GLN  54           HA       GLN  54 -14.256  -6.446   0.382
  407    HB2  GLN  54          2HB       GLN  54 -15.498  -8.354  -0.071
  408    HB3  GLN  54          1HB       GLN  54 -16.258  -7.707   1.356
  409    HG2  GLN  54          2HG       GLN  54 -18.043  -6.762   0.016
  410    HG3  GLN  54          1HG       GLN  54 -17.263  -7.339  -1.451
  411   HE21  GLN  54          1HE2      GLN  54 -17.452  -9.201   1.526
  412   HE22  GLN  54          2HE2      GLN  54 -18.539 -10.397   0.913
  413    H    GLU  55           H        GLU  55 -17.099  -4.784  -0.867
  414    HA   GLU  55           HA       GLU  55 -16.345  -5.105  -3.606
  415    HB2  GLU  55          2HB       GLU  55 -18.154  -3.477  -4.071
  416    HB3  GLU  55          1HB       GLU  55 -18.681  -4.842  -3.098
  417    HG2  GLU  55          2HG       GLU  55 -18.556  -3.460  -1.098
  418    HG3  GLU  55          1HG       GLU  55 -18.013  -2.111  -2.053
  419    H    LYS  56           H        LYS  56 -15.741  -2.745  -1.104
  420    HA   LYS  56           HA       LYS  56 -14.791  -0.578  -2.524
  421    HB2  LYS  56          2HB       LYS  56 -14.752  -1.288   0.100
  422    HB3  LYS  56          1HB       LYS  56 -13.044  -1.468  -0.301
  423    HG2  LYS  56          2HG       LYS  56 -13.326   0.732   0.522
  424    HG3  LYS  56          1HG       LYS  56 -13.150   0.882  -1.229
  425    HD2  LYS  56          2HD       LYS  56 -15.622   0.978  -1.424
  426    HD3  LYS  56          1HD       LYS  56 -15.731   0.949   0.336
  427    HE2  LYS  56          2HE       LYS  56 -15.925   3.216  -0.369
  428    HE3  LYS  56          1HE       LYS  56 -14.340   3.022   0.377
  429    HZ1  LYS  56          1HZ       LYS  56 -14.266   4.313  -1.692
  430    HZ2  LYS  56          2HZ       LYS  56 -14.860   2.983  -2.549
  431    HZ3  LYS  56          3HZ       LYS  56 -13.344   2.899  -1.805
  432    H    LYS  57           H        LYS  57 -12.964  -3.477  -1.583
  433    HA   LYS  57           HA       LYS  57 -10.779  -2.619  -3.344
  434    HB2  LYS  57          2HB       LYS  57  -9.932  -4.713  -1.684
  435    HB3  LYS  57          1HB       LYS  57  -9.455  -3.029  -1.599
  436    HG2  LYS  57          2HG       LYS  57 -10.218  -3.460   0.524
  437    HG3  LYS  57          1HG       LYS  57 -11.637  -2.752  -0.241
  438    HD2  LYS  57          2HD       LYS  57 -12.604  -4.578   0.694
  439    HD3  LYS  57          1HD       LYS  57 -12.119  -5.281  -0.846
  440    HE2  LYS  57          2HE       LYS  57 -10.118  -6.207   0.190
  441    HE3  LYS  57          1HE       LYS  57 -10.544  -5.449   1.713
  442    HZ1  LYS  57          1HZ       LYS  57 -12.718  -6.792   1.428
  443    HZ2  LYS  57          2HZ       LYS  57 -11.333  -7.553   2.020
  444    HZ3  LYS  57          3HZ       LYS  57 -11.786  -7.759   0.394
  445    H    LYS  58           H        LYS  58 -13.318  -4.393  -3.790
  446    HA   LYS  58           HA       LYS  58 -12.623  -7.001  -4.362
  447    HB2  LYS  58          2HB       LYS  58 -14.451  -7.027  -5.978
  448    HB3  LYS  58          1HB       LYS  58 -14.919  -6.167  -4.518
  449    HG2  LYS  58          2HG       LYS  58 -14.535  -4.037  -5.647
  450    HG3  LYS  58          1HG       LYS  58 -14.061  -4.902  -7.109
  451    HD2  LYS  58          2HD       LYS  58 -16.274  -5.859  -7.303
  452    HD3  LYS  58          1HD       LYS  58 -16.759  -5.111  -5.780
  453    HE2  LYS  58          2HE       LYS  58 -17.586  -3.852  -7.711
  454    HE3  LYS  58          1HE       LYS  58 -16.458  -2.900  -6.747
  455    HZ1  LYS  58          1HZ       LYS  58 -16.041  -2.659  -9.114
  456    HZ2  LYS  58          2HZ       LYS  58 -15.798  -4.323  -9.267
  457    HZ3  LYS  58          3HZ       LYS  58 -14.723  -3.394  -8.351
  458    H    GLY  59           H        GLY  59 -12.243  -8.048  -6.460
  459    HA2  GLY  59          2HA       GLY  59 -11.206  -7.945  -8.636
  460    HA3  GLY  59          1HA       GLY  59 -10.417  -6.453  -8.136
  461    H    ARG  60           H        ARG  60  -8.993  -6.716  -6.141
  462    HA   ARG  60           HA       ARG  60  -7.352  -9.117  -6.562
  463    HB2  ARG  60          2HB       ARG  60  -6.526  -6.557  -5.193
  464    HB3  ARG  60          1HB       ARG  60  -5.480  -7.867  -5.715
  465    HG2  ARG  60          2HG       ARG  60  -6.959  -5.894  -7.433
  466    HG3  ARG  60          1HG       ARG  60  -5.215  -6.087  -7.251
  467    HD2  ARG  60          2HD       ARG  60  -5.438  -8.360  -8.238
  468    HD3  ARG  60          1HD       ARG  60  -7.138  -8.012  -8.541
  469    HE   ARG  60           HE       ARG  60  -5.519  -5.976  -9.649
  470   HH11  ARG  60          1HH1      ARG  60  -6.455  -9.309 -10.172
  471   HH12  ARG  60          2HH1      ARG  60  -6.225  -9.236 -11.892
  472   HH21  ARG  60          1HH2      ARG  60  -5.197  -5.878 -11.907
  473   HH22  ARG  60          2HH2      ARG  60  -5.493  -7.288 -12.874
  474    H    ALA  61           H        ALA  61  -8.770  -7.090  -4.026
  475    HA   ALA  61           HA       ALA  61  -7.920  -9.063  -2.023
  476    HB1  ALA  61          1HB       ALA  61  -7.200  -6.784  -1.545
  477    HB2  ALA  61          2HB       ALA  61  -8.368  -7.335  -0.344
  478    HB3  ALA  61          3HB       ALA  61  -8.871  -6.232  -1.620
  479    H    ALA  62           H        ALA  62 -10.245  -8.792  -3.993
  480    HA   ALA  62           HA       ALA  62 -12.700  -8.732  -2.743
  481    HB1  ALA  62          1HB       ALA  62 -12.418  -8.985  -5.138
  482    HB2  ALA  62          2HB       ALA  62 -13.453 -10.264  -4.503
  483    HB3  ALA  62          3HB       ALA  62 -11.771 -10.605  -4.907
  484    H    ALA  63           H        ALA  63 -10.792 -11.685  -3.341
  485    HA   ALA  63           HA       ALA  63 -12.182 -12.995  -1.122
  486    HB1  ALA  63          1HB       ALA  63 -10.283 -14.144  -3.158
  487    HB2  ALA  63          2HB       ALA  63 -12.044 -14.208  -3.235
  488    HB3  ALA  63          3HB       ALA  63 -11.186 -15.051  -1.945
  489    H    ASN  64           H        ASN  64 -10.186 -10.887  -0.839
  490    HA   ASN  64           HA       ASN  64  -8.680 -10.301   0.722
  491    HB2  ASN  64          2HB       ASN  64  -8.740 -13.200   1.558
  492    HB3  ASN  64          1HB       ASN  64  -7.904 -11.913   2.427
  493   HD21  ASN  64          1HD2      ASN  64  -9.987 -10.004   1.622
  494   HD22  ASN  64          2HD2      ASN  64 -11.336 -10.312   2.663
  495    H    GLY  65           H        GLY  65  -7.204  -9.596  -0.466
  496    HA2  GLY  65          2HA       GLY  65  -4.649 -10.556  -0.473
  497    HA3  GLY  65          1HA       GLY  65  -5.352 -11.271  -1.916
  498    H    TYR  66           H        TYR  66  -5.233  -8.051  -0.326
  499    HA   TYR  66           HA       TYR  66  -5.452  -6.652  -2.793
  500    HB2  TYR  66          2HB       TYR  66  -5.480  -5.875  -0.137
  501    HB3  TYR  66          1HB       TYR  66  -3.966  -5.223  -0.731
  502    HD1  TYR  66          1HD       TYR  66  -4.976  -3.053  -0.085
  503    HD2  TYR  66          2HD       TYR  66  -6.595  -5.373  -3.245
  504    HE1  TYR  66          1HE       TYR  66  -6.108  -1.057  -0.930
  505    HE2  TYR  66          2HE       TYR  66  -7.743  -3.384  -4.110
  506    HH   TYR  66           HH       TYR  66  -7.027  -0.235  -3.042
  507    H    ASP  67           H        ASP  67  -4.065  -6.531  -4.326
  508    HA   ASP  67           HA       ASP  67  -1.371  -7.399  -3.910
  509    HB2  ASP  67          2HB       ASP  67  -1.526  -8.034  -6.060
  510    HB3  ASP  67          1HB       ASP  67  -3.228  -7.580  -5.958
  511    H    ARG  68           H        ARG  68   0.366  -6.182  -4.633
  512    HA   ARG  68           HA       ARG  68   0.458  -3.745  -3.284
  513    HB2  ARG  68          2HB       ARG  68   2.765  -3.564  -4.142
  514    HB3  ARG  68          1HB       ARG  68   2.410  -5.153  -3.484
  515    HG2  ARG  68          2HG       ARG  68   1.800  -5.470  -6.128
  516    HG3  ARG  68          1HG       ARG  68   3.179  -4.370  -6.177
  517    HD2  ARG  68          2HD       ARG  68   3.049  -7.065  -4.833
  518    HD3  ARG  68          1HD       ARG  68   3.980  -6.640  -6.267
  519    HE   ARG  68           HE       ARG  68   4.665  -6.110  -3.515
  520   HH11  ARG  68          1HH1      ARG  68   5.235  -5.280  -6.859
  521   HH12  ARG  68          2HH1      ARG  68   6.789  -4.564  -6.553
  522   HH21  ARG  68          1HH2      ARG  68   6.758  -5.230  -3.121
  523   HH22  ARG  68          2HH2      ARG  68   7.664  -4.571  -4.456
  524    H    SER  69           H        SER  69  -0.200  -4.410  -6.638
  525    HA   SER  69           HA       SER  69   0.167  -1.723  -7.533
  526    HB2  SER  69          2HB       SER  69  -1.622  -3.839  -8.744
  527    HB3  SER  69          1HB       SER  69  -0.928  -2.432  -9.550
  528    HG   SER  69           HG       SER  69   0.287  -4.833  -8.771
  529    H    ALA  70           H        ALA  70  -2.642  -3.653  -6.552
  530    HA   ALA  70           HA       ALA  70  -4.598  -1.650  -6.925
  531    HB1  ALA  70          1HB       ALA  70  -4.766  -3.878  -4.906
  532    HB2  ALA  70          2HB       ALA  70  -4.982  -4.141  -6.640
  533    HB3  ALA  70          3HB       ALA  70  -6.085  -3.079  -5.764
  534    H    PHE  71           H        PHE  71  -2.857  -2.772  -4.073
  535    HA   PHE  71           HA       PHE  71  -4.037  -1.040  -2.228
  536    HB2  PHE  71          2HB       PHE  71  -2.721  -2.983  -1.537
  537    HB3  PHE  71          1HB       PHE  71  -1.264  -2.262  -2.207
  538    HD1  PHE  71          1HD       PHE  71  -3.613  -2.242   0.563
  539    HD2  PHE  71          2HD       PHE  71  -0.183  -0.377  -1.098
  540    HE1  PHE  71          1HE       PHE  71  -3.179  -1.166   2.715
  541    HE2  PHE  71          2HE       PHE  71   0.259   0.703   1.062
  542    HZ   PHE  71           HZ       PHE  71  -1.237   0.321   2.964
  543    H    PHE  72           H        PHE  72  -1.063  -0.673  -4.172
  544    HA   PHE  72           HA       PHE  72  -0.417   1.848  -3.070
  545    HB2  PHE  72          2HB       PHE  72   1.279   0.480  -4.212
  546    HB3  PHE  72          1HB       PHE  72   0.435   0.728  -5.743
  547    HD1  PHE  72          1HD       PHE  72   1.814   2.747  -2.925
  548    HD2  PHE  72          2HD       PHE  72   1.223   2.389  -7.125
  549    HE1  PHE  72          1HE       PHE  72   3.055   4.841  -3.276
  550    HE2  PHE  72          2HE       PHE  72   2.468   4.481  -7.482
  551    HZ   PHE  72           HZ       PHE  72   3.384   5.710  -5.555
  552    H    SER  73           H        SER  73  -2.371   0.869  -5.779
  553    HA   SER  73           HA       SER  73  -2.629   3.331  -7.084
  554    HB2  SER  73          2HB       SER  73  -3.371   1.093  -7.962
  555    HB3  SER  73          1HB       SER  73  -4.755   1.183  -6.876
  556    HG   SER  73           HG       SER  73  -5.650   2.692  -8.097
  557    H    LEU  74           H        LEU  74  -4.373   1.952  -4.356
  558    HA   LEU  74           HA       LEU  74  -6.275   4.088  -4.158
  559    HB2  LEU  74          2HB       LEU  74  -6.818   1.852  -3.367
  560    HB3  LEU  74          1HB       LEU  74  -5.491   1.910  -2.226
  561    HG   LEU  74           HG       LEU  74  -6.624   3.568  -0.899
  562   HD11  LEU  74          1HD1      LEU  74  -7.662   4.862  -2.688
  563   HD12  LEU  74          2HD1      LEU  74  -8.858   4.382  -1.485
  564   HD13  LEU  74          3HD1      LEU  74  -8.765   3.528  -3.025
  565   HD21  LEU  74          1HD2      LEU  74  -7.218   1.309  -0.427
  566   HD22  LEU  74          2HD2      LEU  74  -8.365   1.281  -1.763
  567   HD23  LEU  74          3HD2      LEU  74  -8.689   2.280  -0.343
  568    H    VAL  75           H        VAL  75  -3.259   3.246  -2.511
  569    HA   VAL  75           HA       VAL  75  -3.498   5.282  -0.525
  570    HB   VAL  75           HB       VAL  75  -0.956   3.885  -1.389
  571   HG11  VAL  75          1HG1      VAL  75  -0.255   5.507   0.036
  572   HG12  VAL  75          2HG1      VAL  75  -0.570   4.173   1.149
  573   HG13  VAL  75          3HG1      VAL  75  -1.740   5.480   0.977
  574   HG21  VAL  75          1HG2      VAL  75  -2.410   2.112  -0.872
  575   HG22  VAL  75          2HG2      VAL  75  -3.123   2.992   0.481
  576   HG23  VAL  75          3HG2      VAL  75  -1.465   2.395   0.595
  577    H    ALA  76           H        ALA  76  -1.933   5.083  -3.670
  578    HA   ALA  76           HA       ALA  76  -0.275   7.329  -3.446
  579    HB1  ALA  76          1HB       ALA  76  -1.504   6.176  -5.937
  580    HB2  ALA  76          2HB       ALA  76  -0.016   5.621  -5.173
  581    HB3  ALA  76          3HB       ALA  76  -0.101   7.242  -5.861
  582    H    SER  77           H        SER  77  -3.668   7.055  -4.108
  583    HA   SER  77           HA       SER  77  -3.839   9.828  -4.979
  584    HB2  SER  77          2HB       SER  77  -6.337   9.192  -5.125
  585    HB3  SER  77          1HB       SER  77  -5.226   8.436  -6.265
  586    HG   SER  77           HG       SER  77  -5.996   7.252  -3.799
  587    H    ASP  78           H        ASP  78  -3.957   8.074  -2.102
  588    HA   ASP  78           HA       ASP  78  -5.547  10.173  -0.783
  589    HB2  ASP  78          2HB       ASP  78  -5.502   7.197  -0.423
  590    HB3  ASP  78          1HB       ASP  78  -5.937   8.237   0.933
  591    H    GLU  79           H        GLU  79  -4.027  11.481   0.107
  592    HA   GLU  79           HA       GLU  79  -1.461  10.633   0.901
  593    HB2  GLU  79          2HB       GLU  79  -1.046  12.794   1.467
  594    HB3  GLU  79          1HB       GLU  79  -2.408  13.026   0.386
  595    HG2  GLU  79          2HG       GLU  79  -3.903  13.299   2.246
  596    HG3  GLU  79          1HG       GLU  79  -2.613  12.877   3.384
  597    H    GLN  80           H        GLN  80  -4.484  10.777   2.703
  598    HA   GLN  80           HA       GLN  80  -3.275  10.644   5.261
  599    HB2  GLN  80          2HB       GLN  80  -5.407  10.354   6.129
  600    HB3  GLN  80          1HB       GLN  80  -5.721  11.145   4.593
  601    HG2  GLN  80          2HG       GLN  80  -5.770   8.210   4.619
  602    HG3  GLN  80          1HG       GLN  80  -7.115   9.083   5.364
  603   HE21  GLN  80          1HE2      GLN  80  -7.050   7.483   2.942
  604   HE22  GLN  80          2HE2      GLN  80  -7.579   8.538   1.676
  605    H    TYR  81           H        TYR  81  -3.654   8.446   2.756
  606    HA   TYR  81           HA       TYR  81  -3.503   6.054   4.369
  607    HB2  TYR  81          2HB       TYR  81  -3.792   6.577   1.433
  608    HB3  TYR  81          1HB       TYR  81  -3.268   4.994   1.996
  609    HD1  TYR  81          1HD       TYR  81  -5.639   5.002   0.444
  610    HD2  TYR  81          2HD       TYR  81  -5.230   5.885   4.580
  611    HE1  TYR  81          1HE       TYR  81  -7.963   4.261   0.828
  612    HE2  TYR  81          2HE       TYR  81  -7.531   5.183   4.959
  613    HH   TYR  81           HH       TYR  81  -9.312   3.426   2.739
  614    H    VAL  82           H        VAL  82  -1.447   7.923   2.167
  615    HA   VAL  82           HA       VAL  82   0.692   6.153   2.212
  616    HB   VAL  82           HB       VAL  82   1.989   8.077   1.503
  617   HG11  VAL  82          1HG1      VAL  82   0.760   8.554  -0.607
  618   HG12  VAL  82          2HG1      VAL  82  -0.581   7.635   0.084
  619   HG13  VAL  82          3HG1      VAL  82   0.966   6.844  -0.223
  620   HG21  VAL  82          1HG2      VAL  82   1.248   9.944   2.559
  621   HG22  VAL  82          2HG2      VAL  82  -0.423   9.631   2.093
  622   HG23  VAL  82          3HG2      VAL  82   0.745  10.170   0.883
  623    H    ARG  83           H        ARG  83   0.104   9.097   4.036
  624    HA   ARG  83           HA       ARG  83   2.183   8.682   5.883
  625    HB2  ARG  83          2HB       ARG  83   1.063  10.378   7.299
  626    HB3  ARG  83          1HB       ARG  83   1.376  10.908   5.662
  627    HG2  ARG  83          2HG       ARG  83  -1.041  10.169   5.205
  628    HG3  ARG  83          1HG       ARG  83  -1.229  10.207   6.959
  629    HD2  ARG  83          2HD       ARG  83  -0.857  12.353   4.977
  630    HD3  ARG  83          1HD       ARG  83  -1.910  12.299   6.381
  631    HE   ARG  83           HE       ARG  83   0.692  12.380   7.344
  632   HH11  ARG  83          1HH1      ARG  83  -1.444  14.434   5.466
  633   HH12  ARG  83          2HH1      ARG  83  -0.711  15.906   6.018
  634   HH21  ARG  83          1HH2      ARG  83   1.656  14.323   8.064
  635   HH22  ARG  83          2HH2      ARG  83   1.041  15.845   7.496
  636    H    PHE  84           H        PHE  84  -1.076   7.438   5.730
  637    HA   PHE  84           HA       PHE  84  -1.349   6.668   8.419
  638    HB2  PHE  84          2HB       PHE  84  -2.811   6.162   6.152
  639    HB3  PHE  84          1HB       PHE  84  -2.139   4.567   6.500
  640    HD1  PHE  84          1HD       PHE  84  -2.798   3.349   8.462
  641    HD2  PHE  84          2HD       PHE  84  -4.355   7.231   7.693
  642    HE1  PHE  84          1HE       PHE  84  -4.538   2.985  10.164
  643    HE2  PHE  84          2HE       PHE  84  -6.095   6.877   9.396
  644    HZ   PHE  84           HZ       PHE  84  -6.188   4.750  10.633
  645    H    ILE  85           H        ILE  85   0.257   5.032   5.720
  646    HA   ILE  85           HA       ILE  85   1.346   3.010   7.455
  647    HB   ILE  85           HB       ILE  85   1.680   3.571   4.544
  648   HG12  ILE  85          2HG1      ILE  85   0.836   1.198   6.224
  649   HG13  ILE  85          1HG1      ILE  85  -0.207   2.218   5.241
  650   HG21  ILE  85          1HG2      ILE  85   3.315   1.634   4.518
  651   HG22  ILE  85          2HG2      ILE  85   3.470   1.861   6.259
  652   HG23  ILE  85          3HG2      ILE  85   3.939   3.156   5.156
  653   HD11  ILE  85          1HD1      ILE  85   0.846   1.371   3.225
  654   HD12  ILE  85          2HD1      ILE  85   0.204   0.056   4.205
  655   HD13  ILE  85          3HD1      ILE  85   1.938   0.374   4.191
  656    H    ALA  86           H        ALA  86   2.783   5.756   5.671
  657    HA   ALA  86           HA       ALA  86   5.363   5.592   6.514
  658    HB1  ALA  86          1HB       ALA  86   3.948   8.230   6.496
  659    HB2  ALA  86          2HB       ALA  86   4.256   7.323   5.015
  660    HB3  ALA  86          3HB       ALA  86   5.605   7.848   6.020
  661    H    GLN  87           H        GLN  87   2.656   6.916   8.366
  662    HA   GLN  87           HA       GLN  87   4.224   7.720  10.596
  663    HB2  GLN  87          2HB       GLN  87   1.948   8.608  10.041
  664    HB3  GLN  87          1HB       GLN  87   1.276   7.054  10.525
  665    HG2  GLN  87          2HG       GLN  87   2.175   7.401  12.787
  666    HG3  GLN  87          1HG       GLN  87   2.770   8.984  12.288
  667   HE21  GLN  87          1HE2      GLN  87  -0.022   7.080  13.047
  668   HE22  GLN  87          2HE2      GLN  87  -1.142   8.391  13.155
  669    H    HIS  88           H        HIS  88   2.371   4.901   9.704
  670    HA   HIS  88           HA       HIS  88   2.459   3.462  12.130
  671    HB2  HIS  88          2HB       HIS  88   1.283   3.169   9.640
  672    HB3  HIS  88          1HB       HIS  88   2.450   1.855   9.678
  673    HD1  HIS  88          1HD       HIS  88   2.089   1.141  12.737
  674    HD2  HIS  88          2HD       HIS  88  -0.973   1.688   9.960
  675    HE1  HIS  88          1HE       HIS  88   0.117  -0.128  13.643
  676    HE2  HIS  88          2HE       HIS  88  -1.752   0.313  12.014
  677    H    PHE  89           H        PHE  89   4.482   3.462   9.251
  678    HA   PHE  89           HA       PHE  89   6.630   2.081  10.638
  679    HB2  PHE  89          2HB       PHE  89   5.095   0.335   9.684
  680    HB3  PHE  89          1HB       PHE  89   5.421   0.992   8.088
  681    HD1  PHE  89          1HD       PHE  89   7.153   0.121   6.834
  682    HD2  PHE  89          2HD       PHE  89   7.156  -0.419  11.053
  683    HE1  PHE  89          1HE       PHE  89   9.101  -1.369   6.639
  684    HE2  PHE  89          2HE       PHE  89   9.105  -1.903  10.865
  685    HZ   PHE  89           HZ       PHE  89  10.079  -2.383   8.658
  686    HA   PRO  90           HA       PRO  90   8.668   5.206   8.059
  687    HB2  PRO  90          2HB       PRO  90  11.014   3.837   9.263
  688    HB3  PRO  90          1HB       PRO  90  10.626   5.560   9.207
  689    HG2  PRO  90          2HG       PRO  90  10.370   4.186  11.473
  690    HG3  PRO  90          1HG       PRO  90   9.188   5.432  11.024
  691    HD2  PRO  90          2HD       PRO  90   8.961   2.453  10.851
  692    HD3  PRO  90          1HD       PRO  90   7.740   3.657  11.321
  693    H    CYS  91           H        CYS  91   9.874   5.111   6.171
  694    HA   CYS  91           HA       CYS  91   9.685   2.861   4.554
  695    HB2  CYS  91          2HB       CYS  91  10.002   4.915   3.436
  696    HB3  CYS  91          1HB       CYS  91  11.408   5.315   4.406
  697    HG   CYS  91           HG       CYS  91  13.031   3.307   3.267
  698    H    ALA  92           H        ALA  92  10.792   1.135   4.260
  699    HA   ALA  92           HA       ALA  92  12.552   0.332   6.340
  700    HB1  ALA  92          1HB       ALA  92  10.957  -1.199   5.258
  701    HB2  ALA  92          2HB       ALA  92  12.613  -1.815   5.273
  702    HB3  ALA  92          3HB       ALA  92  11.933  -1.139   3.788
  703    HA   PRO  93           HA       PRO  93  16.484   1.225   4.536
  704    HB2  PRO  93          2HB       PRO  93  18.007  -0.340   6.050
  705    HB3  PRO  93          1HB       PRO  93  17.181   1.057   6.738
  706    HG2  PRO  93          2HG       PRO  93  16.438  -1.838   6.853
  707    HG3  PRO  93          1HG       PRO  93  16.374  -0.618   8.138
  708    HD2  PRO  93          2HD       PRO  93  14.197  -1.415   6.664
  709    HD3  PRO  93          1HD       PRO  93  14.347   0.178   7.439
  710    H    GLU  94           H        GLU  94  14.963  -0.685   3.079
  711    HA   GLU  94           HA       GLU  94  16.579  -2.955   2.504
  712    HB2  GLU  94          2HB       GLU  94  14.220  -1.757   1.034
  713    HB3  GLU  94          1HB       GLU  94  14.985  -3.289   0.620
  714    HG2  GLU  94          2HG       GLU  94  14.446  -4.134   2.874
  715    HG3  GLU  94          1HG       GLU  94  13.602  -2.627   3.210
  716    H    GLU  95           H        GLU  95  18.440  -2.696   1.667
  717    HA   GLU  95           HA       GLU  95  19.243  -0.205   0.566
  718    HB2  GLU  95          2HB       GLU  95  20.831  -2.739   0.881
  719    HB3  GLU  95          1HB       GLU  95  21.489  -1.132   0.621
  720    HG2  GLU  95          2HG       GLU  95  20.607  -0.426   2.771
  721    HG3  GLU  95          1HG       GLU  95  19.894  -2.023   2.990
  722    H    GLU  96           H        GLU  96  20.158  -3.372  -0.801
  723    HA   GLU  96           HA       GLU  96  19.956  -2.079  -3.444
  724    HB2  GLU  96          2HB       GLU  96  22.280  -2.245  -2.606
  725    HB3  GLU  96          1HB       GLU  96  22.100  -3.990  -2.510
  726    HG2  GLU  96          2HG       GLU  96  21.704  -4.038  -4.951
  727    HG3  GLU  96          1HG       GLU  96  22.022  -2.304  -5.000
  728    H    LYS  97           H        LYS  97  19.311  -4.908  -1.571
  729    HA   LYS  97           HA       LYS  97  19.231  -6.821  -3.617
  730    HB2  LYS  97          2HB       LYS  97  17.735  -6.746  -1.001
  731    HB3  LYS  97          1HB       LYS  97  17.778  -8.137  -2.071
  732    HG2  LYS  97          2HG       LYS  97  20.140  -6.873  -0.694
  733    HG3  LYS  97          1HG       LYS  97  19.373  -8.401  -0.270
  734    HD2  LYS  97          2HD       LYS  97  20.727  -7.816  -2.904
  735    HD3  LYS  97          1HD       LYS  97  21.462  -8.688  -1.562
  736    HE2  LYS  97          2HE       LYS  97  18.951  -9.538  -3.000
  737    HE3  LYS  97          1HE       LYS  97  20.561 -10.177  -3.324
  738    HZ1  LYS  97          1HZ       LYS  97  20.655 -11.000  -1.059
  739    HZ2  LYS  97          2HZ       LYS  97  19.302 -11.623  -1.857
  740    HZ3  LYS  97          3HZ       LYS  97  19.119 -10.373  -0.736
  741    HA   PRO  98           HA       PRO  98  14.488  -5.654  -4.151
  742    HB2  PRO  98          2HB       PRO  98  14.743  -2.753  -3.579
  743    HB3  PRO  98          1HB       PRO  98  13.413  -3.857  -3.222
  744    HG2  PRO  98          2HG       PRO  98  15.014  -2.989  -1.288
  745    HG3  PRO  98          1HG       PRO  98  14.423  -4.662  -1.297
  746    HD2  PRO  98          2HD       PRO  98  17.106  -3.591  -2.075
  747    HD3  PRO  98          1HD       PRO  98  16.698  -5.068  -1.182
  748    HA   PRO  99           HA       PRO  99  15.059  -4.530  -8.364
  749    HB2  PRO  99          2HB       PRO  99  13.112  -2.315  -7.819
  750    HB3  PRO  99          1HB       PRO  99  13.195  -3.413  -9.201
  751    HG2  PRO  99          2HG       PRO  99  11.460  -3.860  -7.240
  752    HG3  PRO  99          1HG       PRO  99  12.333  -5.205  -7.996
  753    HD2  PRO  99          2HD       PRO  99  12.678  -4.005  -5.313
  754    HD3  PRO  99          1HD       PRO  99  13.049  -5.646  -5.873
  755    H    GLU 100           H        GLU 100  14.683  -1.558  -6.417
  756    HA   GLU 100           HA       GLU 100  17.246  -0.638  -7.502
  757    HB2  GLU 100          2HB       GLU 100  15.389   0.510  -8.706
  758    HB3  GLU 100          1HB       GLU 100  14.812   1.126  -7.171
  759    HG2  GLU 100          2HG       GLU 100  16.041   2.822  -8.328
  760    HG3  GLU 100          1HG       GLU 100  16.883   2.335  -6.864
  761    H    ILE 101           H        ILE 101  14.959   1.007  -5.362
  762    HA   ILE 101           HA       ILE 101  16.748   0.457  -3.083
  763    HB   ILE 101           HB       ILE 101  14.789   2.759  -3.241
  764   HG12  ILE 101          2HG1      ILE 101  16.501   3.021  -5.020
  765   HG13  ILE 101          1HG1      ILE 101  16.650   4.241  -3.769
  766   HG21  ILE 101          1HG2      ILE 101  16.120   3.657  -1.393
  767   HG22  ILE 101          2HG2      ILE 101  17.157   2.231  -1.450
  768   HG23  ILE 101          3HG2      ILE 101  15.458   2.069  -1.005
  769   HD11  ILE 101          1HD1      ILE 101  18.366   1.816  -4.074
  770   HD12  ILE 101          2HD1      ILE 101  18.467   2.997  -2.767
  771   HD13  ILE 101          3HD1      ILE 101  18.799   3.489  -4.422
  772    H    ASP 102           H        ASP 102  13.401   1.489  -3.643
  773    HA   ASP 102           HA       ASP 102  12.315  -1.054  -3.016
  774    HB2  ASP 102          2HB       ASP 102  12.636  -0.432  -0.693
  775    HB3  ASP 102          1HB       ASP 102  11.877   1.131  -0.937
  776    H    ALA 103           H        ALA 103  11.671   2.419  -3.183
  777    HA   ALA 103           HA       ALA 103   8.950   2.101  -3.969
  778    HB1  ALA 103          1HB       ALA 103  10.792   4.484  -4.027
  779    HB2  ALA 103          2HB       ALA 103   9.547   4.110  -2.832
  780    HB3  ALA 103          3HB       ALA 103   9.087   4.550  -4.481
  781    H    LEU 104           H        LEU 104   8.036   2.145  -5.899
  782    HA   LEU 104           HA       LEU 104   7.603   2.560  -8.067
  783    HB2  LEU 104          2HB       LEU 104  10.431   3.513  -8.328
  784    HB3  LEU 104          1HB       LEU 104   9.101   3.868  -9.413
  785    HG   LEU 104           HG       LEU 104   9.627   4.952  -6.653
  786   HD11  LEU 104          1HD1      LEU 104   9.310   7.111  -7.806
  787   HD12  LEU 104          2HD1      LEU 104   9.175   6.237  -9.333
  788   HD13  LEU 104          3HD1      LEU 104  10.676   6.176  -8.408
  789   HD21  LEU 104          1HD2      LEU 104   7.303   4.336  -6.633
  790   HD22  LEU 104          2HD2      LEU 104   7.040   5.130  -8.187
  791   HD23  LEU 104          3HD2      LEU 104   7.447   6.087  -6.761
  792    H    GLU 105           H        GLU 105  10.698   1.126  -7.321
  793    HA   GLU 105           HA       GLU 105  11.670  -0.833  -7.857
  794    HB2  GLU 105          2HB       GLU 105   8.878  -1.568  -8.717
  795    HB3  GLU 105          1HB       GLU 105  10.198  -2.709  -8.502
  796    HG2  GLU 105          2HG       GLU 105  10.328  -2.189  -6.156
  797    HG3  GLU 105          1HG       GLU 105   9.114  -0.924  -6.338
  798    H    LEU 106           H        LEU 106   9.310  -0.753 -10.509
  799    HA   LEU 106           HA       LEU 106  11.215  -1.752 -12.356
  800    HB2  LEU 106          2HB       LEU 106   8.437  -0.649 -12.655
  801    HB3  LEU 106          1HB       LEU 106   9.393  -1.097 -14.052
  802    HG   LEU 106           HG       LEU 106   7.901  -2.896 -13.539
  803   HD11  LEU 106          1HD1      LEU 106  10.131  -3.512 -14.305
  804   HD12  LEU 106          2HD1      LEU 106   9.460  -4.732 -13.224
  805   HD13  LEU 106          3HD1      LEU 106  10.682  -3.609 -12.633
  806   HD21  LEU 106          1HD2      LEU 106   7.441  -2.394 -11.209
  807   HD22  LEU 106          2HD2      LEU 106   9.075  -2.888 -10.763
  808   HD23  LEU 106          3HD2      LEU 106   7.935  -4.076 -11.396
  809    H    LYS 107           H        LYS 107   9.791   1.471 -11.884
  810    HA   LYS 107           HA       LYS 107  12.049   2.583 -13.338
  811    HB2  LYS 107          2HB       LYS 107  10.478   4.052 -14.675
  812    HB3  LYS 107          1HB       LYS 107  10.557   2.363 -15.149
  813    HG2  LYS 107          2HG       LYS 107   8.467   1.929 -13.959
  814    HG3  LYS 107          1HG       LYS 107   8.389   3.625 -13.478
  815    HD2  LYS 107          2HD       LYS 107   6.949   3.178 -15.406
  816    HD3  LYS 107          1HD       LYS 107   8.250   4.294 -15.824
  817    HE2  LYS 107          2HE       LYS 107   9.484   2.519 -16.895
  818    HE3  LYS 107          1HE       LYS 107   8.304   1.324 -16.360
  819    HZ1  LYS 107          1HZ       LYS 107   7.710   3.572 -18.212
  820    HZ2  LYS 107          2HZ       LYS 107   6.653   2.330 -17.763
  821    HZ3  LYS 107          3HZ       LYS 107   8.020   1.981 -18.695
  822    H    THR 108           H        THR 108  12.883   3.829 -11.825
  823    HA   THR 108           HA       THR 108  11.282   5.549 -10.159
  824    HB   THR 108           HB       THR 108  14.281   5.500 -10.621
  825    HG1  THR 108          1HG       THR 108  13.024   3.668  -9.523
  826   HG21  THR 108          1HG2      THR 108  14.436   6.816  -8.559
  827   HG22  THR 108          2HG2      THR 108  12.678   6.893  -8.469
  828   HG23  THR 108          3HG2      THR 108  13.527   7.685  -9.797
  829    H    GLN 109           H        GLN 109  13.114   5.738 -13.126
  830    HA   GLN 109           HA       GLN 109  12.852   8.550 -13.519
  831    HB2  GLN 109          2HB       GLN 109  13.254   6.325 -15.536
  832    HB3  GLN 109          1HB       GLN 109  13.450   8.042 -15.863
  833    HG2  GLN 109          2HG       GLN 109  15.086   6.465 -13.892
  834    HG3  GLN 109          1HG       GLN 109  15.583   6.862 -15.534
  835   HE21  GLN 109          1HE2      GLN 109  15.029   8.077 -12.334
  836   HE22  GLN 109          2HE2      GLN 109  15.804   9.606 -12.558
  837    H    LYS 110           H        LYS 110  11.437   9.568 -15.094
  838    HA   LYS 110           HA       LYS 110   8.750   8.605 -14.849
  839    HB2  LYS 110          2HB       LYS 110   9.347  11.020 -14.773
  840    HB3  LYS 110          1HB       LYS 110   9.778  10.935 -16.475
  841    HG2  LYS 110          2HG       LYS 110   7.450  10.246 -16.978
  842    HG3  LYS 110          1HG       LYS 110   7.053  10.499 -15.277
  843    HD2  LYS 110          2HD       LYS 110   7.739  12.849 -15.485
  844    HD3  LYS 110          1HD       LYS 110   8.091  12.584 -17.193
  845    HE2  LYS 110          2HE       LYS 110   5.733  11.943 -17.544
  846    HE3  LYS 110          1HE       LYS 110   5.407  12.315 -15.852
  847    HZ1  LYS 110          1HZ       LYS 110   4.787  14.161 -17.240
  848    HZ2  LYS 110          2HZ       LYS 110   6.332  14.229 -17.919
  849    HZ3  LYS 110          3HZ       LYS 110   6.113  14.604 -16.287
  850    H    GLY 111           H        GLY 111   9.182   6.565 -15.964
  851    HA2  GLY 111          2HA       GLY 111   9.490   6.640 -18.839
  852    HA3  GLY 111          1HA       GLY 111   9.202   5.214 -17.851
  853    H    PHE 112           H        PHE 112   7.645   8.076 -19.195
  854    HA   PHE 112           HA       PHE 112   5.112   6.577 -19.248
  855    HB2  PHE 112          2HB       PHE 112   5.025   8.460 -17.655
  856    HB3  PHE 112          1HB       PHE 112   5.486   9.568 -18.941
  857    HD1  PHE 112          1HD       PHE 112   3.862  10.557 -20.288
  858    HD2  PHE 112          2HD       PHE 112   2.845   7.173 -17.918
  859    HE1  PHE 112          1HE       PHE 112   1.491  10.877 -20.857
  860    HE2  PHE 112          2HE       PHE 112   0.472   7.485 -18.485
  861    HZ   PHE 112           HZ       PHE 112  -0.208   9.340 -19.955
  Start of MODEL   12
    1    H1   GLY   1          1HT       GLY   1  -5.761  13.995  -3.972
    2    H2   GLY   1          2HT       GLY   1  -6.119  15.109  -2.755
    3    H    GLY   1           H        GLY   1  -6.289  14.722  -3.528
    4    H3   GLY   1          3HT       GLY   1  -5.049  13.841  -2.447
    5    HA2  GLY   1          1HA       GLY   1  -3.794  15.838  -2.748
    6    HA3  GLY   1          2HA       GLY   1  -3.502  14.744  -4.091
    7    H    SER   2           H        SER   2  -2.828  17.147  -4.719
    8    HA   SER   2           HA       SER   2  -5.009  18.847  -5.484
    9    HB2  SER   2          2HB       SER   2  -2.069  19.069  -6.161
   10    HB3  SER   2          1HB       SER   2  -3.276  20.348  -6.311
   11    HG   SER   2           HG       SER   2  -3.487  19.529  -3.855
   12    H    ALA   3           H        ALA   3  -2.835  16.616  -7.142
   13    HA   ALA   3           HA       ALA   3  -4.561  16.699  -9.477
   14    HB1  ALA   3          1HB       ALA   3  -1.631  17.361  -9.709
   15    HB2  ALA   3          2HB       ALA   3  -2.959  18.505  -9.897
   16    HB3  ALA   3          3HB       ALA   3  -2.770  17.178 -11.043
   17    H    MET   4           H        MET   4  -5.025  14.601  -9.577
   18    HA   MET   4           HA       MET   4  -4.813  12.387  -9.987
   19    HB2  MET   4          2HB       MET   4  -2.155  13.366 -10.971
   20    HB3  MET   4          1HB       MET   4  -2.512  11.647 -10.944
   21    HG2  MET   4          2HG       MET   4  -2.967  12.481 -13.126
   22    HG3  MET   4          1HG       MET   4  -4.497  12.081 -12.353
   23    HE1  MET   4          1HE       MET   4  -5.770  13.447 -14.240
   24    HE2  MET   4          2HE       MET   4  -4.231  13.865 -14.996
   25    HE3  MET   4          3HE       MET   4  -5.413  15.127 -14.643
   26    H    GLY   5           H        GLY   5  -3.187  10.421  -9.561
   27    HA2  GLY   5          2HA       GLY   5  -2.358  10.711  -6.744
   28    HA3  GLY   5          1HA       GLY   5  -3.130   9.269  -7.387
   29    H    HIS   6           H        HIS   6  -0.424  11.289  -8.511
   30    HA   HIS   6           HA       HIS   6   1.263   8.871  -8.429
   31    HB2  HIS   6          2HB       HIS   6   1.336  11.278 -10.236
   32    HB3  HIS   6          1HB       HIS   6   2.762  10.273 -10.009
   33    HD1  HIS   6          1HD       HIS   6   2.964   8.333 -11.528
   34    HD2  HIS   6          2HD       HIS   6  -0.949   9.717 -11.283
   35    HE1  HIS   6          1HE       HIS   6   1.664   6.980 -13.203
   36    HE2  HIS   6          2HE       HIS   6  -0.685   7.892 -13.098
   37    H    MET   7           H        MET   7   0.846  12.140  -7.421
   38    HA   MET   7           HA       MET   7   2.862  11.785  -5.377
   39    HB2  MET   7          2HB       MET   7   4.141  12.765  -7.244
   40    HB3  MET   7          1HB       MET   7   2.991  14.091  -7.335
   41    HG2  MET   7          2HG       MET   7   3.630  14.813  -5.102
   42    HG3  MET   7          1HG       MET   7   4.760  13.469  -4.981
   43    HE1  MET   7          1HE       MET   7   3.916  16.851  -6.757
   44    HE2  MET   7          2HE       MET   7   4.017  15.747  -8.128
   45    HE3  MET   7          3HE       MET   7   5.237  17.001  -7.915
   46    H    VAL   8           H        VAL   8   2.056  12.544  -3.527
   47    HA   VAL   8           HA       VAL   8   0.407  14.906  -3.513
   48    HB   VAL   8           HB       VAL   8  -1.370  13.391  -3.732
   49   HG11  VAL   8          1HG1      VAL   8  -0.333  11.649  -1.516
   50   HG12  VAL   8          2HG1      VAL   8   0.044  11.358  -3.211
   51   HG13  VAL   8          3HG1      VAL   8  -1.631  11.316  -2.660
   52   HG21  VAL   8          1HG2      VAL   8  -1.021  13.933  -0.793
   53   HG22  VAL   8          2HG2      VAL   8  -2.533  13.475  -1.573
   54   HG23  VAL   8          3HG2      VAL   8  -1.762  15.007  -1.979
   55    H    LYS   9           H        LYS   9   1.007  12.409  -1.206
   56    HA   LYS   9           HA       LYS   9   2.881  14.155   0.209
   57    HB2  LYS   9          2HB       LYS   9   0.837  12.315   1.520
   58    HB3  LYS   9          1HB       LYS   9   2.134  13.159   2.368
   59    HG2  LYS   9          2HG       LYS   9  -0.183  14.411   0.925
   60    HG3  LYS   9          1HG       LYS   9   0.070  14.352   2.665
   61    HD2  LYS   9          2HD       LYS   9   1.982  15.801   2.496
   62    HD3  LYS   9          1HD       LYS   9   1.931  15.742   0.736
   63    HE2  LYS   9          2HE       LYS   9   0.978  17.809   1.300
   64    HE3  LYS   9          1HE       LYS   9  -0.389  16.765   0.920
   65    HZ1  LYS   9          1HZ       LYS   9   0.574  17.451   3.642
   66    HZ2  LYS   9          2HZ       LYS   9  -0.722  16.414   3.302
   67    HZ3  LYS   9          3HZ       LYS   9  -0.816  18.057   2.896
   68    H    ILE  10           H        ILE  10   3.779  12.642  -1.669
   69    HA   ILE  10           HA       ILE  10   4.776  10.191  -0.432
   70    HB   ILE  10           HB       ILE  10   4.008  10.566  -3.334
   71   HG12  ILE  10          2HG1      ILE  10   2.779   8.716  -1.284
   72   HG13  ILE  10          1HG1      ILE  10   2.087  10.272  -1.726
   73   HG21  ILE  10          1HG2      ILE  10   5.037   8.104  -1.927
   74   HG22  ILE  10          2HG2      ILE  10   5.988   9.133  -2.998
   75   HG23  ILE  10          3HG2      ILE  10   4.605   8.242  -3.631
   76   HD11  ILE  10          1HD1      ILE  10   0.965   8.502  -2.899
   77   HD12  ILE  10          2HD1      ILE  10   2.496   7.912  -3.542
   78   HD13  ILE  10          3HD1      ILE  10   1.876   9.483  -4.046
   79    H    SER  11           H        SER  11   6.784  10.947   0.076
   80    HA   SER  11           HA       SER  11   8.442  12.041  -2.065
   81    HB2  SER  11          2HB       SER  11   9.450  11.320   0.673
   82    HB3  SER  11          1HB       SER  11   9.963  12.635  -0.387
   83    HG   SER  11           HG       SER  11   7.635  12.441   1.220
   84    H    HIS  12           H        HIS  12  10.867  10.824  -1.721
   85    HA   HIS  12           HA       HIS  12  10.630   8.322  -2.948
   86    HB2  HIS  12          2HB       HIS  12  12.876   9.226  -1.137
   87    HB3  HIS  12          1HB       HIS  12  12.972   7.952  -2.343
   88    HD1  HIS  12          1HD       HIS  12  13.248   8.664  -4.814
   89    HD2  HIS  12          2HD       HIS  12  13.060  11.842  -2.140
   90    HE1  HIS  12          1HE       HIS  12  14.012  10.680  -6.105
   91    HE2  HIS  12          2HE       HIS  12  14.048  12.552  -4.421
   92    H    GLU  13           H        GLU  13  11.023   9.266   0.386
   93    HA   GLU  13           HA       GLU  13  11.238   6.666   1.445
   94    HB2  GLU  13          2HB       GLU  13  10.947   7.773   3.622
   95    HB3  GLU  13          1HB       GLU  13  12.129   8.592   2.607
   96    HG2  GLU  13          2HG       GLU  13  10.124  10.095   1.938
   97    HG3  GLU  13          1HG       GLU  13   9.405   9.481   3.424
   98    H    ASP  14           H        ASP  14   8.440   8.808   0.884
   99    HA   ASP  14           HA       ASP  14   6.740   7.362   2.628
  100    HB2  ASP  14          2HB       ASP  14   6.063   9.205   0.348
  101    HB3  ASP  14          1HB       ASP  14   4.893   8.547   1.488
  102    H    THR  15           H        THR  15   7.198   7.232  -0.913
  103    HA   THR  15           HA       THR  15   5.263   5.250  -1.382
  104    HB   THR  15           HB       THR  15   7.409   4.801  -3.157
  105    HG1  THR  15          1HG       THR  15   7.038   7.419  -3.585
  106   HG21  THR  15          1HG2      THR  15   5.132   4.626  -3.829
  107   HG22  THR  15          2HG2      THR  15   5.872   5.921  -4.774
  108   HG23  THR  15          3HG2      THR  15   4.823   6.310  -3.412
  109    H    GLN  16           H        GLN  16   8.708   5.024  -0.539
  110    HA   GLN  16           HA       GLN  16   8.997   2.243  -0.587
  111    HB2  GLN  16          2HB       GLN  16  10.214   4.349   1.182
  112    HB3  GLN  16          1HB       GLN  16  10.664   2.655   1.309
  113    HG2  GLN  16          2HG       GLN  16  11.387   2.737  -1.061
  114    HG3  GLN  16          1HG       GLN  16  11.032   4.462  -1.053
  115   HE21  GLN  16          1HE2      GLN  16  12.369   5.868  -0.017
  116   HE22  GLN  16          2HE2      GLN  16  13.913   5.412   0.613
  117    H    ARG  17           H        ARG  17   7.807   4.416   1.906
  118    HA   ARG  17           HA       ARG  17   7.548   2.585   4.000
  119    HB2  ARG  17          2HB       ARG  17   6.241   5.203   3.349
  120    HB3  ARG  17          1HB       ARG  17   5.716   4.277   4.744
  121    HG2  ARG  17          2HG       ARG  17   7.503   4.862   5.945
  122    HG3  ARG  17          1HG       ARG  17   8.606   4.634   4.588
  123    HD2  ARG  17          2HD       ARG  17   8.200   6.777   3.745
  124    HD3  ARG  17          1HD       ARG  17   6.758   6.992   4.746
  125    HE   ARG  17           HE       ARG  17   9.134   6.648   6.305
  126   HH11  ARG  17          1HH1      ARG  17   7.242   8.999   4.515
  127   HH12  ARG  17          2HH1      ARG  17   7.891  10.353   5.380
  128   HH21  ARG  17          1HH2      ARG  17   9.951   8.436   7.458
  129   HH22  ARG  17          2HH2      ARG  17   9.428  10.038   7.047
  130    H    ILE  18           H        ILE  18   5.102   3.748   1.661
  131    HA   ILE  18           HA       ILE  18   2.946   2.387   2.774
  132    HB   ILE  18           HB       ILE  18   3.355   3.132  -0.116
  133   HG12  ILE  18          2HG1      ILE  18   1.517   4.705   1.509
  134   HG13  ILE  18          1HG1      ILE  18   3.167   4.761   2.123
  135   HG21  ILE  18          1HG2      ILE  18   0.882   2.392   1.443
  136   HG22  ILE  18          2HG2      ILE  18   1.617   1.477   0.123
  137   HG23  ILE  18          3HG2      ILE  18   0.882   3.051  -0.196
  138   HD11  ILE  18          1HD1      ILE  18   3.977   5.541   0.025
  139   HD12  ILE  18          2HD1      ILE  18   2.638   6.570   0.541
  140   HD13  ILE  18          3HD1      ILE  18   2.387   5.355  -0.715
  141    H    LYS  19           H        LYS  19   5.048   1.362   0.079
  142    HA   LYS  19           HA       LYS  19   3.685  -1.059  -0.422
  143    HB2  LYS  19          2HB       LYS  19   6.648  -0.717  -0.790
  144    HB3  LYS  19          1HB       LYS  19   5.531  -1.689  -1.743
  145    HG2  LYS  19          2HG       LYS  19   4.486   0.343  -2.626
  146    HG3  LYS  19          1HG       LYS  19   5.637   1.324  -1.714
  147    HD2  LYS  19          2HD       LYS  19   6.445   1.173  -3.950
  148    HD3  LYS  19          1HD       LYS  19   7.464   0.131  -2.958
  149    HE2  LYS  19          2HE       LYS  19   5.995  -1.767  -3.628
  150    HE3  LYS  19          1HE       LYS  19   5.239  -0.693  -4.798
  151    HZ1  LYS  19          1HZ       LYS  19   8.055  -1.623  -4.723
  152    HZ2  LYS  19          2HZ       LYS  19   7.550  -0.324  -5.682
  153    HZ3  LYS  19          3HZ       LYS  19   6.906  -1.864  -5.944
  154    H    THR  20           H        THR  20   6.556  -0.282   1.472
  155    HA   THR  20           HA       THR  20   7.265  -2.924   1.898
  156    HB   THR  20           HB       THR  20   8.794  -0.936   2.092
  157    HG1  THR  20          1HG       THR  20  10.113  -2.122   3.274
  158   HG21  THR  20          1HG2      THR  20   7.403   0.458   3.534
  159   HG22  THR  20          2HG2      THR  20   8.972   0.156   4.284
  160   HG23  THR  20          3HG2      THR  20   7.547  -0.729   4.829
  161    H    ALA  21           H        ALA  21   5.264  -0.723   3.764
  162    HA   ALA  21           HA       ALA  21   5.235  -2.395   6.060
  163    HB1  ALA  21          1HB       ALA  21   3.334  -0.186   5.302
  164    HB2  ALA  21          2HB       ALA  21   4.848   0.028   6.182
  165    HB3  ALA  21          3HB       ALA  21   3.528  -0.891   6.910
  166    H    PHE  22           H        PHE  22   2.718  -1.529   3.728
  167    HA   PHE  22           HA       PHE  22   0.663  -3.185   4.424
  168    HB2  PHE  22          2HB       PHE  22   0.035  -1.951   2.692
  169    HB3  PHE  22          1HB       PHE  22   1.668  -1.786   2.095
  170    HD1  PHE  22          1HD       PHE  22  -1.263  -3.983   2.061
  171    HD2  PHE  22          2HD       PHE  22   2.316  -2.824   0.135
  172    HE1  PHE  22          1HE       PHE  22  -1.960  -5.260   0.030
  173    HE2  PHE  22          2HE       PHE  22   1.684  -4.110  -1.852
  174    HZ   PHE  22           HZ       PHE  22  -0.455  -5.324  -1.913
  175    H    LEU  23           H        LEU  23   3.276  -4.205   2.152
  176    HA   LEU  23           HA       LEU  23   2.376  -6.844   1.863
  177    HB2  LEU  23          2HB       LEU  23   5.236  -5.888   1.791
  178    HB3  LEU  23          1HB       LEU  23   4.594  -7.328   1.025
  179    HG   LEU  23           HG       LEU  23   3.550  -4.625   0.269
  180   HD11  LEU  23          1HD1      LEU  23   5.974  -4.485   0.104
  181   HD12  LEU  23          2HD1      LEU  23   5.236  -4.534  -1.499
  182   HD13  LEU  23          3HD1      LEU  23   6.008  -5.977  -0.840
  183   HD21  LEU  23          1HD2      LEU  23   2.313  -6.544  -0.518
  184   HD22  LEU  23          2HD2      LEU  23   3.789  -7.270  -1.163
  185   HD23  LEU  23          3HD2      LEU  23   3.153  -5.782  -1.873
  186    H    SER  24           H        SER  24   5.023  -5.631   3.942
  187    HA   SER  24           HA       SER  24   5.664  -8.128   5.074
  188    HB2  SER  24          2HB       SER  24   6.211  -5.475   6.349
  189    HB3  SER  24          1HB       SER  24   7.109  -6.987   6.472
  190    HG   SER  24           HG       SER  24   7.123  -5.078   4.459
  191    H    TYR  25           H        TYR  25   3.315  -5.744   5.926
  192    HA   TYR  25           HA       TYR  25   3.024  -6.464   8.644
  193    HB2  TYR  25          2HB       TYR  25   1.521  -4.755   6.712
  194    HB3  TYR  25          1HB       TYR  25   0.630  -5.336   8.129
  195    HD1  TYR  25          1HD       TYR  25   4.010  -3.899   7.405
  196    HD2  TYR  25          2HD       TYR  25   0.624  -3.938   9.970
  197    HE1  TYR  25          1HE       TYR  25   5.048  -2.155   8.768
  198    HE2  TYR  25          2HE       TYR  25   1.647  -2.183  11.356
  199    HH   TYR  25           HH       TYR  25   4.324  -0.378  10.363
  200    H    ALA  26           H        ALA  26   1.064  -7.237   5.760
  201    HA   ALA  26           HA       ALA  26  -0.658  -8.926   7.314
  202    HB1  ALA  26          1HB       ALA  26  -0.363  -8.969   4.333
  203    HB2  ALA  26          2HB       ALA  26  -1.240  -7.704   5.196
  204    HB3  ALA  26          3HB       ALA  26  -1.781  -9.380   5.306
  205    H    GLN  27           H        GLN  27   1.376  -9.784   4.512
  206    HA   GLN  27           HA       GLN  27   1.547 -12.460   5.697
  207    HB2  GLN  27          2HB       GLN  27   1.724 -12.023   2.739
  208    HB3  GLN  27          1HB       GLN  27   1.267 -13.470   3.637
  209    HG2  GLN  27          2HG       GLN  27  -0.835 -12.376   4.339
  210    HG3  GLN  27          1HG       GLN  27  -0.398 -10.979   3.356
  211   HE21  GLN  27          1HE2      GLN  27  -0.615 -11.064   1.166
  212   HE22  GLN  27          2HE2      GLN  27  -1.360 -12.405   0.345
  213    H    GLY  28           H        GLY  28   3.277  -9.853   4.257
  214    HA2  GLY  28          2HA       GLY  28   5.572  -9.635   3.920
  215    HA3  GLY  28          1HA       GLY  28   5.779 -11.329   4.345
  216    H    GLN  29           H        GLN  29   3.349 -11.651   2.303
  217    HA   GLN  29           HA       GLN  29   5.119 -12.366   0.128
  218    HB2  GLN  29          2HB       GLN  29   2.150 -12.613  -0.037
  219    HB3  GLN  29          1HB       GLN  29   3.393 -13.658  -0.700
  220    HG2  GLN  29          2HG       GLN  29   3.939 -14.317   1.656
  221    HG3  GLN  29          1HG       GLN  29   2.475 -13.451   2.139
  222   HE21  GLN  29          1HE2      GLN  29   0.438 -14.239   1.331
  223   HE22  GLN  29          2HE2      GLN  29   0.270 -15.890   0.849
  224    H    ASP  30           H        ASP  30   3.423 -12.138  -2.042
  225    HA   ASP  30           HA       ASP  30   3.914  -9.482  -2.912
  226    HB2  ASP  30          2HB       ASP  30   2.250 -11.691  -4.145
  227    HB3  ASP  30          1HB       ASP  30   2.643 -10.177  -4.948
  228    H    LYS  31           H        LYS  31   1.416 -10.716  -0.996
  229    HA   LYS  31           HA       LYS  31  -0.391  -8.555  -1.817
  230    HB2  LYS  31          2HB       LYS  31  -1.096 -11.439  -1.309
  231    HB3  LYS  31          1HB       LYS  31  -2.281 -10.155  -1.220
  232    HG2  LYS  31          2HG       LYS  31  -1.495  -9.661  -3.657
  233    HG3  LYS  31          1HG       LYS  31  -0.939 -11.332  -3.590
  234    HD2  LYS  31          2HD       LYS  31  -3.265 -11.830  -2.601
  235    HD3  LYS  31          1HD       LYS  31  -3.715 -10.263  -3.254
  236    HE2  LYS  31          2HE       LYS  31  -2.711 -12.630  -4.788
  237    HE3  LYS  31          1HE       LYS  31  -4.345 -11.958  -4.741
  238    HZ1  LYS  31          1HZ       LYS  31  -3.662 -10.052  -5.895
  239    HZ2  LYS  31          2HZ       LYS  31  -2.959 -11.348  -6.733
  240    HZ3  LYS  31          3HZ       LYS  31  -2.013 -10.390  -5.696
  241    H    VAL  32           H        VAL  32  -2.302  -8.658  -0.165
  242    HA   VAL  32           HA       VAL  32  -1.271  -9.121   2.532
  243    HB   VAL  32           HB       VAL  32  -2.485  -6.648   1.388
  244   HG11  VAL  32          1HG1      VAL  32  -3.979  -6.906   3.150
  245   HG12  VAL  32          2HG1      VAL  32  -2.697  -5.897   3.824
  246   HG13  VAL  32          3HG1      VAL  32  -2.763  -7.618   4.202
  247   HG21  VAL  32          1HG2      VAL  32  -0.724  -5.658   2.787
  248   HG22  VAL  32          2HG2      VAL  32  -0.116  -6.775   1.567
  249   HG23  VAL  32          3HG2      VAL  32  -0.225  -7.281   3.254
  250    H    THR  33           H        THR  33  -2.642 -10.101   3.897
  251    HA   THR  33           HA       THR  33  -5.153 -11.041   2.983
  252    HB   THR  33           HB       THR  33  -5.504 -11.525   5.470
  253    HG1  THR  33          1HG       THR  33  -3.779 -11.152   6.834
  254   HG21  THR  33          1HG2      THR  33  -4.625 -13.219   3.942
  255   HG22  THR  33          2HG2      THR  33  -3.843 -13.334   5.518
  256   HG23  THR  33          3HG2      THR  33  -2.993 -12.585   4.165
  257    H    GLU  34           H        GLU  34  -7.175 -10.411   3.975
  258    HA   GLU  34           HA       GLU  34  -7.502  -7.745   3.231
  259    HB2  GLU  34          2HB       GLU  34  -9.063  -9.751   3.008
  260    HB3  GLU  34          1HB       GLU  34  -9.692  -9.257   4.593
  261    HG2  GLU  34          2HG       GLU  34 -11.084  -8.250   3.001
  262    HG3  GLU  34          1HG       GLU  34  -9.982  -6.960   3.500
  263    H    ALA  35           H        ALA  35  -6.833  -9.051   6.258
  264    HA   ALA  35           HA       ALA  35  -8.107  -7.317   8.054
  265    HB1  ALA  35          1HB       ALA  35  -6.507  -8.099   9.684
  266    HB2  ALA  35          2HB       ALA  35  -5.468  -8.725   8.405
  267    HB3  ALA  35          3HB       ALA  35  -7.051  -9.453   8.694
  268    H    MET  36           H        MET  36  -4.678  -7.258   6.921
  269    HA   MET  36           HA       MET  36  -4.137  -4.717   8.011
  270    HB2  MET  36          2HB       MET  36  -2.823  -6.443   5.975
  271    HB3  MET  36          1HB       MET  36  -2.373  -4.760   6.031
  272    HG2  MET  36          2HG       MET  36  -2.256  -6.650   8.359
  273    HG3  MET  36          1HG       MET  36  -0.881  -6.169   7.359
  274    HE1  MET  36          1HE       MET  36  -2.226  -3.056   6.928
  275    HE2  MET  36          2HE       MET  36  -0.516  -3.484   6.878
  276    HE3  MET  36          3HE       MET  36  -1.077  -2.225   7.977
  277    H    ILE  37           H        ILE  37  -5.750  -5.828   5.201
  278    HA   ILE  37           HA       ILE  37  -5.538  -3.452   3.656
  279    HB   ILE  37           HB       ILE  37  -7.122  -5.900   3.590
  280   HG12  ILE  37          2HG1      ILE  37  -5.626  -6.231   1.972
  281   HG13  ILE  37          1HG1      ILE  37  -6.295  -4.866   1.108
  282   HG21  ILE  37          1HG2      ILE  37  -8.638  -5.052   1.905
  283   HG22  ILE  37          2HG2      ILE  37  -7.945  -3.436   2.061
  284   HG23  ILE  37          3HG2      ILE  37  -8.841  -4.145   3.405
  285   HD11  ILE  37          1HD1      ILE  37  -4.139  -4.619   3.156
  286   HD12  ILE  37          2HD1      ILE  37  -4.746  -3.364   2.071
  287   HD13  ILE  37          3HD1      ILE  37  -3.871  -4.744   1.420
  288    H    ASP  38           H        ASP  38  -7.900  -4.712   5.980
  289    HA   ASP  38           HA       ASP  38  -9.807  -2.719   5.953
  290    HB2  ASP  38          2HB       ASP  38  -9.622  -5.019   7.117
  291    HB3  ASP  38          1HB       ASP  38  -8.901  -4.118   8.444
  292    H    GLN  39           H        GLN  39  -6.711  -2.897   7.678
  293    HA   GLN  39           HA       GLN  39  -7.061  -0.661   9.332
  294    HB2  GLN  39          2HB       GLN  39  -4.917  -1.004   9.969
  295    HB3  GLN  39          1HB       GLN  39  -5.035  -2.460   9.008
  296    HG2  GLN  39          2HG       GLN  39  -2.995  -1.525   8.406
  297    HG3  GLN  39          1HG       GLN  39  -4.055  -1.065   7.087
  298   HE21  GLN  39          1HE2      GLN  39  -2.895   0.709   6.438
  299   HE22  GLN  39          2HE2      GLN  39  -2.731   2.130   7.407
  300    H    LEU  40           H        LEU  40  -5.770  -0.947   6.056
  301    HA   LEU  40           HA       LEU  40  -5.277   1.793   5.665
  302    HB2  LEU  40          2HB       LEU  40  -4.369   0.094   4.191
  303    HB3  LEU  40          1HB       LEU  40  -5.988  -0.344   3.650
  304    HG   LEU  40           HG       LEU  40  -5.948   2.291   3.041
  305   HD11  LEU  40          1HD1      LEU  40  -3.903   3.144   2.954
  306   HD12  LEU  40          2HD1      LEU  40  -3.328   1.781   1.987
  307   HD13  LEU  40          3HD1      LEU  40  -3.327   1.675   3.751
  308   HD21  LEU  40          1HD2      LEU  40  -5.413   1.576   0.740
  309   HD22  LEU  40          2HD2      LEU  40  -6.599   0.526   1.517
  310   HD23  LEU  40          3HD2      LEU  40  -4.920   0.001   1.364
  311    H    ILE  41           H        ILE  41  -8.070  -0.207   4.750
  312    HA   ILE  41           HA       ILE  41  -9.465   1.830   3.445
  313    HB   ILE  41           HB       ILE  41 -10.407  -0.732   4.702
  314   HG12  ILE  41          2HG1      ILE  41  -8.819  -0.586   2.668
  315   HG13  ILE  41          1HG1      ILE  41 -10.220  -1.639   2.544
  316   HG21  ILE  41          1HG2      ILE  41 -12.265   0.899   4.628
  317   HG22  ILE  41          2HG2      ILE  41 -12.510  -0.478   3.553
  318   HG23  ILE  41          3HG2      ILE  41 -12.000   1.074   2.893
  319   HD11  ILE  41          1HD1      ILE  41  -9.851  -0.390   0.503
  320   HD12  ILE  41          2HD1      ILE  41  -9.947   1.125   1.394
  321   HD13  ILE  41          3HD1      ILE  41 -11.375   0.094   1.252
  322    H    CYS  42           H        CYS  42  -9.689   0.807   6.865
  323    HA   CYS  42           HA       CYS  42 -11.764   2.701   7.459
  324    HB2  CYS  42          2HB       CYS  42 -11.406   2.102   9.775
  325    HB3  CYS  42          1HB       CYS  42 -11.394   0.661   8.775
  326    HG   CYS  42           HG       CYS  42  -8.329   1.295   8.797
  327    H    GLY  43           H        GLY  43  -8.448   2.825   7.037
  328    HA2  GLY  43          2HA       GLY  43  -7.549   4.956   8.535
  329    HA3  GLY  43          1HA       GLY  43  -7.021   4.610   6.892
  330    H    ALA  44           H        ALA  44  -9.140   5.208   5.330
  331    HA   ALA  44           HA       ALA  44  -9.462   8.100   5.771
  332    HB1  ALA  44          1HB       ALA  44  -8.500   7.319   3.611
  333    HB2  ALA  44          2HB       ALA  44  -9.986   8.252   3.419
  334    HB3  ALA  44          3HB       ALA  44 -10.027   6.493   3.278
  335    H    PHE  45           H        PHE  45 -11.336   5.384   4.520
  336    HA   PHE  45           HA       PHE  45 -13.850   6.706   5.040
  337    HB2  PHE  45          2HB       PHE  45 -13.833   3.839   4.447
  338    HB3  PHE  45          1HB       PHE  45 -14.802   5.141   3.768
  339    HD1  PHE  45          1HD       PHE  45 -12.030   2.991   3.202
  340    HD2  PHE  45          2HD       PHE  45 -13.738   6.705   2.068
  341    HE1  PHE  45          1HE       PHE  45 -10.679   2.972   1.151
  342    HE2  PHE  45          2HE       PHE  45 -12.383   6.704   0.014
  343    HZ   PHE  45           HZ       PHE  45 -10.842   4.832  -0.442
  344    HA   PRO  46           HA       PRO  46 -14.560   4.820   8.916
  345    HB2  PRO  46          2HB       PRO  46 -17.135   4.174   8.988
  346    HB3  PRO  46          1HB       PRO  46 -16.614   5.851   8.835
  347    HG2  PRO  46          2HG       PRO  46 -17.388   3.929   6.662
  348    HG3  PRO  46          1HG       PRO  46 -18.036   5.560   6.957
  349    HD2  PRO  46          2HD       PRO  46 -16.092   5.121   5.161
  350    HD3  PRO  46          1HD       PRO  46 -16.107   6.591   6.159
  351    H    GLY  47           H        GLY  47 -16.108   2.812   9.842
  352    HA2  GLY  47          2HA       GLY  47 -14.720   0.466   9.052
  353    HA3  GLY  47          1HA       GLY  47 -16.046   0.553  10.204
  354    H    LEU  48           H        LEU  48 -15.258   0.498   6.797
  355    HA   LEU  48           HA       LEU  48 -17.814   0.068   5.751
  356    HB2  LEU  48          2HB       LEU  48 -15.153  -0.975   4.784
  357    HB3  LEU  48          1HB       LEU  48 -16.635  -1.051   3.855
  358    HG   LEU  48           HG       LEU  48 -15.048   1.392   4.617
  359   HD11  LEU  48          1HD1      LEU  48 -14.896   1.696   2.225
  360   HD12  LEU  48          2HD1      LEU  48 -15.943   0.302   1.952
  361   HD13  LEU  48          3HD1      LEU  48 -14.341   0.075   2.653
  362   HD21  LEU  48          1HD2      LEU  48 -17.388   1.932   4.969
  363   HD22  LEU  48          2HD2      LEU  48 -17.803   1.268   3.391
  364   HD23  LEU  48          3HD2      LEU  48 -16.800   2.714   3.501
  365    H    SER  49           H        SER  49 -19.177  -1.587   5.888
  366    HA   SER  49           HA       SER  49 -18.564  -4.025   7.183
  367    HB2  SER  49          2HB       SER  49 -20.815  -3.479   5.228
  368    HB3  SER  49          1HB       SER  49 -20.768  -4.734   6.469
  369    HG   SER  49           HG       SER  49 -21.968  -2.966   7.196
  370    H    TRP  50           H        TRP  50 -18.379  -6.165   6.162
  371    HA   TRP  50           HA       TRP  50 -16.232  -6.068   4.430
  372    HB2  TRP  50          2HB       TRP  50 -16.759  -7.987   5.925
  373    HB3  TRP  50          1HB       TRP  50 -18.018  -8.471   4.790
  374    HD1  TRP  50           HD       TRP  50 -14.187  -7.895   4.714
  375    HE1  TRP  50          1HE       TRP  50 -13.209  -9.570   3.021
  376    HE3  TRP  50          3HE       TRP  50 -18.535 -10.004   3.088
  377    HZ2  TRP  50          2HZ       TRP  50 -14.187 -11.522   1.250
  378    HZ3  TRP  50          3HZ       TRP  50 -18.430 -11.766   1.383
  379    HH2  TRP  50           HH       TRP  50 -16.291 -12.518   0.480
  380    H    GLU  51           H        GLU  51 -19.638  -6.462   3.608
  381    HA   GLU  51           HA       GLU  51 -19.256  -7.199   0.916
  382    HB2  GLU  51          2HB       GLU  51 -21.541  -5.804   2.293
  383    HB3  GLU  51          1HB       GLU  51 -21.582  -6.243   0.591
  384    HG2  GLU  51          2HG       GLU  51 -21.187  -8.598   1.261
  385    HG3  GLU  51          1HG       GLU  51 -21.328  -8.102   2.931
  386    H    GLN  52           H        GLN  52 -19.666  -3.997   2.403
  387    HA   GLN  52           HA       GLN  52 -19.541  -2.568  -0.050
  388    HB2  GLN  52          2HB       GLN  52 -20.559  -1.575   1.920
  389    HB3  GLN  52          1HB       GLN  52 -19.042  -1.674   2.795
  390    HG2  GLN  52          2HG       GLN  52 -19.489   0.592   2.059
  391    HG3  GLN  52          1HG       GLN  52 -18.043  -0.051   1.287
  392   HE21  GLN  52          1HE2      GLN  52 -18.041  -0.421  -0.910
  393   HE22  GLN  52          2HE2      GLN  52 -19.277   0.189  -1.959
  394    H    LEU  53           H        LEU  53 -17.148  -3.719   2.225
  395    HA   LEU  53           HA       LEU  53 -15.041  -2.117   1.121
  396    HB2  LEU  53          2HB       LEU  53 -14.987  -2.792   3.453
  397    HB3  LEU  53          1HB       LEU  53 -14.963  -4.479   2.991
  398    HG   LEU  53           HG       LEU  53 -12.761  -2.686   2.045
  399   HD11  LEU  53          1HD1      LEU  53 -12.970  -2.244   4.453
  400   HD12  LEU  53          2HD1      LEU  53 -11.503  -3.148   4.086
  401   HD13  LEU  53          3HD1      LEU  53 -12.899  -3.975   4.776
  402   HD21  LEU  53          1HD2      LEU  53 -12.846  -5.589   2.878
  403   HD22  LEU  53          2HD2      LEU  53 -11.466  -4.743   2.183
  404   HD23  LEU  53          3HD2      LEU  53 -12.921  -4.997   1.218
  405    H    GLN  54           H        GLN  54 -16.105  -5.482   0.817
  406    HA   GLN  54           HA       GLN  54 -13.953  -6.407  -0.690
  407    HB2  GLN  54          2HB       GLN  54 -15.239  -8.292  -1.210
  408    HB3  GLN  54          1HB       GLN  54 -15.818  -7.766   0.349
  409    HG2  GLN  54          2HG       GLN  54 -17.821  -6.947  -0.527
  410    HG3  GLN  54          1HG       GLN  54 -17.202  -6.963  -2.178
  411   HE21  GLN  54          1HE2      GLN  54 -18.530  -8.872   0.404
  412   HE22  GLN  54          2HE2      GLN  54 -18.852 -10.281  -0.539
  413    H    GLU  55           H        GLU  55 -16.977  -4.857  -1.697
  414    HA   GLU  55           HA       GLU  55 -16.397  -5.020  -4.476
  415    HB2  GLU  55          2HB       GLU  55 -18.264  -3.423  -4.766
  416    HB3  GLU  55          1HB       GLU  55 -18.694  -4.821  -3.798
  417    HG2  GLU  55          2HG       GLU  55 -18.364  -3.424  -1.773
  418    HG3  GLU  55          1HG       GLU  55 -18.119  -2.051  -2.812
  419    H    LYS  56           H        LYS  56 -15.630  -2.740  -1.953
  420    HA   LYS  56           HA       LYS  56 -14.855  -0.487  -3.328
  421    HB2  LYS  56          2HB       LYS  56 -14.544  -1.188  -0.753
  422    HB3  LYS  56          1HB       LYS  56 -12.929  -1.585  -1.319
  423    HG2  LYS  56          2HG       LYS  56 -13.016   0.649  -0.367
  424    HG3  LYS  56          1HG       LYS  56 -12.596   0.691  -2.080
  425    HD2  LYS  56          2HD       LYS  56 -14.871   1.306  -2.650
  426    HD3  LYS  56          1HD       LYS  56 -15.355   1.179  -0.959
  427    HE2  LYS  56          2HE       LYS  56 -13.944   3.029  -0.363
  428    HE3  LYS  56          1HE       LYS  56 -13.267   3.091  -1.991
  429    HZ1  LYS  56          1HZ       LYS  56 -16.090   3.649  -1.250
  430    HZ2  LYS  56          2HZ       LYS  56 -15.477   3.654  -2.826
  431    HZ3  LYS  56          3HZ       LYS  56 -14.931   4.794  -1.705
  432    H    LYS  57           H        LYS  57 -12.971  -3.452  -2.789
  433    HA   LYS  57           HA       LYS  57 -11.040  -2.480  -4.787
  434    HB2  LYS  57          2HB       LYS  57 -10.097  -4.696  -3.204
  435    HB3  LYS  57          1HB       LYS  57  -9.400  -3.103  -3.428
  436    HG2  LYS  57          2HG       LYS  57  -9.772  -2.961  -1.227
  437    HG3  LYS  57          1HG       LYS  57 -11.365  -2.470  -1.759
  438    HD2  LYS  57          2HD       LYS  57 -11.702  -4.095  -0.080
  439    HD3  LYS  57          1HD       LYS  57 -12.034  -4.892  -1.615
  440    HE2  LYS  57          2HE       LYS  57 -10.623  -6.125   0.142
  441    HE3  LYS  57          1HE       LYS  57 -10.069  -6.153  -1.517
  442    HZ1  LYS  57          1HZ       LYS  57  -8.378  -5.692   0.246
  443    HZ2  LYS  57          2HZ       LYS  57  -9.102  -4.170   0.428
  444    HZ3  LYS  57          3HZ       LYS  57  -8.416  -4.604  -1.053
  445    H    LYS  58           H        LYS  58 -13.591  -4.414  -4.916
  446    HA   LYS  58           HA       LYS  58 -12.768  -6.884  -5.845
  447    HB2  LYS  58          2HB       LYS  58 -15.123  -5.173  -6.452
  448    HB3  LYS  58          1HB       LYS  58 -14.813  -6.536  -7.518
  449    HG2  LYS  58          2HG       LYS  58 -14.825  -8.037  -5.572
  450    HG3  LYS  58          1HG       LYS  58 -15.189  -6.663  -4.531
  451    HD2  LYS  58          2HD       LYS  58 -17.285  -7.568  -4.871
  452    HD3  LYS  58          1HD       LYS  58 -17.222  -6.340  -6.132
  453    HE2  LYS  58          2HE       LYS  58 -16.481  -9.220  -6.601
  454    HE3  LYS  58          1HE       LYS  58 -18.116  -8.606  -6.814
  455    HZ1  LYS  58          1HZ       LYS  58 -15.698  -7.719  -8.292
  456    HZ2  LYS  58          2HZ       LYS  58 -17.235  -7.041  -8.463
  457    HZ3  LYS  58          3HZ       LYS  58 -16.967  -8.649  -8.906
  458    H    GLY  59           H        GLY  59 -11.536  -7.545  -7.397
  459    HA2  GLY  59          2HA       GLY  59 -11.229  -7.218  -9.951
  460    HA3  GLY  59          1HA       GLY  59 -10.650  -5.636  -9.439
  461    H    ARG  60           H        ARG  60  -9.277  -6.201  -7.181
  462    HA   ARG  60           HA       ARG  60  -7.374  -8.308  -7.841
  463    HB2  ARG  60          2HB       ARG  60  -6.724  -5.914  -8.719
  464    HB3  ARG  60          1HB       ARG  60  -6.285  -5.645  -7.039
  465    HG2  ARG  60          2HG       ARG  60  -4.366  -6.341  -8.378
  466    HG3  ARG  60          1HG       ARG  60  -4.744  -7.524  -7.118
  467    HD2  ARG  60          2HD       ARG  60  -5.807  -8.970  -8.688
  468    HD3  ARG  60          1HD       ARG  60  -5.733  -7.741  -9.953
  469    HE   ARG  60           HE       ARG  60  -3.225  -8.775  -8.836
  470   HH11  ARG  60          1HH1      ARG  60  -5.475  -8.569 -11.509
  471   HH12  ARG  60          2HH1      ARG  60  -4.361  -9.221 -12.665
  472   HH21  ARG  60          1HH2      ARG  60  -1.744  -9.632 -10.353
  473   HH22  ARG  60          2HH2      ARG  60  -2.242  -9.833 -12.004
  474    H    ALA  61           H        ALA  61  -9.362  -8.180  -5.928
  475    HA   ALA  61           HA       ALA  61  -8.125  -9.148  -3.653
  476    HB1  ALA  61          1HB       ALA  61  -7.375  -6.898  -3.177
  477    HB2  ALA  61          2HB       ALA  61  -8.594  -7.375  -2.003
  478    HB3  ALA  61          3HB       ALA  61  -9.018  -6.286  -3.323
  479    H    ALA  62           H        ALA  62 -10.250  -9.654  -5.411
  480    HA   ALA  62           HA       ALA  62 -12.752  -8.833  -4.283
  481    HB1  ALA  62          1HB       ALA  62 -12.395  -9.154  -6.686
  482    HB2  ALA  62          2HB       ALA  62 -13.719 -10.147  -6.071
  483    HB3  ALA  62          3HB       ALA  62 -12.146 -10.874  -6.406
  484    H    ALA  63           H        ALA  63 -10.760 -11.721  -4.227
  485    HA   ALA  63           HA       ALA  63 -12.676 -12.964  -2.373
  486    HB1  ALA  63          1HB       ALA  63 -11.578 -15.086  -2.879
  487    HB2  ALA  63          2HB       ALA  63 -10.473 -14.255  -3.975
  488    HB3  ALA  63          3HB       ALA  63 -12.197 -14.320  -4.341
  489    H    ASN  64           H        ASN  64 -10.849 -10.856  -1.765
  490    HA   ASN  64           HA       ASN  64  -9.664 -10.187   0.015
  491    HB2  ASN  64          2HB       ASN  64  -9.858 -13.048   0.954
  492    HB3  ASN  64          1HB       ASN  64  -9.263 -11.697   1.918
  493   HD21  ASN  64          1HD2      ASN  64 -11.147  -9.863   0.618
  494   HD22  ASN  64          2HD2      ASN  64 -12.704 -10.216   1.320
  495    H    GLY  65           H        GLY  65  -8.097  -9.600  -1.207
  496    HA2  GLY  65          2HA       GLY  65  -5.539 -10.532  -0.508
  497    HA3  GLY  65          1HA       GLY  65  -5.927 -11.232  -2.083
  498    H    TYR  66           H        TYR  66  -5.799  -8.071  -0.363
  499    HA   TYR  66           HA       TYR  66  -5.532  -6.595  -2.786
  500    HB2  TYR  66          2HB       TYR  66  -5.509  -5.895  -0.044
  501    HB3  TYR  66          1HB       TYR  66  -4.000  -5.325  -0.737
  502    HD1  TYR  66          1HD       TYR  66  -5.122  -3.154   0.112
  503    HD2  TYR  66          2HD       TYR  66  -6.498  -5.271  -3.288
  504    HE1  TYR  66          1HE       TYR  66  -6.197  -1.110  -0.696
  505    HE2  TYR  66          2HE       TYR  66  -7.582  -3.244  -4.114
  506    HH   TYR  66           HH       TYR  66  -6.936  -0.202  -2.979
  507    H    ASP  67           H        ASP  67  -3.978  -6.233  -4.082
  508    HA   ASP  67           HA       ASP  67  -1.433  -7.539  -3.565
  509    HB2  ASP  67          2HB       ASP  67  -2.996  -7.976  -5.587
  510    HB3  ASP  67          1HB       ASP  67  -2.378  -6.435  -6.183
  511    H    ARG  68           H        ARG  68   0.390  -6.274  -4.754
  512    HA   ARG  68           HA       ARG  68   0.510  -3.810  -3.320
  513    HB2  ARG  68          2HB       ARG  68   2.645  -3.743  -5.138
  514    HB3  ARG  68          1HB       ARG  68   2.701  -4.207  -3.449
  515    HG2  ARG  68          2HG       ARG  68   2.322  -6.547  -4.096
  516    HG3  ARG  68          1HG       ARG  68   2.335  -6.057  -5.795
  517    HD2  ARG  68          2HD       ARG  68   4.592  -5.271  -5.616
  518    HD3  ARG  68          1HD       ARG  68   4.593  -5.520  -3.874
  519    HE   ARG  68           HE       ARG  68   4.180  -7.893  -5.504
  520   HH11  ARG  68          1HH1      ARG  68   6.418  -5.862  -3.739
  521   HH12  ARG  68          2HH1      ARG  68   7.629  -7.090  -3.582
  522   HH21  ARG  68          1HH2      ARG  68   5.778  -9.542  -5.294
  523   HH22  ARG  68          2HH2      ARG  68   7.267  -9.174  -4.466
  524    H    SER  69           H        SER  69  -0.017  -4.680  -6.668
  525    HA   SER  69           HA       SER  69   0.097  -2.087  -7.758
  526    HB2  SER  69          2HB       SER  69  -1.467  -3.175  -9.514
  527    HB3  SER  69          1HB       SER  69   0.149  -3.853  -9.305
  528    HG   SER  69           HG       SER  69  -0.914  -5.649  -9.021
  529    H    ALA  70           H        ALA  70  -2.588  -3.985  -6.463
  530    HA   ALA  70           HA       ALA  70  -4.635  -2.094  -6.953
  531    HB1  ALA  70          1HB       ALA  70  -6.028  -3.517  -5.743
  532    HB2  ALA  70          2HB       ALA  70  -4.720  -4.066  -4.694
  533    HB3  ALA  70          3HB       ALA  70  -4.793  -4.609  -6.377
  534    H    PHE  71           H        PHE  71  -2.900  -2.976  -4.007
  535    HA   PHE  71           HA       PHE  71  -4.086  -1.163  -2.275
  536    HB2  PHE  71          2HB       PHE  71  -2.710  -3.067  -1.549
  537    HB3  PHE  71          1HB       PHE  71  -1.280  -2.296  -2.222
  538    HD1  PHE  71          1HD       PHE  71  -3.686  -2.274   0.503
  539    HD2  PHE  71          2HD       PHE  71  -0.236  -0.419  -1.117
  540    HE1  PHE  71          1HE       PHE  71  -3.293  -1.171   2.652
  541    HE2  PHE  71          2HE       PHE  71   0.163   0.695   1.032
  542    HZ   PHE  71           HZ       PHE  71  -1.364   0.332   2.914
  543    H    PHE  72           H        PHE  72  -1.184  -0.816  -4.293
  544    HA   PHE  72           HA       PHE  72  -0.463   1.714  -3.280
  545    HB2  PHE  72          2HB       PHE  72   1.130   0.273  -4.464
  546    HB3  PHE  72          1HB       PHE  72   0.223   0.504  -5.957
  547    HD1  PHE  72          1HD       PHE  72   1.773   2.570  -3.272
  548    HD2  PHE  72          2HD       PHE  72   1.045   2.059  -7.433
  549    HE1  PHE  72          1HE       PHE  72   3.103   4.579  -3.745
  550    HE2  PHE  72          2HE       PHE  72   2.377   4.070  -7.917
  551    HZ   PHE  72           HZ       PHE  72   3.409   5.335  -6.071
  552    H    SER  73           H        SER  73  -2.539   0.716  -5.898
  553    HA   SER  73           HA       SER  73  -2.824   3.198  -7.175
  554    HB2  SER  73          2HB       SER  73  -4.782   0.896  -6.992
  555    HB3  SER  73          1HB       SER  73  -4.936   2.260  -8.099
  556    HG   SER  73           HG       SER  73  -2.991   0.207  -8.062
  557    H    LEU  74           H        LEU  74  -4.462   1.800  -4.396
  558    HA   LEU  74           HA       LEU  74  -6.364   3.930  -4.147
  559    HB2  LEU  74          2HB       LEU  74  -6.779   1.665  -3.266
  560    HB3  LEU  74          1HB       LEU  74  -5.474   1.886  -2.118
  561    HG   LEU  74           HG       LEU  74  -6.714   3.557  -0.924
  562   HD11  LEU  74          1HD1      LEU  74  -8.794   3.302  -3.095
  563   HD12  LEU  74          2HD1      LEU  74  -7.759   4.701  -2.805
  564   HD13  LEU  74          3HD1      LEU  74  -8.968   4.237  -1.610
  565   HD21  LEU  74          1HD2      LEU  74  -8.733   2.232  -0.315
  566   HD22  LEU  74          2HD2      LEU  74  -7.235   1.302  -0.330
  567   HD23  LEU  74          3HD2      LEU  74  -8.370   1.164  -1.672
  568    H    VAL  75           H        VAL  75  -3.314   3.129  -2.503
  569    HA   VAL  75           HA       VAL  75  -3.520   5.232  -0.603
  570    HB   VAL  75           HB       VAL  75  -0.977   3.849  -1.445
  571   HG11  VAL  75          1HG1      VAL  75  -0.640   4.206   1.118
  572   HG12  VAL  75          2HG1      VAL  75  -1.742   5.558   0.827
  573   HG13  VAL  75          3HG1      VAL  75  -0.225   5.445  -0.065
  574   HG21  VAL  75          1HG2      VAL  75  -3.150   2.973   0.430
  575   HG22  VAL  75          2HG2      VAL  75  -1.489   2.408   0.599
  576   HG23  VAL  75          3HG2      VAL  75  -2.396   2.060  -0.880
  577    H    ALA  76           H        ALA  76  -1.943   4.951  -3.739
  578    HA   ALA  76           HA       ALA  76  -0.271   7.180  -3.572
  579    HB1  ALA  76          1HB       ALA  76  -0.157   7.081  -6.000
  580    HB2  ALA  76          2HB       ALA  76  -1.563   6.017  -6.029
  581    HB3  ALA  76          3HB       ALA  76  -0.059   5.467  -5.294
  582    H    SER  77           H        SER  77  -3.691   7.019  -4.022
  583    HA   SER  77           HA       SER  77  -3.774   9.799  -4.948
  584    HB2  SER  77          2HB       SER  77  -6.027   7.804  -4.637
  585    HB3  SER  77          1HB       SER  77  -6.147   9.396  -5.381
  586    HG   SER  77           HG       SER  77  -5.860   7.537  -6.832
  587    H    ASP  78           H        ASP  78  -3.863   8.067  -2.070
  588    HA   ASP  78           HA       ASP  78  -5.500  10.138  -0.774
  589    HB2  ASP  78          2HB       ASP  78  -5.348   7.185  -0.248
  590    HB3  ASP  78          1HB       ASP  78  -5.929   8.307   0.979
  591    H    GLU  79           H        GLU  79  -4.207  11.486   0.221
  592    HA   GLU  79           HA       GLU  79  -1.632  10.955   1.211
  593    HB2  GLU  79          2HB       GLU  79  -1.878  13.203   1.048
  594    HB3  GLU  79          1HB       GLU  79  -3.601  13.148   1.384
  595    HG2  GLU  79          2HG       GLU  79  -3.097  12.874   3.780
  596    HG3  GLU  79          1HG       GLU  79  -1.378  13.013   3.415
  597    H    GLN  80           H        GLN  80  -4.798  10.729   2.709
  598    HA   GLN  80           HA       GLN  80  -4.139  10.399   5.371
  599    HB2  GLN  80          2HB       GLN  80  -6.095   8.540   4.049
  600    HB3  GLN  80          1HB       GLN  80  -6.163   9.222   5.662
  601    HG2  GLN  80          2HG       GLN  80  -7.867  10.275   4.479
  602    HG3  GLN  80          1HG       GLN  80  -6.561  11.457   4.527
  603   HE21  GLN  80          1HE2      GLN  80  -8.041   8.973   2.496
  604   HE22  GLN  80          2HE2      GLN  80  -7.650   9.725   0.986
  605    H    TYR  81           H        TYR  81  -3.740   8.286   2.666
  606    HA   TYR  81           HA       TYR  81  -3.407   5.926   4.282
  607    HB2  TYR  81          2HB       TYR  81  -3.712   6.415   1.331
  608    HB3  TYR  81          1HB       TYR  81  -3.249   4.838   1.970
  609    HD1  TYR  81          1HD       TYR  81  -5.696   5.065   0.380
  610    HD2  TYR  81          2HD       TYR  81  -5.118   5.730   4.530
  611    HE1  TYR  81          1HE       TYR  81  -8.033   4.398   0.806
  612    HE2  TYR  81          2HE       TYR  81  -7.429   5.124   4.950
  613    HH   TYR  81           HH       TYR  81  -9.366   3.561   2.703
  614    H    VAL  82           H        VAL  82  -1.537   7.961   2.061
  615    HA   VAL  82           HA       VAL  82   0.698   6.322   1.966
  616    HB   VAL  82           HB       VAL  82   1.822   8.370   1.291
  617   HG11  VAL  82          1HG1      VAL  82   0.618   8.764  -0.766
  618   HG12  VAL  82          2HG1      VAL  82  -0.815   8.025  -0.045
  619   HG13  VAL  82          3HG1      VAL  82   0.616   7.044  -0.360
  620   HG21  VAL  82          1HG2      VAL  82   0.427  10.422   0.909
  621   HG22  VAL  82          2HG2      VAL  82   0.997  10.089   2.545
  622   HG23  VAL  82          3HG2      VAL  82  -0.666   9.708   2.100
  623    H    ARG  83           H        ARG  83  -0.046   9.114   3.922
  624    HA   ARG  83           HA       ARG  83   2.159   8.905   5.638
  625    HB2  ARG  83          2HB       ARG  83  -0.453  10.378   5.846
  626    HB3  ARG  83          1HB       ARG  83   0.836  10.539   7.013
  627    HG2  ARG  83          2HG       ARG  83   2.328  11.234   5.114
  628    HG3  ARG  83          1HG       ARG  83   0.861  11.318   4.141
  629    HD2  ARG  83          2HD       ARG  83  -0.033  12.985   5.340
  630    HD3  ARG  83          1HD       ARG  83   1.027  12.752   6.728
  631    HE   ARG  83           HE       ARG  83   2.554  13.441   4.460
  632   HH11  ARG  83          1HH1      ARG  83   0.280  14.854   6.709
  633   HH12  ARG  83          2HH1      ARG  83   0.951  16.451   6.588
  634   HH21  ARG  83          1HH2      ARG  83   3.447  15.538   4.282
  635   HH22  ARG  83          2HH2      ARG  83   2.766  16.837   5.214
  636    H    PHE  84           H        PHE  84  -1.028   7.490   5.651
  637    HA   PHE  84           HA       PHE  84  -1.205   6.796   8.369
  638    HB2  PHE  84          2HB       PHE  84  -2.707   6.202   6.135
  639    HB3  PHE  84          1HB       PHE  84  -2.029   4.624   6.549
  640    HD1  PHE  84          1HD       PHE  84  -2.660   3.500   8.565
  641    HD2  PHE  84          2HD       PHE  84  -4.222   7.343   7.647
  642    HE1  PHE  84          1HE       PHE  84  -4.380   3.210  10.300
  643    HE2  PHE  84          2HE       PHE  84  -5.944   7.063   9.379
  644    HZ   PHE  84           HZ       PHE  84  -6.026   4.995  10.709
  645    H    ILE  85           H        ILE  85   0.315   5.091   5.677
  646    HA   ILE  85           HA       ILE  85   1.283   3.012   7.421
  647    HB   ILE  85           HB       ILE  85   1.481   3.502   4.491
  648   HG12  ILE  85          2HG1      ILE  85   0.666   1.212   6.287
  649   HG13  ILE  85          1HG1      ILE  85  -0.376   2.206   5.277
  650   HG21  ILE  85          1HG2      ILE  85   3.038   1.506   4.391
  651   HG22  ILE  85          2HG2      ILE  85   3.357   1.800   6.100
  652   HG23  ILE  85          3HG2      ILE  85   3.747   3.035   4.904
  653   HD11  ILE  85          1HD1      ILE  85  -0.044  -0.020   4.345
  654   HD12  ILE  85          2HD1      ILE  85   1.697   0.260   4.268
  655   HD13  ILE  85          3HD1      ILE  85   0.600   1.231   3.281
  656    H    ALA  86           H        ALA  86   2.724   5.727   5.669
  657    HA   ALA  86           HA       ALA  86   5.367   5.484   6.323
  658    HB1  ALA  86          1HB       ALA  86   3.793   8.062   6.366
  659    HB2  ALA  86          2HB       ALA  86   4.390   7.269   4.910
  660    HB3  ALA  86          3HB       ALA  86   5.529   7.892   6.107
  661    H    GLN  87           H        GLN  87   2.785   6.728   8.421
  662    HA   GLN  87           HA       GLN  87   4.597   7.359  10.548
  663    HB2  GLN  87          2HB       GLN  87   2.415   8.501  10.262
  664    HB3  GLN  87          1HB       GLN  87   1.597   6.993  10.641
  665    HG2  GLN  87          2HG       GLN  87   2.497   7.005  12.870
  666    HG3  GLN  87          1HG       GLN  87   3.467   8.433  12.508
  667   HE21  GLN  87          1HE2      GLN  87   2.463  10.431  12.332
  668   HE22  GLN  87          2HE2      GLN  87   0.867  10.715  12.933
  669    H    HIS  88           H        HIS  88   2.626   4.595   9.660
  670    HA   HIS  88           HA       HIS  88   3.027   3.182  12.108
  671    HB2  HIS  88          2HB       HIS  88   2.138   2.301   9.368
  672    HB3  HIS  88          1HB       HIS  88   2.354   1.161  10.688
  673    HD1  HIS  88          1HD       HIS  88   1.079   2.967  12.936
  674    HD2  HIS  88          2HD       HIS  88  -0.595   2.186   9.209
  675    HE1  HIS  88          1HE       HIS  88  -1.393   3.281  13.226
  676    HE2  HIS  88          2HE       HIS  88  -2.393   2.599  11.021
  677    H    PHE  89           H        PHE  89   4.843   3.431   9.110
  678    HA   PHE  89           HA       PHE  89   7.026   1.911  10.256
  679    HB2  PHE  89          2HB       PHE  89   5.373   0.257   9.263
  680    HB3  PHE  89          1HB       PHE  89   5.766   0.942   7.695
  681    HD1  PHE  89          1HD       PHE  89   7.619   0.210   6.509
  682    HD2  PHE  89          2HD       PHE  89   7.235  -0.802  10.617
  683    HE1  PHE  89          1HE       PHE  89   9.487  -1.374   6.283
  684    HE2  PHE  89          2HE       PHE  89   9.116  -2.374  10.411
  685    HZ   PHE  89           HZ       PHE  89  10.247  -2.662   8.242
  686    HA   PRO  90           HA       PRO  90   9.233   5.052   7.853
  687    HB2  PRO  90          2HB       PRO  90  11.412   3.179   8.628
  688    HB3  PRO  90          1HB       PRO  90  11.328   4.934   8.786
  689    HG2  PRO  90          2HG       PRO  90  11.009   3.360  10.904
  690    HG3  PRO  90          1HG       PRO  90  10.047   4.834  10.708
  691    HD2  PRO  90          2HD       PRO  90   9.248   1.992  10.318
  692    HD3  PRO  90          1HD       PRO  90   8.301   3.361  10.933
  693    H    CYS  91           H        CYS  91  10.895   4.969   6.112
  694    HA   CYS  91           HA       CYS  91   9.953   3.148   4.091
  695    HB2  CYS  91          2HB       CYS  91  11.420   4.510   2.585
  696    HB3  CYS  91          1HB       CYS  91  10.249   5.482   3.509
  697    HG   CYS  91           HG       CYS  91  13.499   5.084   4.521
  698    H    ALA  92           H        ALA  92  10.662   1.203   4.224
  699    HA   ALA  92           HA       ALA  92  13.570   0.783   4.055
  700    HB1  ALA  92          1HB       ALA  92  11.658  -1.010   5.549
  701    HB2  ALA  92          2HB       ALA  92  12.777   0.130   6.297
  702    HB3  ALA  92          3HB       ALA  92  13.400  -1.240   5.369
  703    HA   PRO  93           HA       PRO  93  12.420  -1.753   0.564
  704    HB2  PRO  93          2HB       PRO  93  14.625  -3.268   0.305
  705    HB3  PRO  93          1HB       PRO  93  14.644  -1.546  -0.068
  706    HG2  PRO  93          2HG       PRO  93  15.605  -2.960   2.384
  707    HG3  PRO  93          1HG       PRO  93  16.357  -1.619   1.499
  708    HD2  PRO  93          2HD       PRO  93  14.879  -1.308   3.802
  709    HD3  PRO  93          1HD       PRO  93  15.082  -0.043   2.571
  710    H    GLU  94           H        GLU  94  11.952  -4.046   0.042
  711    HA   GLU  94           HA       GLU  94  10.855  -5.475   2.167
  712    HB2  GLU  94          2HB       GLU  94  11.709  -6.492  -0.538
  713    HB3  GLU  94          1HB       GLU  94  10.720  -7.398   0.597
  714    HG2  GLU  94          2HG       GLU  94   9.040  -5.550   0.482
  715    HG3  GLU  94          1HG       GLU  94  10.002  -4.843  -0.816
  716    H    GLU  95           H        GLU  95  13.722  -6.205   0.329
  717    HA   GLU  95           HA       GLU  95  15.136  -7.060   2.701
  718    HB2  GLU  95          2HB       GLU  95  14.493  -8.929   0.429
  719    HB3  GLU  95          1HB       GLU  95  15.873  -9.199   1.482
  720    HG2  GLU  95          2HG       GLU  95  14.320  -9.233   3.405
  721    HG3  GLU  95          1HG       GLU  95  12.986  -9.070   2.266
  722    H    GLU  96           H        GLU  96  17.334  -8.263   1.314
  723    HA   GLU  96           HA       GLU  96  18.679  -5.844   0.649
  724    HB2  GLU  96          2HB       GLU  96  20.654  -7.306   0.271
  725    HB3  GLU  96          1HB       GLU  96  19.891  -7.537   1.837
  726    HG2  GLU  96          2HG       GLU  96  18.811  -9.556   1.036
  727    HG3  GLU  96          1HG       GLU  96  19.508  -9.313  -0.563
  728    H    LYS  97           H        LYS  97  17.634  -8.647  -1.278
  729    HA   LYS  97           HA       LYS  97  18.811  -7.614  -3.668
  730    HB2  LYS  97          2HB       LYS  97  16.779  -9.811  -3.297
  731    HB3  LYS  97          1HB       LYS  97  17.543  -9.408  -4.825
  732    HG2  LYS  97          2HG       LYS  97  19.753  -9.865  -3.731
  733    HG3  LYS  97          1HG       LYS  97  18.856 -10.490  -2.346
  734    HD2  LYS  97          2HD       LYS  97  18.690 -11.517  -5.178
  735    HD3  LYS  97          1HD       LYS  97  19.543 -12.293  -3.844
  736    HE2  LYS  97          2HE       LYS  97  17.473 -12.651  -2.667
  737    HE3  LYS  97          1HE       LYS  97  16.583 -11.732  -3.880
  738    HZ1  LYS  97          1HZ       LYS  97  16.346 -14.111  -4.213
  739    HZ2  LYS  97          2HZ       LYS  97  18.019 -14.278  -4.363
  740    HZ3  LYS  97          3HZ       LYS  97  17.154 -13.402  -5.519
  741    HA   PRO  98           HA       PRO  98  14.019  -6.355  -4.512
  742    HB2  PRO  98          2HB       PRO  98  13.742  -5.628  -1.617
  743    HB3  PRO  98          1HB       PRO  98  12.488  -6.060  -2.789
  744    HG2  PRO  98          2HG       PRO  98  13.322  -7.843  -1.015
  745    HG3  PRO  98          1HG       PRO  98  12.994  -8.327  -2.688
  746    HD2  PRO  98          2HD       PRO  98  15.596  -7.956  -1.298
  747    HD3  PRO  98          1HD       PRO  98  15.158  -9.072  -2.606
  748    HA   PRO  99           HA       PRO  99  15.934  -2.500  -5.277
  749    HB2  PRO  99          2HB       PRO  99  13.178  -1.386  -5.142
  750    HB3  PRO  99          1HB       PRO  99  14.397  -1.233  -6.411
  751    HG2  PRO  99          2HG       PRO  99  12.321  -2.872  -6.709
  752    HG3  PRO  99          1HG       PRO  99  13.933  -3.319  -7.296
  753    HD2  PRO  99          2HD       PRO  99  12.452  -4.285  -4.900
  754    HD3  PRO  99          1HD       PRO  99  13.585  -5.149  -5.957
  755    H    GLU 100           H        GLU 100  16.782  -0.862  -4.167
  756    HA   GLU 100           HA       GLU 100  16.187  -0.662  -1.365
  757    HB2  GLU 100          2HB       GLU 100  18.496  -0.602  -2.211
  758    HB3  GLU 100          1HB       GLU 100  18.136   0.883  -3.077
  759    HG2  GLU 100          2HG       GLU 100  17.841   2.084  -1.081
  760    HG3  GLU 100          1HG       GLU 100  17.946   0.622  -0.099
  761    H    ILE 101           H        ILE 101  15.077   0.890  -4.139
  762    HA   ILE 101           HA       ILE 101  13.788   2.941  -2.502
  763    HB   ILE 101           HB       ILE 101  13.818   4.414  -4.602
  764   HG12  ILE 101          2HG1      ILE 101  16.157   2.629  -5.244
  765   HG13  ILE 101          1HG1      ILE 101  14.657   2.695  -6.153
  766   HG21  ILE 101          1HG2      ILE 101  15.027   4.978  -2.579
  767   HG22  ILE 101          2HG2      ILE 101  15.985   5.395  -4.000
  768   HG23  ILE 101          3HG2      ILE 101  16.370   3.946  -3.070
  769   HD11  ILE 101          1HD1      ILE 101  16.426   3.888  -7.251
  770   HD12  ILE 101          2HD1      ILE 101  16.668   4.885  -5.822
  771   HD13  ILE 101          3HD1      ILE 101  15.165   5.008  -6.737
  772    H    ASP 102           H        ASP 102  12.818   0.631  -2.814
  773    HA   ASP 102           HA       ASP 102  11.466  -0.341  -4.962
  774    HB2  ASP 102          2HB       ASP 102  11.670  -1.488  -2.805
  775    HB3  ASP 102          1HB       ASP 102  10.597  -0.314  -2.059
  776    H    ALA 103           H        ALA 103  10.684   2.249  -2.900
  777    HA   ALA 103           HA       ALA 103   8.296   3.158  -2.911
  778    HB1  ALA 103          1HB       ALA 103   9.040   5.405  -3.610
  779    HB2  ALA 103          2HB       ALA 103  10.512   4.682  -4.272
  780    HB3  ALA 103          3HB       ALA 103  10.188   4.603  -2.547
  781    H    LEU 104           H        LEU 104   9.914   3.939  -5.980
  782    HA   LEU 104           HA       LEU 104   7.469   3.207  -7.399
  783    HB2  LEU 104          2HB       LEU 104   7.644   5.309  -8.747
  784    HB3  LEU 104          1HB       LEU 104   7.138   5.532  -7.085
  785    HG   LEU 104           HG       LEU 104  10.034   5.862  -7.687
  786   HD11  LEU 104          1HD1      LEU 104   7.925   7.901  -8.393
  787   HD12  LEU 104          2HD1      LEU 104   8.969   7.050  -9.531
  788   HD13  LEU 104          3HD1      LEU 104   9.665   8.184  -8.377
  789   HD21  LEU 104          1HD2      LEU 104   9.815   7.611  -5.999
  790   HD22  LEU 104          2HD2      LEU 104   9.186   6.076  -5.408
  791   HD23  LEU 104          3HD2      LEU 104   8.075   7.338  -5.933
  792    H    GLU 105           H        GLU 105   9.915   1.807  -7.254
  793    HA   GLU 105           HA       GLU 105  11.499   2.159  -9.551
  794    HB2  GLU 105          2HB       GLU 105  10.801  -0.327  -7.988
  795    HB3  GLU 105          1HB       GLU 105  11.998  -0.291  -9.275
  796    HG2  GLU 105          2HG       GLU 105  12.119   1.402  -6.795
  797    HG3  GLU 105          1HG       GLU 105  12.946  -0.140  -7.001
  798    H    LEU 106           H        LEU 106  11.544   0.256 -11.254
  799    HA   LEU 106           HA       LEU 106   9.304   0.516 -12.915
  800    HB2  LEU 106          2HB       LEU 106  11.404  -1.650 -12.901
  801    HB3  LEU 106          1HB       LEU 106  10.288  -1.339 -14.213
  802    HG   LEU 106           HG       LEU 106  12.387   0.606 -13.254
  803   HD11  LEU 106          1HD1      LEU 106  13.402  -1.352 -14.281
  804   HD12  LEU 106          2HD1      LEU 106  13.548   0.053 -15.337
  805   HD13  LEU 106          3HD1      LEU 106  12.339  -1.185 -15.678
  806   HD21  LEU 106          1HD2      LEU 106  11.845   1.807 -15.329
  807   HD22  LEU 106          2HD2      LEU 106  10.464   1.717 -14.236
  808   HD23  LEU 106          3HD2      LEU 106  10.545   0.656 -15.642
  809    H    LYS 107           H        LYS 107   8.094  -1.436 -13.789
  810    HA   LYS 107           HA       LYS 107   6.693  -2.693 -11.629
  811    HB2  LYS 107          2HB       LYS 107   5.560  -1.888 -13.680
  812    HB3  LYS 107          1HB       LYS 107   6.430  -3.096 -14.615
  813    HG2  LYS 107          2HG       LYS 107   4.110  -3.748 -14.132
  814    HG3  LYS 107          1HG       LYS 107   5.284  -4.876 -13.457
  815    HD2  LYS 107          2HD       LYS 107   5.023  -3.830 -11.259
  816    HD3  LYS 107          1HD       LYS 107   3.854  -2.695 -11.936
  817    HE2  LYS 107          2HE       LYS 107   2.368  -4.540 -12.494
  818    HE3  LYS 107          1HE       LYS 107   3.545  -5.695 -11.875
  819    HZ1  LYS 107          1HZ       LYS 107   2.236  -3.584 -10.248
  820    HZ2  LYS 107          2HZ       LYS 107   3.270  -4.800  -9.681
  821    HZ3  LYS 107          3HZ       LYS 107   1.747  -5.205 -10.295
  822    H    THR 108           H        THR 108   9.112  -3.514 -11.211
  823    HA   THR 108           HA       THR 108   9.507  -6.155 -12.374
  824    HB   THR 108           HB       THR 108  11.491  -6.175 -10.778
  825    HG1  THR 108          1HG       THR 108  12.048  -4.001 -10.027
  826   HG21  THR 108          1HG2      THR 108  11.315  -3.944 -12.810
  827   HG22  THR 108          2HG2      THR 108  11.760  -5.620 -13.137
  828   HG23  THR 108          3HG2      THR 108  12.811  -4.606 -12.149
  829    H    GLN 109           H        GLN 109   7.934  -4.654  -9.809
  830    HA   GLN 109           HA       GLN 109   7.872  -6.996  -8.095
  831    HB2  GLN 109          2HB       GLN 109   6.417  -4.355  -7.846
  832    HB3  GLN 109          1HB       GLN 109   6.489  -5.609  -6.618
  833    HG2  GLN 109          2HG       GLN 109   8.887  -4.130  -7.668
  834    HG3  GLN 109          1HG       GLN 109   7.998  -3.682  -6.215
  835   HE21  GLN 109          1HE2      GLN 109   9.728  -3.976  -4.866
  836   HE22  GLN 109          2HE2      GLN 109  10.342  -5.551  -4.472
  837    H    LYS 110           H        LYS 110   6.639  -8.601  -8.854
  838    HA   LYS 110           HA       LYS 110   4.310  -8.052 -10.472
  839    HB2  LYS 110          2HB       LYS 110   4.140 -10.485 -10.688
  840    HB3  LYS 110          1HB       LYS 110   5.762  -9.923 -11.061
  841    HG2  LYS 110          2HG       LYS 110   6.540 -10.640  -8.881
  842    HG3  LYS 110          1HG       LYS 110   4.907 -11.140  -8.444
  843    HD2  LYS 110          2HD       LYS 110   6.532 -12.279 -10.715
  844    HD3  LYS 110          1HD       LYS 110   6.324 -13.033  -9.136
  845    HE2  LYS 110          2HE       LYS 110   3.864 -13.063  -9.548
  846    HE3  LYS 110          1HE       LYS 110   4.179 -12.469 -11.179
  847    HZ1  LYS 110          1HZ       LYS 110   5.477 -14.450 -11.621
  848    HZ2  LYS 110          2HZ       LYS 110   3.914 -14.871 -11.129
  849    HZ3  LYS 110          3HZ       LYS 110   5.204 -15.013 -10.048
  850    H    GLY 111           H        GLY 111   2.452  -9.828  -9.872
  851    HA2  GLY 111          2HA       GLY 111   1.870 -10.167  -7.123
  852    HA3  GLY 111          1HA       GLY 111   1.025  -8.756  -7.747
  853    H    PHE 112           H        PHE 112   1.107 -12.160  -7.575
  854    HA   PHE 112           HA       PHE 112  -0.939 -12.427  -9.647
  855    HB2  PHE 112          2HB       PHE 112   1.026 -13.926  -9.771
  856    HB3  PHE 112          1HB       PHE 112   0.618 -14.574  -8.188
  857    HD1  PHE 112          1HD       PHE 112  -0.689 -16.474  -8.057
  858    HD2  PHE 112          2HD       PHE 112  -0.842 -14.086 -11.574
  859    HE1  PHE 112          1HE       PHE 112  -2.135 -18.147  -9.130
  860    HE2  PHE 112          2HE       PHE 112  -2.289 -15.755 -12.652
  861    HZ   PHE 112           HZ       PHE 112  -2.940 -17.789 -11.428
  Start of MODEL   13
    1    H1   GLY   1          1HT       GLY   1  -6.006   5.225 -18.207
    2    H2   GLY   1          2HT       GLY   1  -4.745   4.969 -17.108
    3    H    GLY   1           H        GLY   1  -4.347   4.469 -17.786
    4    H3   GLY   1          3HT       GLY   1  -4.589   4.452 -18.710
    5    HA2  GLY   1          1HA       GLY   1  -4.627   6.725 -19.495
    6    HA3  GLY   1          2HA       GLY   1  -4.815   7.274 -17.834
    7    H    SER   2           H        SER   2  -2.715   8.001 -19.635
    8    HA   SER   2           HA       SER   2  -0.359   6.551 -18.801
    9    HB2  SER   2          2HB       SER   2  -0.565   9.151 -20.345
   10    HB3  SER   2          1HB       SER   2   0.846   8.097 -20.235
   11    HG   SER   2           HG       SER   2  -0.297   6.511 -21.362
   12    H    ALA   3           H        ALA   3  -1.816   9.729 -18.261
   13    HA   ALA   3           HA       ALA   3   0.148  10.320 -16.181
   14    HB1  ALA   3          1HB       ALA   3  -0.366  12.076 -17.801
   15    HB2  ALA   3          2HB       ALA   3  -0.835  12.556 -16.169
   16    HB3  ALA   3          3HB       ALA   3  -2.063  12.030 -17.321
   17    H    MET   4           H        MET   4  -1.172   8.250 -15.324
   18    HA   MET   4           HA       MET   4  -3.624   8.867 -13.988
   19    HB2  MET   4          2HB       MET   4  -3.295   6.631 -12.905
   20    HB3  MET   4          1HB       MET   4  -3.300   6.602 -14.660
   21    HG2  MET   4          2HG       MET   4  -0.849   6.495 -14.648
   22    HG3  MET   4          1HG       MET   4  -0.876   6.468 -12.886
   23    HE1  MET   4          1HE       MET   4   0.599   4.270 -14.669
   24    HE2  MET   4          2HE       MET   4   0.127   2.783 -13.849
   25    HE3  MET   4          3HE       MET   4   0.576   4.206 -12.909
   26    H    GLY   5           H        GLY   5  -3.977   9.519 -11.950
   27    HA2  GLY   5          2HA       GLY   5  -1.785  10.817 -10.639
   28    HA3  GLY   5          1HA       GLY   5  -3.462  10.813 -10.116
   29    H    HIS   6           H        HIS   6  -0.417   9.861  -9.329
   30    HA   HIS   6           HA       HIS   6  -1.415   8.212  -7.181
   31    HB2  HIS   6          2HB       HIS   6   0.304   6.402  -7.655
   32    HB3  HIS   6          1HB       HIS   6  -1.099   6.436  -8.713
   33    HD1  HIS   6          1HD       HIS   6  -0.421   5.856 -10.988
   34    HD2  HIS   6          2HD       HIS   6   2.467   8.155  -9.079
   35    HE1  HIS   6          1HE       HIS   6   1.409   6.194 -12.683
   36    HE2  HIS   6          2HE       HIS   6   3.027   7.769 -11.572
   37    H    MET   7           H        MET   7  -0.400  10.705  -6.983
   38    HA   MET   7           HA       MET   7   1.821  10.269  -5.219
   39    HB2  MET   7          2HB       MET   7   2.958  10.492  -7.412
   40    HB3  MET   7          1HB       MET   7   2.214  12.070  -7.618
   41    HG2  MET   7          2HG       MET   7   3.415  12.921  -5.702
   42    HG3  MET   7          1HG       MET   7   4.112  11.331  -5.403
   43    HE1  MET   7          1HE       MET   7   5.861  10.157  -6.985
   44    HE2  MET   7          2HE       MET   7   6.448  10.850  -8.495
   45    HE3  MET   7          3HE       MET   7   4.771  10.323  -8.362
   46    H    VAL   8           H        VAL   8   1.812  11.765  -3.593
   47    HA   VAL   8           HA       VAL   8   0.620  14.322  -3.870
   48    HB   VAL   8           HB       VAL   8  -1.461  13.175  -3.755
   49   HG11  VAL   8          1HG1      VAL   8  -0.511  11.825  -1.232
   50   HG12  VAL   8          2HG1      VAL   8  -0.632  11.055  -2.813
   51   HG13  VAL   8          3HG1      VAL   8  -2.087  11.636  -2.002
   52   HG21  VAL   8          1HG2      VAL   8  -0.808  14.363  -1.066
   53   HG22  VAL   8          2HG2      VAL   8  -2.431  14.085  -1.695
   54   HG23  VAL   8          3HG2      VAL   8  -1.361  15.237  -2.492
   55    H    LYS   9           H        LYS   9   1.150  11.927  -1.449
   56    HA   LYS   9           HA       LYS   9   3.156  13.655  -0.190
   57    HB2  LYS   9          2HB       LYS   9   1.135  11.878   1.216
   58    HB3  LYS   9          1HB       LYS   9   2.527  12.606   2.013
   59    HG2  LYS   9          2HG       LYS   9   0.241  14.054   0.720
   60    HG3  LYS   9          1HG       LYS   9   0.506  13.855   2.449
   61    HD2  LYS   9          2HD       LYS   9   2.599  15.131   2.255
   62    HD3  LYS   9          1HD       LYS   9   2.289  15.353   0.531
   63    HE2  LYS   9          2HE       LYS   9   0.171  16.489   1.096
   64    HE3  LYS   9          1HE       LYS   9   0.574  16.340   2.804
   65    HZ1  LYS   9          1HZ       LYS   9   2.579  17.660   2.376
   66    HZ2  LYS   9          2HZ       LYS   9   1.164  18.510   2.011
   67    HZ3  LYS   9          3HZ       LYS   9   2.103  17.857   0.765
   68    H    ILE  10           H        ILE  10   3.911  12.040  -2.133
   69    HA   ILE  10           HA       ILE  10   4.986   9.676  -0.809
   70    HB   ILE  10           HB       ILE  10   4.014   9.828  -3.664
   71   HG12  ILE  10          2HG1      ILE  10   2.991   8.214  -1.318
   72   HG13  ILE  10          1HG1      ILE  10   2.198   9.633  -1.994
   73   HG21  ILE  10          1HG2      ILE  10   5.298   7.559  -2.143
   74   HG22  ILE  10          2HG2      ILE  10   5.998   8.439  -3.503
   75   HG23  ILE  10          3HG2      ILE  10   4.574   7.425  -3.744
   76   HD11  ILE  10          1HD1      ILE  10   2.752   7.132  -3.559
   77   HD12  ILE  10          2HD1      ILE  10   1.733   8.494  -4.026
   78   HD13  ILE  10          3HD1      ILE  10   1.249   7.442  -2.696
   79    H    SER  11           H        SER  11   6.995  10.482  -0.457
   80    HA   SER  11           HA       SER  11   8.581  11.247  -2.795
   81    HB2  SER  11          2HB       SER  11   9.636  11.010   0.015
   82    HB3  SER  11          1HB       SER  11  10.167  12.088  -1.278
   83    HG   SER  11           HG       SER  11   7.796  12.248   0.280
   84    H    HIS  12           H        HIS  12  11.011  10.100  -2.304
   85    HA   HIS  12           HA       HIS  12  10.788   7.441  -3.100
   86    HB2  HIS  12          2HB       HIS  12  12.992   8.702  -1.456
   87    HB3  HIS  12          1HB       HIS  12  13.104   7.127  -2.228
   88    HD1  HIS  12          1HD       HIS  12  13.590   7.039  -4.720
   89    HD2  HIS  12          2HD       HIS  12  13.170  10.909  -3.255
   90    HE1  HIS  12          1HE       HIS  12  14.424   8.547  -6.549
   91    HE2  HIS  12          2HE       HIS  12  14.071  10.887  -5.682
   92    H    GLU  13           H        GLU  13  11.375   8.781   0.080
   93    HA   GLU  13           HA       GLU  13  11.420   6.400   1.516
   94    HB2  GLU  13          2HB       GLU  13  11.011   7.870   3.489
   95    HB3  GLU  13          1HB       GLU  13  12.309   8.423   2.425
   96    HG2  GLU  13          2HG       GLU  13  10.732  10.018   1.386
   97    HG3  GLU  13          1HG       GLU  13   9.515   9.530   2.563
   98    H    ASP  14           H        ASP  14   8.685   8.469   0.575
   99    HA   ASP  14           HA       ASP  14   6.901   7.208   2.409
  100    HB2  ASP  14          2HB       ASP  14   6.314   8.913   0.006
  101    HB3  ASP  14          1HB       ASP  14   5.140   8.449   1.238
  102    H    THR  15           H        THR  15   7.632   6.792  -1.045
  103    HA   THR  15           HA       THR  15   5.527   4.941  -1.510
  104    HB   THR  15           HB       THR  15   7.912   4.409  -3.093
  105    HG1  THR  15          1HG       THR  15   7.060   7.049  -2.719
  106   HG21  THR  15          1HG2      THR  15   6.280   4.896  -4.931
  107   HG22  THR  15          2HG2      THR  15   5.087   5.258  -3.686
  108   HG23  THR  15          3HG2      THR  15   5.771   3.638  -3.806
  109    H    GLN  16           H        GLN  16   8.916   4.593  -0.548
  110    HA   GLN  16           HA       GLN  16   9.056   1.818  -0.368
  111    HB2  GLN  16          2HB       GLN  16  10.323   3.963   1.336
  112    HB3  GLN  16          1HB       GLN  16  10.673   2.253   1.548
  113    HG2  GLN  16          2HG       GLN  16  11.565   2.118  -0.685
  114    HG3  GLN  16          1HG       GLN  16  11.114   3.794  -0.991
  115   HE21  GLN  16          1HE2      GLN  16  12.287   5.442  -0.039
  116   HE22  GLN  16          2HE2      GLN  16  13.843   5.184   0.668
  117    H    ARG  17           H        ARG  17   7.851   4.219   1.891
  118    HA   ARG  17           HA       ARG  17   7.399   2.572   4.092
  119    HB2  ARG  17          2HB       ARG  17   6.306   5.187   3.158
  120    HB3  ARG  17          1HB       ARG  17   5.526   4.385   4.513
  121    HG2  ARG  17          2HG       ARG  17   7.231   4.807   5.916
  122    HG3  ARG  17          1HG       ARG  17   8.451   4.605   4.663
  123    HD2  ARG  17          2HD       ARG  17   8.123   6.775   3.835
  124    HD3  ARG  17          1HD       ARG  17   6.626   6.984   4.752
  125    HE   ARG  17           HE       ARG  17   8.553   6.582   6.647
  126   HH11  ARG  17          1HH1      ARG  17   7.947   8.904   4.108
  127   HH12  ARG  17          2HH1      ARG  17   8.967  10.129   4.804
  128   HH21  ARG  17          1HH2      ARG  17   9.842   8.220   7.609
  129   HH22  ARG  17          2HH2      ARG  17  10.014   9.747   6.804
  130    H    ILE  18           H        ILE  18   5.111   3.607   1.531
  131    HA   ILE  18           HA       ILE  18   2.914   2.285   2.641
  132    HB   ILE  18           HB       ILE  18   3.368   2.904  -0.270
  133   HG12  ILE  18          2HG1      ILE  18   1.611   4.630   1.307
  134   HG13  ILE  18          1HG1      ILE  18   3.286   4.674   1.851
  135   HG21  ILE  18          1HG2      ILE  18   0.866   2.392   1.335
  136   HG22  ILE  18          2HG2      ILE  18   1.564   1.324   0.111
  137   HG23  ILE  18          3HG2      ILE  18   0.908   2.895  -0.357
  138   HD11  ILE  18          1HD1      ILE  18   2.383   5.137  -0.976
  139   HD12  ILE  18          2HD1      ILE  18   4.023   5.287  -0.336
  140   HD13  ILE  18          3HD1      ILE  18   2.761   6.402   0.195
  141    H    LYS  19           H        LYS  19   5.105   1.162   0.014
  142    HA   LYS  19           HA       LYS  19   3.816  -1.329  -0.325
  143    HB2  LYS  19          2HB       LYS  19   6.787  -0.962  -0.607
  144    HB3  LYS  19          1HB       LYS  19   5.738  -2.084  -1.458
  145    HG2  LYS  19          2HG       LYS  19   4.683  -0.266  -2.670
  146    HG3  LYS  19          1HG       LYS  19   5.693   0.899  -1.818
  147    HD2  LYS  19          2HD       LYS  19   6.598   0.511  -4.011
  148    HD3  LYS  19          1HD       LYS  19   7.698  -0.165  -2.813
  149    HE2  LYS  19          2HE       LYS  19   5.636  -1.812  -4.219
  150    HE3  LYS  19          1HE       LYS  19   7.204  -1.504  -4.940
  151    HZ1  LYS  19          1HZ       LYS  19   6.669  -2.941  -2.401
  152    HZ2  LYS  19          2HZ       LYS  19   8.210  -2.490  -2.907
  153    HZ3  LYS  19          3HZ       LYS  19   7.304  -3.582  -3.827
  154    H    THR  20           H        THR  20   6.609  -0.366   1.607
  155    HA   THR  20           HA       THR  20   7.356  -2.945   2.246
  156    HB   THR  20           HB       THR  20   8.826  -0.913   2.417
  157    HG1  THR  20          1HG       THR  20  10.105  -1.959   3.784
  158   HG21  THR  20          1HG2      THR  20   8.860   0.342   4.502
  159   HG22  THR  20          2HG2      THR  20   7.472  -0.571   5.095
  160   HG23  THR  20          3HG2      THR  20   7.291   0.506   3.711
  161    H    ALA  21           H        ALA  21   5.238  -0.690   3.940
  162    HA   ALA  21           HA       ALA  21   5.021  -2.363   6.229
  163    HB1  ALA  21          1HB       ALA  21   3.182  -0.851   6.873
  164    HB2  ALA  21          2HB       ALA  21   3.293  -0.082   5.286
  165    HB3  ALA  21          3HB       ALA  21   4.644   0.019   6.417
  166    H    PHE  22           H        PHE  22   2.643  -1.458   3.750
  167    HA   PHE  22           HA       PHE  22   0.571  -3.137   4.299
  168    HB2  PHE  22          2HB       PHE  22   0.037  -1.896   2.544
  169    HB3  PHE  22          1HB       PHE  22   1.700  -1.744   2.020
  170    HD1  PHE  22          1HD       PHE  22  -1.237  -3.941   1.877
  171    HD2  PHE  22          2HD       PHE  22   2.425  -2.802   0.093
  172    HE1  PHE  22          1HE       PHE  22  -1.841  -5.240  -0.160
  173    HE2  PHE  22          2HE       PHE  22   1.881  -4.116  -1.905
  174    HZ   PHE  22           HZ       PHE  22  -0.256  -5.332  -2.039
  175    H    LEU  23           H        LEU  23   3.317  -4.123   2.189
  176    HA   LEU  23           HA       LEU  23   2.407  -6.751   1.791
  177    HB2  LEU  23          2HB       LEU  23   5.244  -5.717   1.809
  178    HB3  LEU  23          1HB       LEU  23   4.714  -7.230   1.100
  179    HG   LEU  23           HG       LEU  23   3.591  -4.609   0.170
  180   HD11  LEU  23          1HD1      LEU  23   6.015  -4.442   0.017
  181   HD12  LEU  23          2HD1      LEU  23   5.291  -4.600  -1.586
  182   HD13  LEU  23          3HD1      LEU  23   6.078  -5.986  -0.833
  183   HD21  LEU  23          1HD2      LEU  23   3.274  -5.928  -1.907
  184   HD22  LEU  23          2HD2      LEU  23   2.379  -6.555  -0.524
  185   HD23  LEU  23          3HD2      LEU  23   3.865  -7.352  -1.050
  186    H    SER  24           H        SER  24   4.956  -5.577   4.011
  187    HA   SER  24           HA       SER  24   5.559  -8.117   5.048
  188    HB2  SER  24          2HB       SER  24   7.175  -6.449   5.149
  189    HB3  SER  24          1HB       SER  24   6.138  -5.353   6.055
  190    HG   SER  24           HG       SER  24   7.618  -7.565   6.900
  191    H    TYR  25           H        TYR  25   3.203  -5.747   5.904
  192    HA   TYR  25           HA       TYR  25   2.840  -6.555   8.594
  193    HB2  TYR  25          2HB       TYR  25   1.484  -4.668   6.709
  194    HB3  TYR  25          1HB       TYR  25   0.557  -5.195   8.130
  195    HD1  TYR  25          1HD       TYR  25   3.996  -3.956   7.316
  196    HD2  TYR  25          2HD       TYR  25   0.778  -3.985  10.088
  197    HE1  TYR  25          1HE       TYR  25   5.218  -2.371   8.720
  198    HE2  TYR  25          2HE       TYR  25   1.989  -2.389  11.513
  199    HH   TYR  25           HH       TYR  25   4.485  -1.772  11.876
  200    H    ALA  26           H        ALA  26   0.911  -7.155   5.632
  201    HA   ALA  26           HA       ALA  26  -0.913  -8.801   7.124
  202    HB1  ALA  26          1HB       ALA  26  -2.038  -9.164   5.125
  203    HB2  ALA  26          2HB       ALA  26  -0.588  -8.894   4.156
  204    HB3  ALA  26          3HB       ALA  26  -1.374  -7.536   4.969
  205    H    GLN  27           H        GLN  27   1.198  -9.687   4.379
  206    HA   GLN  27           HA       GLN  27   1.205 -12.389   5.518
  207    HB2  GLN  27          2HB       GLN  27   1.478 -11.873   2.575
  208    HB3  GLN  27          1HB       GLN  27   1.022 -13.358   3.407
  209    HG2  GLN  27          2HG       GLN  27  -1.100 -12.278   4.127
  210    HG3  GLN  27          1HG       GLN  27  -0.666 -10.881   3.145
  211   HE21  GLN  27          1HE2      GLN  27  -0.866 -10.964   0.954
  212   HE22  GLN  27          2HE2      GLN  27  -1.621 -12.299   0.126
  213    H    GLY  28           H        GLY  28   3.108  -9.838   4.215
  214    HA2  GLY  28          2HA       GLY  28   5.417  -9.714   3.933
  215    HA3  GLY  28          1HA       GLY  28   5.539 -11.421   4.348
  216    H    GLN  29           H        GLN  29   3.115 -11.457   2.211
  217    HA   GLN  29           HA       GLN  29   4.891 -12.225   0.036
  218    HB2  GLN  29          2HB       GLN  29   1.904 -12.332  -0.113
  219    HB3  GLN  29          1HB       GLN  29   3.089 -13.405  -0.840
  220    HG2  GLN  29          2HG       GLN  29   3.612 -14.309   1.374
  221    HG3  GLN  29          1HG       GLN  29   2.387 -13.245   2.072
  222   HE21  GLN  29          1HE2      GLN  29   0.669 -13.663  -0.341
  223   HE22  GLN  29          2HE2      GLN  29  -0.049 -15.218  -0.104
  224    H    ASP  30           H        ASP  30   3.283 -11.762  -2.169
  225    HA   ASP  30           HA       ASP  30   3.805  -8.998  -2.705
  226    HB2  ASP  30          2HB       ASP  30   2.633 -11.264  -4.282
  227    HB3  ASP  30          1HB       ASP  30   2.478  -9.615  -4.873
  228    H    LYS  31           H        LYS  31   1.298 -10.396  -1.058
  229    HA   LYS  31           HA       LYS  31  -0.520  -8.264  -1.844
  230    HB2  LYS  31          2HB       LYS  31  -1.246 -11.197  -1.741
  231    HB3  LYS  31          1HB       LYS  31  -2.428  -9.898  -1.784
  232    HG2  LYS  31          2HG       LYS  31  -0.864  -9.298  -3.928
  233    HG3  LYS  31          1HG       LYS  31  -0.818 -11.054  -3.935
  234    HD2  LYS  31          2HD       LYS  31  -3.315  -9.349  -3.879
  235    HD3  LYS  31          1HD       LYS  31  -2.678 -10.193  -5.287
  236    HE2  LYS  31          2HE       LYS  31  -3.464 -11.575  -2.744
  237    HE3  LYS  31          1HE       LYS  31  -4.588 -11.251  -4.057
  238    HZ1  LYS  31          1HZ       LYS  31  -3.221 -12.568  -5.530
  239    HZ2  LYS  31          2HZ       LYS  31  -3.643 -13.487  -4.176
  240    HZ3  LYS  31          3HZ       LYS  31  -2.091 -12.834  -4.302
  241    H    VAL  32           H        VAL  32  -2.542  -8.525  -0.349
  242    HA   VAL  32           HA       VAL  32  -1.590  -9.054   2.366
  243    HB   VAL  32           HB       VAL  32  -2.636  -6.516   1.221
  244   HG11  VAL  32          1HG1      VAL  32  -2.980  -5.745   3.614
  245   HG12  VAL  32          2HG1      VAL  32  -3.019  -7.453   4.056
  246   HG13  VAL  32          3HG1      VAL  32  -4.227  -6.802   2.955
  247   HG21  VAL  32          1HG2      VAL  32  -0.300  -6.711   1.500
  248   HG22  VAL  32          2HG2      VAL  32  -0.488  -7.270   3.161
  249   HG23  VAL  32          3HG2      VAL  32  -0.915  -5.617   2.735
  250    H    THR  33           H        THR  33  -2.997  -9.891   3.728
  251    HA   THR  33           HA       THR  33  -5.470 -10.933   2.835
  252    HB   THR  33           HB       THR  33  -5.783 -11.462   5.288
  253    HG1  THR  33          1HG       THR  33  -3.752 -11.131   6.519
  254   HG21  THR  33          1HG2      THR  33  -3.173 -12.286   4.015
  255   HG22  THR  33          2HG2      THR  33  -4.736 -13.069   3.784
  256   HG23  THR  33          3HG2      THR  33  -3.954 -13.109   5.364
  257    H    GLU  34           H        GLU  34  -7.492 -10.509   4.137
  258    HA   GLU  34           HA       GLU  34  -8.315  -7.882   3.817
  259    HB2  GLU  34          2HB       GLU  34 -10.262  -8.567   5.309
  260    HB3  GLU  34          1HB       GLU  34 -10.014  -9.422   3.787
  261    HG2  GLU  34          2HG       GLU  34  -8.874 -11.206   5.046
  262    HG3  GLU  34          1HG       GLU  34  -9.258 -10.369   6.545
  263    H    ALA  35           H        ALA  35  -6.566  -9.233   6.445
  264    HA   ALA  35           HA       ALA  35  -7.574  -7.733   8.609
  265    HB1  ALA  35          1HB       ALA  35  -4.776  -8.801   8.259
  266    HB2  ALA  35          2HB       ALA  35  -6.150  -9.750   8.838
  267    HB3  ALA  35          3HB       ALA  35  -5.563  -8.378   9.779
  268    H    MET  36           H        MET  36  -4.522  -7.302   6.823
  269    HA   MET  36           HA       MET  36  -4.158  -4.660   7.807
  270    HB2  MET  36          2HB       MET  36  -2.723  -6.453   5.947
  271    HB3  MET  36          1HB       MET  36  -2.454  -4.741   5.759
  272    HG2  MET  36          2HG       MET  36  -2.228  -6.086   8.413
  273    HG3  MET  36          1HG       MET  36  -0.873  -6.006   7.283
  274    HE1  MET  36          1HE       MET  36  -0.297  -3.731   6.094
  275    HE2  MET  36          2HE       MET  36  -0.546  -2.139   6.806
  276    HE3  MET  36          3HE       MET  36  -1.889  -2.977   6.036
  277    H    ILE  37           H        ILE  37  -5.793  -6.109   5.177
  278    HA   ILE  37           HA       ILE  37  -5.822  -3.788   3.518
  279    HB   ILE  37           HB       ILE  37  -6.949  -6.444   3.459
  280   HG12  ILE  37          2HG1      ILE  37  -5.672  -6.402   1.626
  281   HG13  ILE  37          1HG1      ILE  37  -6.661  -5.140   0.951
  282   HG21  ILE  37          1HG2      ILE  37  -8.538  -4.237   2.192
  283   HG22  ILE  37          2HG2      ILE  37  -9.055  -5.232   3.556
  284   HG23  ILE  37          3HG2      ILE  37  -8.792  -5.971   1.977
  285   HD11  ILE  37          1HD1      ILE  37  -4.401  -4.592   2.813
  286   HD12  ILE  37          2HD1      ILE  37  -5.326  -3.431   1.852
  287   HD13  ILE  37          3HD1      ILE  37  -4.268  -4.590   1.060
  288    H    ASP  38           H        ASP  38  -7.888  -4.982   6.091
  289    HA   ASP  38           HA       ASP  38  -9.800  -2.911   6.035
  290    HB2  ASP  38          2HB       ASP  38  -9.627  -5.242   7.226
  291    HB3  ASP  38          1HB       ASP  38  -8.915  -4.297   8.526
  292    H    GLN  39           H        GLN  39  -6.612  -3.279   7.424
  293    HA   GLN  39           HA       GLN  39  -6.528  -1.236   9.302
  294    HB2  GLN  39          2HB       GLN  39  -4.675  -2.658   9.270
  295    HB3  GLN  39          1HB       GLN  39  -4.537  -2.610   7.528
  296    HG2  GLN  39          2HG       GLN  39  -3.771  -0.258   9.226
  297    HG3  GLN  39          1HG       GLN  39  -2.680  -1.579   8.922
  298   HE21  GLN  39          1HE2      GLN  39  -2.647   1.305   8.153
  299   HE22  GLN  39          2HE2      GLN  39  -2.414   1.302   6.441
  300    H    LEU  40           H        LEU  40  -5.681  -1.110   5.872
  301    HA   LEU  40           HA       LEU  40  -5.354   1.709   5.871
  302    HB2  LEU  40          2HB       LEU  40  -4.121   0.404   4.327
  303    HB3  LEU  40          1HB       LEU  40  -5.592  -0.306   3.652
  304    HG   LEU  40           HG       LEU  40  -5.803   2.499   3.358
  305   HD11  LEU  40          1HD1      LEU  40  -3.798   3.237   2.580
  306   HD12  LEU  40          2HD1      LEU  40  -3.286   1.629   2.067
  307   HD13  LEU  40          3HD1      LEU  40  -3.238   2.063   3.777
  308   HD21  LEU  40          1HD2      LEU  40  -5.154   0.308   1.381
  309   HD22  LEU  40          2HD2      LEU  40  -5.691   1.934   0.961
  310   HD23  LEU  40          3HD2      LEU  40  -6.767   0.851   1.846
  311    H    ILE  41           H        ILE  41  -7.936  -0.425   4.617
  312    HA   ILE  41           HA       ILE  41  -9.435   1.625   3.448
  313    HB   ILE  41           HB       ILE  41 -10.269  -1.071   4.482
  314   HG12  ILE  41          2HG1      ILE  41  -8.777  -0.707   2.408
  315   HG13  ILE  41          1HG1      ILE  41 -10.170  -1.763   2.236
  316   HG21  ILE  41          1HG2      ILE  41 -12.403  -0.739   3.287
  317   HG22  ILE  41          2HG2      ILE  41 -11.965   0.951   3.030
  318   HG23  ILE  41          3HG2      ILE  41 -12.215   0.342   4.668
  319   HD11  ILE  41          1HD1      ILE  41 -10.009   1.113   1.362
  320   HD12  ILE  41          2HD1      ILE  41 -11.405   0.048   1.156
  321   HD13  ILE  41          3HD1      ILE  41  -9.893  -0.300   0.314
  322    H    CYS  42           H        CYS  42  -9.523   0.386   6.772
  323    HA   CYS  42           HA       CYS  42 -11.768   1.979   7.550
  324    HB2  CYS  42          2HB       CYS  42 -10.965  -0.123   8.722
  325    HB3  CYS  42          1HB       CYS  42  -9.632   0.830   9.358
  326    HG   CYS  42           HG       CYS  42 -12.378   0.317  10.807
  327    H    GLY  43           H        GLY  43  -8.372   2.441   7.223
  328    HA2  GLY  43          2HA       GLY  43  -7.806   4.640   8.780
  329    HA3  GLY  43          1HA       GLY  43  -7.130   4.362   7.181
  330    H    ALA  44           H        ALA  44  -9.170   4.801   5.443
  331    HA   ALA  44           HA       ALA  44  -9.670   7.652   5.840
  332    HB1  ALA  44          1HB       ALA  44 -10.335   7.706   3.520
  333    HB2  ALA  44          2HB       ALA  44 -10.256   5.947   3.431
  334    HB3  ALA  44          3HB       ALA  44  -8.783   6.881   3.688
  335    H    PHE  45           H        PHE  45 -11.612   4.822   4.848
  336    HA   PHE  45           HA       PHE  45 -13.960   6.199   5.961
  337    HB2  PHE  45          2HB       PHE  45 -14.993   4.416   4.180
  338    HB3  PHE  45          1HB       PHE  45 -14.845   6.164   3.967
  339    HD1  PHE  45          1HD       PHE  45 -12.641   3.186   3.712
  340    HD2  PHE  45          2HD       PHE  45 -13.955   6.801   1.911
  341    HE1  PHE  45          1HE       PHE  45 -11.155   2.761   1.793
  342    HE2  PHE  45          2HE       PHE  45 -12.460   6.397  -0.007
  343    HZ   PHE  45           HZ       PHE  45 -11.047   4.372  -0.063
  344    HA   PRO  46           HA       PRO  46 -14.317   2.359   8.119
  345    HB2  PRO  46          2HB       PRO  46 -15.109   3.427  10.433
  346    HB3  PRO  46          1HB       PRO  46 -13.430   3.480   9.909
  347    HG2  PRO  46          2HG       PRO  46 -15.465   5.643   9.933
  348    HG3  PRO  46          1HG       PRO  46 -13.709   5.755  10.128
  349    HD2  PRO  46          2HD       PRO  46 -15.207   6.215   7.737
  350    HD3  PRO  46          1HD       PRO  46 -13.441   6.148   7.903
  351    H    GLY  47           H        GLY  47 -16.106   1.113   8.545
  352    HA2  GLY  47          2HA       GLY  47 -18.378   0.835   9.233
  353    HA3  GLY  47          1HA       GLY  47 -18.722   2.450   8.633
  354    H    LEU  48           H        LEU  48 -16.796   0.615   6.524
  355    HA   LEU  48           HA       LEU  48 -18.857   0.511   4.549
  356    HB2  LEU  48          2HB       LEU  48 -16.114  -0.745   4.624
  357    HB3  LEU  48          1HB       LEU  48 -17.170  -0.781   3.229
  358    HG   LEU  48           HG       LEU  48 -15.881   1.653   4.460
  359   HD11  LEU  48          1HD1      LEU  48 -14.749   1.785   2.289
  360   HD12  LEU  48          2HD1      LEU  48 -15.530   0.279   1.801
  361   HD13  LEU  48          3HD1      LEU  48 -14.382   0.281   3.137
  362   HD21  LEU  48          1HD2      LEU  48 -18.088   2.267   3.701
  363   HD22  LEU  48          2HD2      LEU  48 -17.826   1.446   2.165
  364   HD23  LEU  48          3HD2      LEU  48 -16.888   2.884   2.570
  365    H    SER  49           H        SER  49 -20.265  -1.092   4.131
  366    HA   SER  49           HA       SER  49 -20.277  -3.579   5.498
  367    HB2  SER  49          2HB       SER  49 -22.311  -2.653   4.450
  368    HB3  SER  49          1HB       SER  49 -21.560  -2.787   2.860
  369    HG   SER  49           HG       SER  49 -23.022  -4.537   3.459
  370    H    TRP  50           H        TRP  50 -19.612  -5.665   4.656
  371    HA   TRP  50           HA       TRP  50 -17.113  -5.556   3.393
  372    HB2  TRP  50          2HB       TRP  50 -17.772  -7.441   4.847
  373    HB3  TRP  50          1HB       TRP  50 -18.921  -7.968   3.620
  374    HD1  TRP  50           HD       TRP  50 -15.092  -7.414   3.879
  375    HE1  TRP  50          1HE       TRP  50 -13.977  -9.165   2.350
  376    HE3  TRP  50          3HE       TRP  50 -19.286  -9.572   1.939
  377    HZ2  TRP  50          2HZ       TRP  50 -14.796 -11.181   0.587
  378    HZ3  TRP  50          3HZ       TRP  50 -19.033 -11.403   0.326
  379    HH2  TRP  50           HH       TRP  50 -16.823 -12.204  -0.340
  380    H    GLU  51           H        GLU  51 -20.333  -5.960   2.096
  381    HA   GLU  51           HA       GLU  51 -19.504  -6.762  -0.498
  382    HB2  GLU  51          2HB       GLU  51 -22.064  -5.424   0.377
  383    HB3  GLU  51          1HB       GLU  51 -21.793  -6.167  -1.196
  384    HG2  GLU  51          2HG       GLU  51 -21.309  -8.306   0.030
  385    HG3  GLU  51          1HG       GLU  51 -21.883  -7.517   1.480
  386    H    GLN  52           H        GLN  52 -20.134  -3.647   0.998
  387    HA   GLN  52           HA       GLN  52 -19.712  -2.073  -1.335
  388    HB2  GLN  52          2HB       GLN  52 -20.938  -1.170   0.545
  389    HB3  GLN  52          1HB       GLN  52 -19.571  -1.423   1.617
  390    HG2  GLN  52          2HG       GLN  52 -19.798   0.914   1.065
  391    HG3  GLN  52          1HG       GLN  52 -18.301   0.269   0.393
  392   HE21  GLN  52          1HE2      GLN  52 -18.064   0.114  -1.815
  393   HE22  GLN  52          2HE2      GLN  52 -19.146   0.887  -2.925
  394    H    LEU  53           H        LEU  53 -17.649  -3.411   1.144
  395    HA   LEU  53           HA       LEU  53 -15.370  -1.838   0.407
  396    HB2  LEU  53          2HB       LEU  53 -15.663  -2.575   2.689
  397    HB3  LEU  53          1HB       LEU  53 -15.669  -4.250   2.183
  398    HG   LEU  53           HG       LEU  53 -13.255  -2.617   1.569
  399   HD11  LEU  53          1HD1      LEU  53 -13.842  -3.818   4.285
  400   HD12  LEU  53          2HD1      LEU  53 -13.816  -2.092   3.927
  401   HD13  LEU  53          3HD1      LEU  53 -12.339  -3.045   3.783
  402   HD21  LEU  53          1HD2      LEU  53 -13.459  -4.935   0.794
  403   HD22  LEU  53          2HD2      LEU  53 -13.686  -5.474   2.460
  404   HD23  LEU  53          3HD2      LEU  53 -12.152  -4.760   1.967
  405    H    GLN  54           H        GLN  54 -16.496  -5.131  -0.196
  406    HA   GLN  54           HA       GLN  54 -14.170  -6.037  -1.468
  407    HB2  GLN  54          2HB       GLN  54 -15.428  -7.895  -2.200
  408    HB3  GLN  54          1HB       GLN  54 -16.075  -7.441  -0.644
  409    HG2  GLN  54          2HG       GLN  54 -18.014  -6.519  -1.586
  410    HG3  GLN  54          1HG       GLN  54 -17.326  -6.534  -3.206
  411   HE21  GLN  54          1HE2      GLN  54 -18.757  -8.489  -0.682
  412   HE22  GLN  54          2HE2      GLN  54 -19.113  -9.846  -1.688
  413    H    GLU  55           H        GLU  55 -17.031  -4.336  -2.717
  414    HA   GLU  55           HA       GLU  55 -16.201  -4.446  -5.436
  415    HB2  GLU  55          2HB       GLU  55 -17.870  -2.691  -5.853
  416    HB3  GLU  55          1HB       GLU  55 -18.529  -4.033  -4.933
  417    HG2  GLU  55          2HG       GLU  55 -18.481  -2.769  -2.930
  418    HG3  GLU  55          1HG       GLU  55 -17.580  -1.488  -3.682
  419    H    LYS  56           H        LYS  56 -15.522  -2.265  -2.770
  420    HA   LYS  56           HA       LYS  56 -14.257  -0.164  -4.050
  421    HB2  LYS  56          2HB       LYS  56 -14.416  -0.801  -1.433
  422    HB3  LYS  56          1HB       LYS  56 -12.818  -1.455  -1.762
  423    HG2  LYS  56          2HG       LYS  56 -12.747   0.830  -0.860
  424    HG3  LYS  56          1HG       LYS  56 -12.003   0.693  -2.453
  425    HD2  LYS  56          2HD       LYS  56 -13.331   2.716  -2.328
  426    HD3  LYS  56          1HD       LYS  56 -14.061   1.592  -3.468
  427    HE2  LYS  56          2HE       LYS  56 -15.635   0.883  -1.685
  428    HE3  LYS  56          1HE       LYS  56 -14.945   2.121  -0.635
  429    HZ1  LYS  56          1HZ       LYS  56 -16.408   2.546  -3.183
  430    HZ2  LYS  56          2HZ       LYS  56 -15.586   3.769  -2.358
  431    HZ3  LYS  56          3HZ       LYS  56 -16.902   3.002  -1.629
  432    H    LYS  57           H        LYS  57 -13.197  -3.439  -3.508
  433    HA   LYS  57           HA       LYS  57 -10.604  -2.849  -4.786
  434    HB2  LYS  57          2HB       LYS  57 -11.087  -5.328  -3.215
  435    HB3  LYS  57          1HB       LYS  57  -9.651  -4.334  -3.346
  436    HG2  LYS  57          2HG       LYS  57 -10.200  -3.032  -1.655
  437    HG3  LYS  57          1HG       LYS  57 -11.882  -3.004  -2.108
  438    HD2  LYS  57          2HD       LYS  57 -11.855  -4.112  -0.051
  439    HD3  LYS  57          1HD       LYS  57 -11.990  -5.398  -1.247
  440    HE2  LYS  57          2HE       LYS  57 -10.314  -5.688   0.659
  441    HE3  LYS  57          1HE       LYS  57  -9.769  -6.058  -0.965
  442    HZ1  LYS  57          1HZ       LYS  57  -8.156  -4.718   0.262
  443    HZ2  LYS  57          2HZ       LYS  57  -9.302  -3.491   0.456
  444    HZ3  LYS  57          3HZ       LYS  57  -8.737  -3.884  -1.088
  445    H    LYS  58           H        LYS  58 -13.449  -3.972  -5.767
  446    HA   LYS  58           HA       LYS  58 -12.950  -6.500  -6.875
  447    HB2  LYS  58          2HB       LYS  58 -14.885  -4.308  -7.485
  448    HB3  LYS  58          1HB       LYS  58 -14.714  -5.622  -8.641
  449    HG2  LYS  58          2HG       LYS  58 -15.311  -6.045  -5.723
  450    HG3  LYS  58          1HG       LYS  58 -16.557  -5.884  -6.963
  451    HD2  LYS  58          2HD       LYS  58 -14.372  -7.964  -7.002
  452    HD3  LYS  58          1HD       LYS  58 -15.989  -8.239  -6.361
  453    HE2  LYS  58          2HE       LYS  58 -16.935  -7.703  -8.568
  454    HE3  LYS  58          1HE       LYS  58 -15.305  -7.480  -9.197
  455    HZ1  LYS  58          1HZ       LYS  58 -14.836  -9.799  -8.657
  456    HZ2  LYS  58          2HZ       LYS  58 -16.130  -9.668  -9.736
  457    HZ3  LYS  58          3HZ       LYS  58 -16.420 -10.004  -8.104
  458    H    GLY  59           H        GLY  59 -11.894  -7.195  -8.603
  459    HA2  GLY  59          2HA       GLY  59 -11.176  -6.711 -10.932
  460    HA3  GLY  59          1HA       GLY  59 -10.618  -5.157 -10.328
  461    H    ARG  60           H        ARG  60  -9.389  -5.858  -7.994
  462    HA   ARG  60           HA       ARG  60  -7.148  -7.428  -9.070
  463    HB2  ARG  60          2HB       ARG  60  -6.891  -4.914  -9.068
  464    HB3  ARG  60          1HB       ARG  60  -6.865  -5.008  -7.314
  465    HG2  ARG  60          2HG       ARG  60  -4.631  -4.896  -8.286
  466    HG3  ARG  60          1HG       ARG  60  -4.895  -6.391  -7.383
  467    HD2  ARG  60          2HD       ARG  60  -5.188  -7.635  -9.385
  468    HD3  ARG  60          1HD       ARG  60  -5.238  -6.157 -10.363
  469    HE   ARG  60           HE       ARG  60  -2.807  -6.433  -8.852
  470   HH11  ARG  60          1HH1      ARG  60  -4.395  -7.359 -11.832
  471   HH12  ARG  60          2HH1      ARG  60  -2.910  -7.660 -12.675
  472   HH21  ARG  60          1HH2      ARG  60  -0.856  -6.839  -9.961
  473   HH22  ARG  60          2HH2      ARG  60  -0.899  -7.373 -11.610
  474    H    ALA  61           H        ALA  61  -8.780  -6.345  -6.101
  475    HA   ALA  61           HA       ALA  61  -7.214  -8.231  -4.530
  476    HB1  ALA  61          1HB       ALA  61  -9.579  -6.653  -3.539
  477    HB2  ALA  61          2HB       ALA  61  -7.967  -5.964  -3.648
  478    HB3  ALA  61          3HB       ALA  61  -8.259  -7.345  -2.595
  479    H    ALA  62           H        ALA  62  -9.901  -8.163  -6.449
  480    HA   ALA  62           HA       ALA  62 -11.475  -9.670  -7.047
  481    HB1  ALA  62          1HB       ALA  62 -10.044 -11.554  -5.182
  482    HB2  ALA  62          2HB       ALA  62  -9.677 -11.316  -6.892
  483    HB3  ALA  62          3HB       ALA  62 -11.230 -12.002  -6.408
  484    H    ALA  63           H        ALA  63 -10.962 -10.560  -3.653
  485    HA   ALA  63           HA       ALA  63 -13.462  -9.201  -2.958
  486    HB1  ALA  63          1HB       ALA  63 -14.013 -11.584  -3.172
  487    HB2  ALA  63          2HB       ALA  63 -14.128 -11.048  -1.497
  488    HB3  ALA  63          3HB       ALA  63 -12.730 -11.983  -2.029
  489    H    ASN  64           H        ASN  64 -10.828 -11.114  -1.545
  490    HA   ASN  64           HA       ASN  64  -9.997  -8.788  -0.013
  491    HB2  ASN  64          2HB       ASN  64 -10.976 -11.348   1.150
  492    HB3  ASN  64          1HB       ASN  64  -9.605 -10.566   1.925
  493   HD21  ASN  64          1HD2      ASN  64 -10.423  -7.891   1.318
  494   HD22  ASN  64          2HD2      ASN  64 -11.771  -7.531   2.339
  495    H    GLY  65           H        GLY  65  -8.135  -8.503  -0.965
  496    HA2  GLY  65          2HA       GLY  65  -5.841  -9.869  -0.362
  497    HA3  GLY  65          1HA       GLY  65  -6.427 -10.644  -1.827
  498    H    TYR  66           H        TYR  66  -5.686  -7.443  -0.483
  499    HA   TYR  66           HA       TYR  66  -5.461  -6.195  -3.045
  500    HB2  TYR  66          2HB       TYR  66  -5.219  -5.395  -0.301
  501    HB3  TYR  66          1HB       TYR  66  -3.862  -4.779  -1.219
  502    HD1  TYR  66          1HD       TYR  66  -5.138  -2.740  -0.126
  503    HD2  TYR  66          2HD       TYR  66  -6.534  -4.903  -3.489
  504    HE1  TYR  66          1HE       TYR  66  -6.483  -0.793  -0.791
  505    HE2  TYR  66          2HE       TYR  66  -7.895  -2.985  -4.175
  506    HH   TYR  66           HH       TYR  66  -7.506   0.100  -2.892
  507    H    ASP  67           H        ASP  67  -3.778  -5.904  -4.329
  508    HA   ASP  67           HA       ASP  67  -1.305  -7.237  -3.572
  509    HB2  ASP  67          2HB       ASP  67  -1.216  -8.056  -5.673
  510    HB3  ASP  67          1HB       ASP  67  -2.909  -7.562  -5.782
  511    H    ARG  68           H        ARG  68   0.614  -6.150  -4.608
  512    HA   ARG  68           HA       ARG  68   0.921  -3.672  -3.413
  513    HB2  ARG  68          2HB       ARG  68   3.036  -3.542  -4.883
  514    HB3  ARG  68          1HB       ARG  68   2.888  -4.912  -3.790
  515    HG2  ARG  68          2HG       ARG  68   1.830  -6.081  -5.881
  516    HG3  ARG  68          1HG       ARG  68   2.699  -4.827  -6.762
  517    HD2  ARG  68          2HD       ARG  68   4.100  -6.480  -4.698
  518    HD3  ARG  68          1HD       ARG  68   3.841  -7.113  -6.319
  519    HE   ARG  68           HE       ARG  68   5.079  -4.503  -6.232
  520   HH11  ARG  68          1HH1      ARG  68   5.621  -7.981  -6.223
  521   HH12  ARG  68          2HH1      ARG  68   7.227  -7.847  -6.873
  522   HH21  ARG  68          1HH2      ARG  68   7.196  -4.345  -7.044
  523   HH22  ARG  68          2HH2      ARG  68   8.118  -5.796  -7.345
  524    H    SER  69           H        SER  69   0.015  -4.413  -6.748
  525    HA   SER  69           HA       SER  69   0.214  -1.716  -7.665
  526    HB2  SER  69          2HB       SER  69  -1.391  -4.014  -8.804
  527    HB3  SER  69          1HB       SER  69  -0.977  -2.516  -9.638
  528    HG   SER  69           HG       SER  69   0.646  -4.702  -8.971
  529    H    ALA  70           H        ALA  70  -2.461  -3.744  -6.532
  530    HA   ALA  70           HA       ALA  70  -4.542  -1.868  -6.948
  531    HB1  ALA  70          1HB       ALA  70  -4.780  -4.355  -6.524
  532    HB2  ALA  70          2HB       ALA  70  -5.905  -3.311  -5.662
  533    HB3  ALA  70          3HB       ALA  70  -4.516  -3.995  -4.816
  534    H    PHE  71           H        PHE  71  -2.700  -2.793  -4.099
  535    HA   PHE  71           HA       PHE  71  -3.944  -1.126  -2.255
  536    HB2  PHE  71          2HB       PHE  71  -2.406  -2.993  -1.678
  537    HB3  PHE  71          1HB       PHE  71  -1.058  -2.048  -2.267
  538    HD1  PHE  71          1HD       PHE  71  -3.581  -2.319   0.368
  539    HD2  PHE  71          2HD       PHE  71  -0.130  -0.269  -0.997
  540    HE1  PHE  71          1HE       PHE  71  -3.345  -1.277   2.579
  541    HE2  PHE  71          2HE       PHE  71   0.118   0.762   1.211
  542    HZ   PHE  71           HZ       PHE  71  -1.477   0.281   2.991
  543    H    PHE  72           H        PHE  72  -1.055  -0.589  -4.258
  544    HA   PHE  72           HA       PHE  72  -0.515   1.970  -3.198
  545    HB2  PHE  72          2HB       PHE  72   1.160   0.589  -4.393
  546    HB3  PHE  72          1HB       PHE  72   0.309   0.910  -5.899
  547    HD1  PHE  72          1HD       PHE  72   1.743   2.788  -3.013
  548    HD2  PHE  72          2HD       PHE  72   1.096   2.624  -7.213
  549    HE1  PHE  72          1HE       PHE  72   3.021   4.869  -3.288
  550    HE2  PHE  72          2HE       PHE  72   2.374   4.703  -7.498
  551    HZ   PHE  72           HZ       PHE  72   3.338   5.830  -5.534
  552    H    SER  73           H        SER  73  -2.534   0.851  -5.787
  553    HA   SER  73           HA       SER  73  -2.958   3.248  -7.158
  554    HB2  SER  73          2HB       SER  73  -3.692   1.055  -8.006
  555    HB3  SER  73          1HB       SER  73  -4.897   0.960  -6.724
  556    HG   SER  73           HG       SER  73  -4.787   2.958  -8.746
  557    H    LEU  74           H        LEU  74  -4.613   1.880  -4.343
  558    HA   LEU  74           HA       LEU  74  -6.477   4.044  -4.104
  559    HB2  LEU  74          2HB       LEU  74  -6.960   1.783  -3.266
  560    HB3  LEU  74          1HB       LEU  74  -5.657   1.937  -2.106
  561    HG   LEU  74           HG       LEU  74  -6.862   3.644  -0.897
  562   HD11  LEU  74          1HD1      LEU  74  -9.123   4.322  -1.571
  563   HD12  LEU  74          2HD1      LEU  74  -8.953   3.389  -3.057
  564   HD13  LEU  74          3HD1      LEU  74  -7.917   4.786  -2.769
  565   HD21  LEU  74          1HD2      LEU  74  -7.383   1.392  -0.291
  566   HD22  LEU  74          2HD2      LEU  74  -8.513   1.244  -1.635
  567   HD23  LEU  74          3HD2      LEU  74  -8.886   2.316  -0.283
  568    H    VAL  75           H        VAL  75  -3.507   3.132  -2.403
  569    HA   VAL  75           HA       VAL  75  -3.632   5.154  -0.443
  570    HB   VAL  75           HB       VAL  75  -1.141   3.802  -1.488
  571   HG11  VAL  75          1HG1      VAL  75  -0.247   5.288  -0.076
  572   HG12  VAL  75          2HG1      VAL  75  -0.703   4.058   1.106
  573   HG13  VAL  75          3HG1      VAL  75  -1.730   5.473   0.856
  574   HG21  VAL  75          1HG2      VAL  75  -3.209   2.885   0.466
  575   HG22  VAL  75          2HG2      VAL  75  -1.547   2.300   0.523
  576   HG23  VAL  75          3HG2      VAL  75  -2.534   2.020  -0.919
  577    H    ALA  76           H        ALA  76  -2.078   5.037  -3.610
  578    HA   ALA  76           HA       ALA  76  -0.516   7.356  -3.250
  579    HB1  ALA  76          1HB       ALA  76  -0.074   7.213  -5.616
  580    HB2  ALA  76          2HB       ALA  76  -1.423   6.097  -5.821
  581    HB3  ALA  76          3HB       ALA  76  -0.011   5.610  -4.884
  582    H    SER  77           H        SER  77  -3.841   6.983  -3.935
  583    HA   SER  77           HA       SER  77  -4.028   9.723  -4.947
  584    HB2  SER  77          2HB       SER  77  -6.488   9.104  -5.212
  585    HB3  SER  77          1HB       SER  77  -5.349   8.229  -6.232
  586    HG   SER  77           HG       SER  77  -5.805   7.025  -3.801
  587    H    ASP  78           H        ASP  78  -3.957   8.164  -2.054
  588    HA   ASP  78           HA       ASP  78  -5.633  10.186  -0.716
  589    HB2  ASP  78          2HB       ASP  78  -5.446   7.228  -0.237
  590    HB3  ASP  78          1HB       ASP  78  -6.004   8.340   1.012
  591    H    GLU  79           H        GLU  79  -4.083  11.537   0.086
  592    HA   GLU  79           HA       GLU  79  -1.503  10.740   0.867
  593    HB2  GLU  79          2HB       GLU  79  -1.142  12.907   1.494
  594    HB3  GLU  79          1HB       GLU  79  -2.485  13.123   0.385
  595    HG2  GLU  79          2HG       GLU  79  -4.028  13.264   2.253
  596    HG3  GLU  79          1HG       GLU  79  -2.705  12.964   3.383
  597    H    GLN  80           H        GLN  80  -4.521  10.880   2.639
  598    HA   GLN  80           HA       GLN  80  -3.514  10.678   5.253
  599    HB2  GLN  80          2HB       GLN  80  -5.693  10.095   5.882
  600    HB3  GLN  80          1HB       GLN  80  -5.933  11.002   4.396
  601    HG2  GLN  80          2HG       GLN  80  -5.615   8.449   3.489
  602    HG3  GLN  80          1HG       GLN  80  -6.511   8.228   4.990
  603   HE21  GLN  80          1HE2      GLN  80  -7.120   8.041   2.066
  604   HE22  GLN  80          2HE2      GLN  80  -8.592   8.901   1.901
  605    H    TYR  81           H        TYR  81  -3.705   8.472   2.660
  606    HA   TYR  81           HA       TYR  81  -3.541   6.092   4.286
  607    HB2  TYR  81          2HB       TYR  81  -3.932   6.638   1.373
  608    HB3  TYR  81          1HB       TYR  81  -3.315   5.068   1.865
  609    HD1  TYR  81          1HD       TYR  81  -5.809   5.174   0.385
  610    HD2  TYR  81          2HD       TYR  81  -5.163   5.617   4.567
  611    HE1  TYR  81          1HE       TYR  81  -8.082   4.304   0.836
  612    HE2  TYR  81          2HE       TYR  81  -7.404   4.788   5.003
  613    HH   TYR  81           HH       TYR  81  -9.303   3.267   2.639
  614    H    VAL  82           H        VAL  82  -1.573   7.898   1.971
  615    HA   VAL  82           HA       VAL  82   0.618   6.171   2.067
  616    HB   VAL  82           HB       VAL  82   1.854   8.073   1.229
  617   HG11  VAL  82          1HG1      VAL  82  -0.761   7.605  -0.102
  618   HG12  VAL  82          2HG1      VAL  82   0.758   6.763  -0.409
  619   HG13  VAL  82          3HG1      VAL  82   0.585   8.457  -0.863
  620   HG21  VAL  82          1HG2      VAL  82   1.184   9.987   2.195
  621   HG22  VAL  82          2HG2      VAL  82  -0.519   9.622   1.924
  622   HG23  VAL  82          3HG2      VAL  82   0.500  10.123   0.571
  623    H    ARG  83           H        ARG  83  -0.047   9.181   3.743
  624    HA   ARG  83           HA       ARG  83   2.120   9.041   5.485
  625    HB2  ARG  83          2HB       ARG  83   1.208  10.947   6.542
  626    HB3  ARG  83          1HB       ARG  83   0.849  11.099   4.845
  627    HG2  ARG  83          2HG       ARG  83  -1.388  10.294   5.271
  628    HG3  ARG  83          1HG       ARG  83  -1.053  10.237   7.006
  629    HD2  ARG  83          2HD       ARG  83  -1.132  12.546   5.145
  630    HD3  ARG  83          1HD       ARG  83  -2.179  12.269   6.528
  631    HE   ARG  83           HE       ARG  83   0.100  12.467   7.795
  632   HH11  ARG  83          1HH1      ARG  83  -0.985  14.405   5.067
  633   HH12  ARG  83          2HH1      ARG  83  -0.033  15.781   5.521
  634   HH21  ARG  83          1HH2      ARG  83   1.325  14.288   8.386
  635   HH22  ARG  83          2HH2      ARG  83   1.263  15.723   7.412
  636    H    PHE  84           H        PHE  84  -1.083   7.629   5.620
  637    HA   PHE  84           HA       PHE  84  -1.202   7.055   8.365
  638    HB2  PHE  84          2HB       PHE  84  -2.858   6.409   6.363
  639    HB3  PHE  84          1HB       PHE  84  -1.988   4.877   6.465
  640    HD1  PHE  84          1HD       PHE  84  -2.413   3.337   8.168
  641    HD2  PHE  84          2HD       PHE  84  -4.078   7.247   8.374
  642    HE1  PHE  84          1HE       PHE  84  -3.857   2.621  10.026
  643    HE2  PHE  84          2HE       PHE  84  -5.522   6.538  10.234
  644    HZ   PHE  84           HZ       PHE  84  -5.411   4.223  11.062
  645    H    ILE  85           H        ILE  85   0.351   5.299   5.716
  646    HA   ILE  85           HA       ILE  85   1.426   3.320   7.503
  647    HB   ILE  85           HB       ILE  85   1.813   3.825   4.568
  648   HG12  ILE  85          2HG1      ILE  85   0.712   1.538   6.221
  649   HG13  ILE  85          1HG1      ILE  85  -0.203   2.631   5.192
  650   HG21  ILE  85          1HG2      ILE  85   3.997   3.234   5.376
  651   HG22  ILE  85          2HG2      ILE  85   3.308   1.842   4.541
  652   HG23  ILE  85          3HG2      ILE  85   3.334   1.891   6.303
  653   HD11  ILE  85          1HD1      ILE  85   0.036   0.474   4.140
  654   HD12  ILE  85          2HD1      ILE  85   1.793   0.554   4.267
  655   HD13  ILE  85          3HD1      ILE  85   0.923   1.686   3.223
  656    H    ALA  86           H        ALA  86   2.804   5.998   5.627
  657    HA   ALA  86           HA       ALA  86   5.427   5.885   6.365
  658    HB1  ALA  86          1HB       ALA  86   3.815   8.426   6.190
  659    HB2  ALA  86          2HB       ALA  86   4.430   7.529   4.803
  660    HB3  ALA  86          3HB       ALA  86   5.553   8.256   5.953
  661    H    GLN  87           H        GLN  87   2.774   7.253   8.286
  662    HA   GLN  87           HA       GLN  87   4.594   8.175  10.326
  663    HB2  GLN  87          2HB       GLN  87   1.579   8.142  10.167
  664    HB3  GLN  87          1HB       GLN  87   2.474   8.790  11.536
  665    HG2  GLN  87          2HG       GLN  87   3.468  10.482  10.159
  666    HG3  GLN  87          1HG       GLN  87   2.766   9.772   8.707
  667   HE21  GLN  87          1HE2      GLN  87   0.998   9.978  11.698
  668   HE22  GLN  87          2HE2      GLN  87  -0.117  11.196  11.188
  669    H    HIS  88           H        HIS  88   2.684   5.291   9.790
  670    HA   HIS  88           HA       HIS  88   3.152   4.519  12.564
  671    HB2  HIS  88          2HB       HIS  88   1.591   2.820  12.343
  672    HB3  HIS  88          1HB       HIS  88   0.952   4.046  11.265
  673    HD1  HIS  88          1HD       HIS  88   3.285   1.049  10.839
  674    HD2  HIS  88          2HD       HIS  88   0.013   2.869   9.022
  675    HE1  HIS  88          1HE       HIS  88   2.742  -0.364   8.843
  676    HE2  HIS  88          2HE       HIS  88   0.588   0.585   7.976
  677    H    PHE  89           H        PHE  89   4.684   4.248   9.572
  678    HA   PHE  89           HA       PHE  89   6.708   2.528  10.702
  679    HB2  PHE  89          2HB       PHE  89   4.983   0.978   9.711
  680    HB3  PHE  89          1HB       PHE  89   5.347   1.681   8.140
  681    HD1  PHE  89          1HD       PHE  89   7.026   0.748   6.828
  682    HD2  PHE  89          2HD       PHE  89   6.971  -0.026  11.014
  683    HE1  PHE  89          1HE       PHE  89   8.846  -0.886   6.551
  684    HE2  PHE  89          2HE       PHE  89   8.798  -1.649  10.740
  685    HZ   PHE  89           HZ       PHE  89   9.738  -2.079   8.508
  686    HA   PRO  90           HA       PRO  90   8.925   5.606   8.243
  687    HB2  PRO  90          2HB       PRO  90  11.396   4.637   8.978
  688    HB3  PRO  90          1HB       PRO  90  10.455   5.789   9.928
  689    HG2  PRO  90          2HG       PRO  90  10.709   2.828  10.243
  690    HG3  PRO  90          1HG       PRO  90  10.683   4.091  11.489
  691    HD2  PRO  90          2HD       PRO  90   8.530   2.592  10.968
  692    HD3  PRO  90          1HD       PRO  90   8.374   4.310  11.393
  693    H    CYS  91           H        CYS  91  10.595   5.519   6.526
  694    HA   CYS  91           HA       CYS  91   9.870   3.485   4.670
  695    HB2  CYS  91          2HB       CYS  91  11.429   4.699   3.141
  696    HB3  CYS  91          1HB       CYS  91  10.255   5.765   3.928
  697    HG   CYS  91           HG       CYS  91  13.454   5.374   5.086
  698    H    ALA  92           H        ALA  92  10.546   1.558   4.790
  699    HA   ALA  92           HA       ALA  92  13.445   1.094   4.948
  700    HB1  ALA  92          1HB       ALA  92  13.057  -1.021   6.077
  701    HB2  ALA  92          2HB       ALA  92  11.315  -0.712   6.096
  702    HB3  ALA  92          3HB       ALA  92  12.404   0.318   7.028
  703    HA   PRO  93           HA       PRO  93  12.768  -1.028   1.126
  704    HB2  PRO  93          2HB       PRO  93  15.107  -2.270   0.895
  705    HB3  PRO  93          1HB       PRO  93  15.039  -0.508   0.909
  706    HG2  PRO  93          2HG       PRO  93  15.711  -2.385   3.152
  707    HG3  PRO  93          1HG       PRO  93  16.552  -0.905   2.651
  708    HD2  PRO  93          2HD       PRO  93  14.740  -1.012   4.711
  709    HD3  PRO  93          1HD       PRO  93  15.067   0.448   3.755
  710    H    GLU  94           H        GLU  94  13.091  -3.337   0.213
  711    HA   GLU  94           HA       GLU  94  12.014  -5.277   2.032
  712    HB2  GLU  94          2HB       GLU  94  11.390  -5.254  -0.376
  713    HB3  GLU  94          1HB       GLU  94  13.049  -5.665  -0.782
  714    HG2  GLU  94          2HG       GLU  94  11.575  -7.613  -0.847
  715    HG3  GLU  94          1HG       GLU  94  12.848  -7.784   0.361
  716    H    GLU  95           H        GLU  95  13.360  -5.870   3.564
  717    HA   GLU  95           HA       GLU  95  16.152  -5.845   3.386
  718    HB2  GLU  95          2HB       GLU  95  14.688  -5.620   5.444
  719    HB3  GLU  95          1HB       GLU  95  14.508  -7.367   5.394
  720    HG2  GLU  95          2HG       GLU  95  16.805  -7.691   5.702
  721    HG3  GLU  95          1HG       GLU  95  17.147  -5.970   5.570
  722    H    GLU  96           H        GLU  96  13.961  -8.084   2.177
  723    HA   GLU  96           HA       GLU  96  15.972 -10.219   2.151
  724    HB2  GLU  96          2HB       GLU  96  13.024 -10.240   1.503
  725    HB3  GLU  96          1HB       GLU  96  14.090 -11.594   1.154
  726    HG2  GLU  96          2HG       GLU  96  14.651 -11.697   3.570
  727    HG3  GLU  96          1HG       GLU  96  13.440 -10.448   3.857
  728    H    LYS  97           H        LYS  97  16.517  -7.972   0.739
  729    HA   LYS  97           HA       LYS  97  17.528  -7.456  -1.227
  730    HB2  LYS  97          2HB       LYS  97  17.930  -9.873  -1.569
  731    HB3  LYS  97          1HB       LYS  97  16.351 -10.012  -2.330
  732    HG2  LYS  97          2HG       LYS  97  17.078  -8.462  -4.090
  733    HG3  LYS  97          1HG       LYS  97  18.669  -8.375  -3.334
  734    HD2  LYS  97          2HD       LYS  97  17.374 -10.877  -4.411
  735    HD3  LYS  97          1HD       LYS  97  18.631  -9.942  -5.222
  736    HE2  LYS  97          2HE       LYS  97  20.152 -10.385  -3.346
  737    HE3  LYS  97          1HE       LYS  97  18.895 -11.343  -2.563
  738    HZ1  LYS  97          1HZ       LYS  97  20.162 -11.942  -5.178
  739    HZ2  LYS  97          2HZ       LYS  97  18.931 -12.848  -4.460
  740    HZ3  LYS  97          3HZ       LYS  97  20.448 -12.754  -3.725
  741    HA   PRO  98           HA       PRO  98  13.811  -5.151  -2.376
  742    HB2  PRO  98          2HB       PRO  98  15.999  -3.672  -3.759
  743    HB3  PRO  98          1HB       PRO  98  14.667  -3.050  -2.778
  744    HG2  PRO  98          2HG       PRO  98  17.110  -3.165  -1.766
  745    HG3  PRO  98          1HG       PRO  98  15.709  -3.607  -0.773
  746    HD2  PRO  98          2HD       PRO  98  17.717  -5.368  -2.112
  747    HD3  PRO  98          1HD       PRO  98  16.933  -5.553  -0.531
  748    HA   PRO  99           HA       PRO  99  13.268  -7.054  -6.373
  749    HB2  PRO  99          2HB       PRO  99  10.922  -5.782  -6.976
  750    HB3  PRO  99          1HB       PRO  99  11.029  -7.194  -5.922
  751    HG2  PRO  99          2HG       PRO  99  10.815  -4.300  -5.203
  752    HG3  PRO  99          1HG       PRO  99  10.021  -5.702  -4.460
  753    HD2  PRO  99          2HD       PRO  99  12.177  -4.510  -3.356
  754    HD3  PRO  99          1HD       PRO  99  11.883  -6.255  -3.215
  755    H    GLU 100           H        GLU 100  13.235  -3.626  -5.742
  756    HA   GLU 100           HA       GLU 100  14.818  -3.128  -8.066
  757    HB2  GLU 100          2HB       GLU 100  12.544  -3.103  -9.056
  758    HB3  GLU 100          1HB       GLU 100  12.088  -1.823  -7.950
  759    HG2  GLU 100          2HG       GLU 100  12.564  -0.833 -10.022
  760    HG3  GLU 100          1HG       GLU 100  13.884  -0.421  -8.931
  761    H    ILE 101           H        ILE 101  12.612  -0.847  -6.497
  762    HA   ILE 101           HA       ILE 101  14.840   0.188  -4.899
  763    HB   ILE 101           HB       ILE 101  13.976   2.542  -5.437
  764   HG12  ILE 101          2HG1      ILE 101  12.858   1.067  -7.826
  765   HG13  ILE 101          1HG1      ILE 101  11.910   1.866  -6.583
  766   HG21  ILE 101          1HG2      ILE 101  16.146   1.730  -6.151
  767   HG22  ILE 101          2HG2      ILE 101  15.413   2.710  -7.420
  768   HG23  ILE 101          3HG2      ILE 101  15.417   0.953  -7.555
  769   HD11  ILE 101          1HD1      ILE 101  12.044   3.169  -8.596
  770   HD12  ILE 101          2HD1      ILE 101  13.799   3.152  -8.514
  771   HD13  ILE 101          3HD1      ILE 101  12.868   3.996  -7.277
  772    H    ASP 102           H        ASP 102  11.667  -0.809  -5.075
  773    HA   ASP 102           HA       ASP 102  10.109  -1.112  -3.464
  774    HB2  ASP 102          2HB       ASP 102  12.109   0.248  -1.649
  775    HB3  ASP 102          1HB       ASP 102  10.582  -0.406  -1.104
  776    H    ALA 103           H        ALA 103  10.649   1.409  -5.056
  777    HA   ALA 103           HA       ALA 103   8.311   2.792  -4.108
  778    HB1  ALA 103          1HB       ALA 103  10.993   4.178  -4.234
  779    HB2  ALA 103          2HB       ALA 103   9.950   4.005  -2.821
  780    HB3  ALA 103          3HB       ALA 103   9.447   5.031  -4.176
  781    H    LEU 104           H        LEU 104   7.599   4.379  -5.659
  782    HA   LEU 104           HA       LEU 104   7.163   5.232  -7.699
  783    HB2  LEU 104          2HB       LEU 104  10.039   4.538  -8.239
  784    HB3  LEU 104          1HB       LEU 104   9.059   5.598  -9.229
  785    HG   LEU 104           HG       LEU 104  10.120   7.196  -8.049
  786   HD11  LEU 104          1HD1      LEU 104   7.817   7.458  -7.340
  787   HD12  LEU 104          2HD1      LEU 104   8.938   7.973  -6.081
  788   HD13  LEU 104          3HD1      LEU 104   8.124   6.414  -5.950
  789   HD21  LEU 104          1HD2      LEU 104  10.506   5.223  -5.838
  790   HD22  LEU 104          2HD2      LEU 104  11.064   6.894  -5.784
  791   HD23  LEU 104          3HD2      LEU 104  11.704   5.790  -7.000
  792    H    GLU 105           H        GLU 105   7.445   2.135  -7.162
  793    HA   GLU 105           HA       GLU 105   7.937   0.689  -9.405
  794    HB2  GLU 105          2HB       GLU 105   7.443  -0.269  -7.231
  795    HB3  GLU 105          1HB       GLU 105   5.769   0.247  -7.359
  796    HG2  GLU 105          2HG       GLU 105   5.472  -1.249  -9.280
  797    HG3  GLU 105          1HG       GLU 105   7.142  -1.789  -9.097
  798    H    LEU 106           H        LEU 106   4.776   2.185  -8.632
  799    HA   LEU 106           HA       LEU 106   3.549   0.899 -10.889
  800    HB2  LEU 106          2HB       LEU 106   2.345   1.286  -8.767
  801    HB3  LEU 106          1HB       LEU 106   2.422   3.013  -9.056
  802    HG   LEU 106           HG       LEU 106   1.076   2.670 -11.135
  803   HD11  LEU 106          1HD1      LEU 106   0.781  -0.132 -10.064
  804   HD12  LEU 106          2HD1      LEU 106   1.620   0.335 -11.543
  805   HD13  LEU 106          3HD1      LEU 106  -0.123   0.561 -11.411
  806   HD21  LEU 106          1HD2      LEU 106  -1.045   2.357  -9.984
  807   HD22  LEU 106          2HD2      LEU 106   0.035   3.382  -9.038
  808   HD23  LEU 106          3HD2      LEU 106  -0.202   1.694  -8.585
  809    H    LYS 107           H        LYS 107   5.278   2.003 -12.266
  810    HA   LYS 107           HA       LYS 107   5.778   3.395 -13.985
  811    HB2  LYS 107          2HB       LYS 107   2.766   3.543 -14.138
  812    HB3  LYS 107          1HB       LYS 107   3.874   3.995 -15.426
  813    HG2  LYS 107          2HG       LYS 107   4.732   1.648 -15.397
  814    HG3  LYS 107          1HG       LYS 107   3.432   1.253 -14.274
  815    HD2  LYS 107          2HD       LYS 107   2.766   0.670 -16.523
  816    HD3  LYS 107          1HD       LYS 107   1.794   2.026 -15.953
  817    HE2  LYS 107          2HE       LYS 107   2.560   2.286 -18.292
  818    HE3  LYS 107          1HE       LYS 107   3.114   3.581 -17.234
  819    HZ1  LYS 107          1HZ       LYS 107   4.863   2.791 -18.721
  820    HZ2  LYS 107          2HZ       LYS 107   4.742   1.236 -18.065
  821    HZ3  LYS 107          3HZ       LYS 107   5.271   2.522 -17.103
  822    H    THR 108           H        THR 108   6.609   4.928 -12.332
  823    HA   THR 108           HA       THR 108   4.987   7.309 -11.953
  824    HB   THR 108           HB       THR 108   7.098   8.068 -10.684
  825    HG1  THR 108          1HG       THR 108   7.654   5.298 -10.528
  826   HG21  THR 108          1HG2      THR 108   5.564   5.659  -9.701
  827   HG22  THR 108          2HG2      THR 108   5.006   7.330  -9.614
  828   HG23  THR 108          3HG2      THR 108   6.425   6.826  -8.699
  829    H    GLN 109           H        GLN 109   5.164   9.083 -13.131
  830    HA   GLN 109           HA       GLN 109   6.999   9.173 -15.333
  831    HB2  GLN 109          2HB       GLN 109   4.744  10.878 -14.364
  832    HB3  GLN 109          1HB       GLN 109   5.884  11.557 -15.517
  833    HG2  GLN 109          2HG       GLN 109   3.762  10.484 -16.434
  834    HG3  GLN 109          1HG       GLN 109   5.292  10.044 -17.184
  835   HE21  GLN 109          1HE2      GLN 109   2.696   8.967 -15.118
  836   HE22  GLN 109          2HE2      GLN 109   3.065   7.281 -15.210
  837    H    LYS 110           H        LYS 110   8.925   9.100 -14.107
  838    HA   LYS 110           HA       LYS 110   9.617  11.197 -12.285
  839    HB2  LYS 110          2HB       LYS 110  11.188   8.948 -13.537
  840    HB3  LYS 110          1HB       LYS 110  11.901  10.096 -12.418
  841    HG2  LYS 110          2HG       LYS 110   9.546   8.335 -11.776
  842    HG3  LYS 110          1HG       LYS 110  11.222   7.959 -11.369
  843    HD2  LYS 110          2HD       LYS 110   9.744  10.426 -10.452
  844    HD3  LYS 110          1HD       LYS 110   9.946   8.963  -9.489
  845    HE2  LYS 110          2HE       LYS 110  12.327   9.238  -9.457
  846    HE3  LYS 110          1HE       LYS 110  12.238  10.576 -10.601
  847    HZ1  LYS 110          1HZ       LYS 110  11.067  10.607  -7.876
  848    HZ2  LYS 110          2HZ       LYS 110  11.111  11.896  -8.963
  849    HZ3  LYS 110          3HZ       LYS 110  12.546  11.308  -8.296
  850    H    GLY 111           H        GLY 111  10.356  10.429 -15.641
  851    HA2  GLY 111          2HA       GLY 111  10.934  11.970 -17.300
  852    HA3  GLY 111          1HA       GLY 111  11.223  13.175 -16.054
  853    H    PHE 112           H        PHE 112  12.817  10.895 -14.699
  854    HA   PHE 112           HA       PHE 112  15.371  11.698 -15.750
  855    HB2  PHE 112          2HB       PHE 112  14.580   9.822 -13.515
  856    HB3  PHE 112          1HB       PHE 112  16.251  10.152 -13.952
  857    HD1  PHE 112          1HD       PHE 112  13.234  11.480 -12.387
  858    HD2  PHE 112          2HD       PHE 112  17.258  12.303 -13.488
  859    HE1  PHE 112          1HE       PHE 112  13.232  13.439 -10.903
  860    HE2  PHE 112          2HE       PHE 112  17.265  14.266 -12.003
  861    HZ   PHE 112           HZ       PHE 112  15.250  14.835 -10.708
  Start of MODEL   14
    1    H1   GLY   1          1HT       GLY   1  14.916  16.107 -13.217
    2    H2   GLY   1          2HT       GLY   1  13.446  15.282 -13.103
    3    H    GLY   1           H        GLY   1  13.644  14.967 -13.978
    4    H3   GLY   1          3HT       GLY   1  14.470  15.006 -14.420
    5    HA2  GLY   1          1HA       GLY   1  16.138  14.052 -12.958
    6    HA3  GLY   1          2HA       GLY   1  15.064  14.334 -11.596
    7    H    SER   2           H        SER   2  15.385  11.956 -11.336
    8    HA   SER   2           HA       SER   2  14.120  10.220 -13.244
    9    HB2  SER   2          2HB       SER   2  15.001   9.668 -10.400
   10    HB3  SER   2          1HB       SER   2  14.537   8.452 -11.588
   11    HG   SER   2           HG       SER   2  16.668   8.505 -11.840
   12    H    ALA   3           H        ALA   3  13.113  12.066 -10.522
   13    HA   ALA   3           HA       ALA   3  10.705  10.560 -10.028
   14    HB1  ALA   3          1HB       ALA   3  10.168  12.329  -8.437
   15    HB2  ALA   3          2HB       ALA   3  11.520  13.290  -9.033
   16    HB3  ALA   3          3HB       ALA   3  11.821  11.761  -8.206
   17    H    MET   4           H        MET   4   9.062  10.633 -11.400
   18    HA   MET   4           HA       MET   4   8.795  12.776 -13.307
   19    HB2  MET   4          2HB       MET   4   8.354  10.401 -13.890
   20    HB3  MET   4          1HB       MET   4   6.973  10.416 -12.806
   21    HG2  MET   4          2HG       MET   4   5.930  12.162 -14.172
   22    HG3  MET   4          1HG       MET   4   7.304  12.101 -15.274
   23    HE1  MET   4          1HE       MET   4   7.008   8.456 -16.703
   24    HE2  MET   4          2HE       MET   4   7.890   8.905 -15.246
   25    HE3  MET   4          3HE       MET   4   7.964   9.936 -16.672
   26    H    GLY   5           H        GLY   5   7.269  11.769 -10.339
   27    HA2  GLY   5          2HA       GLY   5   6.335  13.939  -9.266
   28    HA3  GLY   5          1HA       GLY   5   5.229  13.856 -10.631
   29    H    HIS   6           H        HIS   6   3.336  13.396  -9.704
   30    HA   HIS   6           HA       HIS   6   1.687  12.283  -8.611
   31    HB2  HIS   6          2HB       HIS   6   2.819  10.436 -10.117
   32    HB3  HIS   6          1HB       HIS   6   3.331   9.781  -8.568
   33    HD1  HIS   6          1HD       HIS   6   0.681   9.550 -10.934
   34    HD2  HIS   6          2HD       HIS   6   0.914   9.388  -6.788
   35    HE1  HIS   6          1HE       HIS   6  -1.424   8.404 -10.188
   36    HE2  HIS   6          2HE       HIS   6  -1.343   8.473  -7.673
   37    H    MET   7           H        MET   7   3.517  13.691  -7.061
   38    HA   MET   7           HA       MET   7   3.791  12.028  -4.652
   39    HB2  MET   7          2HB       MET   7   5.383  14.449  -5.516
   40    HB3  MET   7          1HB       MET   7   5.550  13.660  -3.955
   41    HG2  MET   7          2HG       MET   7   6.210  11.584  -5.116
   42    HG3  MET   7          1HG       MET   7   6.130  12.449  -6.650
   43    HE1  MET   7          1HE       MET   7   7.805  14.324  -7.392
   44    HE2  MET   7          2HE       MET   7   9.036  15.021  -6.339
   45    HE3  MET   7          3HE       MET   7   7.328  15.282  -5.990
   46    H    VAL   8           H        VAL   8   2.137  12.419  -3.341
   47    HA   VAL   8           HA       VAL   8   1.168  15.161  -3.088
   48    HB   VAL   8           HB       VAL   8  -0.639  13.748  -3.744
   49   HG11  VAL   8          1HG1      VAL   8  -1.324  11.752  -2.610
   50   HG12  VAL   8          2HG1      VAL   8  -0.093  11.972  -1.371
   51   HG13  VAL   8          3HG1      VAL   8   0.383  11.595  -3.026
   52   HG21  VAL   8          1HG2      VAL   8  -1.211  15.438  -2.111
   53   HG22  VAL   8          2HG2      VAL   8  -0.829  14.328  -0.796
   54   HG23  VAL   8          3HG2      VAL   8  -2.191  13.993  -1.864
   55    H    LYS   9           H        LYS   9   1.478  12.368  -1.125
   56    HA   LYS   9           HA       LYS   9   3.153  13.835   0.754
   57    HB2  LYS   9          2HB       LYS   9   0.913  11.943   1.551
   58    HB3  LYS   9          1HB       LYS   9   2.125  12.584   2.653
   59    HG2  LYS   9          2HG       LYS   9   0.072  14.165   1.138
   60    HG3  LYS   9          1HG       LYS   9   0.034  13.782   2.857
   61    HD2  LYS   9          2HD       LYS   9   2.041  15.093   3.221
   62    HD3  LYS   9          1HD       LYS   9   2.166  15.424   1.491
   63    HE2  LYS   9          2HE       LYS   9  -0.033  16.551   1.593
   64    HE3  LYS   9          1HE       LYS   9  -0.051  16.299   3.336
   65    HZ1  LYS   9          1HZ       LYS   9   1.960  17.885   1.837
   66    HZ2  LYS   9          2HZ       LYS   9   1.959  17.634   3.508
   67    HZ3  LYS   9          3HZ       LYS   9   0.708  18.512   2.786
   68    H    ILE  10           H        ILE  10   3.909  12.343  -1.405
   69    HA   ILE  10           HA       ILE  10   4.936   9.881  -0.228
   70    HB   ILE  10           HB       ILE  10   4.111  10.214  -3.121
   71   HG12  ILE  10          2HG1      ILE  10   2.735   8.479  -1.074
   72   HG13  ILE  10          1HG1      ILE  10   2.176  10.102  -1.462
   73   HG21  ILE  10          1HG2      ILE  10   4.448   7.753  -3.201
   74   HG22  ILE  10          2HG2      ILE  10   5.091   7.824  -1.560
   75   HG23  ILE  10          3HG2      ILE  10   5.925   8.654  -2.871
   76   HD11  ILE  10          1HD1      ILE  10   2.373   7.768  -3.350
   77   HD12  ILE  10          2HD1      ILE  10   1.911   9.405  -3.813
   78   HD13  ILE  10          3HD1      ILE  10   0.902   8.488  -2.697
   79    H    SER  11           H        SER  11   6.949  10.815   0.171
   80    HA   SER  11           HA       SER  11   8.437  11.678  -2.188
   81    HB2  SER  11          2HB       SER  11   9.309  11.464   0.710
   82    HB3  SER  11          1HB       SER  11  10.258  12.161  -0.606
   83    HG   SER  11           HG       SER  11   8.734  13.505   0.909
   84    H    HIS  12           H        HIS  12  10.886  10.580  -1.756
   85    HA   HIS  12           HA       HIS  12  10.718   8.065  -2.898
   86    HB2  HIS  12          2HB       HIS  12  12.859   9.045  -1.009
   87    HB3  HIS  12          1HB       HIS  12  13.026   7.716  -2.153
   88    HD1  HIS  12          1HD       HIS  12  13.698  11.220  -1.784
   89    HD2  HIS  12          2HD       HIS  12  12.768   8.705  -4.961
   90    HE1  HIS  12          1HE       HIS  12  14.392  12.463  -3.856
   91    HE2  HIS  12          2HE       HIS  12  14.026  10.826  -5.733
   92    H    GLU  13           H        GLU  13  11.322   8.937   0.434
   93    HA   GLU  13           HA       GLU  13  11.414   6.320   1.443
   94    HB2  GLU  13          2HB       GLU  13  11.218   9.057   2.581
   95    HB3  GLU  13          1HB       GLU  13  10.967   7.675   3.653
   96    HG2  GLU  13          2HG       GLU  13  13.268   8.455   3.731
   97    HG3  GLU  13          1HG       GLU  13  13.183   6.831   3.050
   98    H    ASP  14           H        ASP  14   8.754   8.626   1.024
   99    HA   ASP  14           HA       ASP  14   6.963   7.186   2.702
  100    HB2  ASP  14          2HB       ASP  14   6.388   9.136   0.482
  101    HB3  ASP  14          1HB       ASP  14   5.204   8.537   1.643
  102    H    THR  15           H        THR  15   7.731   7.138  -0.731
  103    HA   THR  15           HA       THR  15   5.611   5.444  -1.515
  104    HB   THR  15           HB       THR  15   8.219   5.178  -2.906
  105    HG1  THR  15          1HG       THR  15   7.225   7.593  -2.295
  106   HG21  THR  15          1HG2      THR  15   6.698   5.417  -4.869
  107   HG22  THR  15          2HG2      THR  15   5.349   5.555  -3.742
  108   HG23  THR  15          3HG2      THR  15   6.295   4.067  -3.811
  109    H    GLN  16           H        GLN  16   8.915   4.855  -0.440
  110    HA   GLN  16           HA       GLN  16   8.863   2.038  -0.667
  111    HB2  GLN  16          2HB       GLN  16  10.495   3.784   1.186
  112    HB3  GLN  16          1HB       GLN  16  10.825   2.100   0.810
  113    HG2  GLN  16          2HG       GLN  16  11.393   2.622  -1.429
  114    HG3  GLN  16          1HG       GLN  16  10.780   4.264  -1.267
  115   HE21  GLN  16          1HE2      GLN  16  12.022   5.805  -0.314
  116   HE22  GLN  16          2HE2      GLN  16  13.676   5.578   0.126
  117    H    ARG  17           H        ARG  17   7.908   4.317   1.799
  118    HA   ARG  17           HA       ARG  17   7.583   2.605   3.981
  119    HB2  ARG  17          2HB       ARG  17   6.507   5.251   3.175
  120    HB3  ARG  17          1HB       ARG  17   5.626   4.395   4.428
  121    HG2  ARG  17          2HG       ARG  17   7.208   4.763   5.967
  122    HG3  ARG  17          1HG       ARG  17   8.526   4.498   4.826
  123    HD2  ARG  17          2HD       ARG  17   8.388   6.697   3.993
  124    HD3  ARG  17          1HD       ARG  17   6.844   6.995   4.811
  125    HE   ARG  17           HE       ARG  17   9.095   6.401   6.536
  126   HH11  ARG  17          1HH1      ARG  17   7.199   8.951   5.027
  127   HH12  ARG  17          2HH1      ARG  17   7.679  10.139   6.199
  128   HH21  ARG  17          1HH2      ARG  17   9.716   7.994   8.048
  129   HH22  ARG  17          2HH2      ARG  17   9.102   9.606   7.888
  130    H    ILE  18           H        ILE  18   5.183   3.688   1.558
  131    HA   ILE  18           HA       ILE  18   3.031   2.259   2.604
  132    HB   ILE  18           HB       ILE  18   3.504   2.927  -0.297
  133   HG12  ILE  18          2HG1      ILE  18   1.664   4.596   1.240
  134   HG13  ILE  18          1HG1      ILE  18   3.320   4.681   1.832
  135   HG21  ILE  18          1HG2      ILE  18   1.018   2.876  -0.388
  136   HG22  ILE  18          2HG2      ILE  18   1.015   2.242   1.264
  137   HG23  ILE  18          3HG2      ILE  18   1.755   1.310  -0.042
  138   HD11  ILE  18          1HD1      ILE  18   4.102   5.289  -0.355
  139   HD12  ILE  18          2HD1      ILE  18   2.837   6.404   0.171
  140   HD13  ILE  18          3HD1      ILE  18   2.470   5.145  -1.012
  141    H    LYS  19           H        LYS  19   5.321   1.312   0.018
  142    HA   LYS  19           HA       LYS  19   4.081  -1.165  -0.495
  143    HB2  LYS  19          2HB       LYS  19   6.357   0.240  -1.434
  144    HB3  LYS  19          1HB       LYS  19   6.892  -1.373  -0.927
  145    HG2  LYS  19          2HG       LYS  19   5.562  -2.440  -2.481
  146    HG3  LYS  19          1HG       LYS  19   4.452  -1.083  -2.636
  147    HD2  LYS  19          2HD       LYS  19   6.295   0.190  -3.749
  148    HD3  LYS  19          1HD       LYS  19   7.241  -1.301  -3.745
  149    HE2  LYS  19          2HE       LYS  19   5.427  -2.412  -4.962
  150    HE3  LYS  19          1HE       LYS  19   4.563  -0.885  -5.050
  151    HZ1  LYS  19          1HZ       LYS  19   5.710  -1.206  -7.091
  152    HZ2  LYS  19          2HZ       LYS  19   7.168  -1.538  -6.308
  153    HZ3  LYS  19          3HZ       LYS  19   6.518   0.020  -6.255
  154    H    THR  20           H        THR  20   6.866  -0.322   1.527
  155    HA   THR  20           HA       THR  20   7.573  -2.951   2.062
  156    HB   THR  20           HB       THR  20   9.070  -0.959   2.377
  157    HG1  THR  20          1HG       THR  20  10.108  -2.534   3.328
  158   HG21  THR  20          1HG2      THR  20   7.502   0.457   3.652
  159   HG22  THR  20          2HG2      THR  20   9.028   0.233   4.507
  160   HG23  THR  20          3HG2      THR  20   7.598  -0.669   5.005
  161    H    ALA  21           H        ALA  21   5.414  -0.757   3.789
  162    HA   ALA  21           HA       ALA  21   5.231  -2.453   6.063
  163    HB1  ALA  21          1HB       ALA  21   3.470  -0.172   5.180
  164    HB2  ALA  21          2HB       ALA  21   4.861  -0.065   6.263
  165    HB3  ALA  21          3HB       ALA  21   3.418  -0.945   6.768
  166    H    PHE  22           H        PHE  22   2.900  -1.590   3.542
  167    HA   PHE  22           HA       PHE  22   0.772  -3.156   4.109
  168    HB2  PHE  22          2HB       PHE  22   0.434  -1.857   2.315
  169    HB3  PHE  22          1HB       PHE  22   2.068  -2.034   1.725
  170    HD1  PHE  22          1HD       PHE  22  -1.153  -3.859   1.905
  171    HD2  PHE  22          2HD       PHE  22   2.436  -3.164  -0.221
  172    HE1  PHE  22          1HE       PHE  22  -2.074  -5.136  -0.031
  173    HE2  PHE  22          2HE       PHE  22   1.579  -4.466  -2.114
  174    HZ   PHE  22           HZ       PHE  22  -0.674  -5.445  -2.024
  175    H    LEU  23           H        LEU  23   3.461  -4.338   2.045
  176    HA   LEU  23           HA       LEU  23   2.455  -6.951   1.750
  177    HB2  LEU  23          2HB       LEU  23   5.353  -6.132   1.722
  178    HB3  LEU  23          1HB       LEU  23   4.618  -7.482   0.875
  179    HG   LEU  23           HG       LEU  23   3.743  -4.687   0.265
  180   HD11  LEU  23          1HD1      LEU  23   6.156  -4.601   0.118
  181   HD12  LEU  23          2HD1      LEU  23   5.466  -4.623  -1.507
  182   HD13  LEU  23          3HD1      LEU  23   6.181  -6.088  -0.832
  183   HD21  LEU  23          1HD2      LEU  23   3.381  -5.728  -1.966
  184   HD22  LEU  23          2HD2      LEU  23   2.420  -6.446  -0.668
  185   HD23  LEU  23          3HD2      LEU  23   3.859  -7.277  -1.268
  186    H    SER  24           H        SER  24   5.104  -5.752   3.792
  187    HA   SER  24           HA       SER  24   5.815  -8.162   4.977
  188    HB2  SER  24          2HB       SER  24   7.330  -6.429   5.036
  189    HB3  SER  24          1HB       SER  24   6.199  -5.311   5.794
  190    HG   SER  24           HG       SER  24   7.985  -6.725   7.004
  191    H    TYR  25           H        TYR  25   3.379  -5.853   5.801
  192    HA   TYR  25           HA       TYR  25   3.127  -6.641   8.509
  193    HB2  TYR  25          2HB       TYR  25   1.688  -4.763   6.686
  194    HB3  TYR  25          1HB       TYR  25   0.827  -5.359   8.122
  195    HD1  TYR  25          1HD       TYR  25   4.281  -4.132   7.351
  196    HD2  TYR  25          2HD       TYR  25   0.967  -4.048  10.009
  197    HE1  TYR  25          1HE       TYR  25   5.498  -2.571   8.794
  198    HE2  TYR  25          2HE       TYR  25   2.173  -2.480  11.469
  199    HH   TYR  25           HH       TYR  25   5.178  -1.014  10.502
  200    H    ALA  26           H        ALA  26   1.161  -7.322   5.599
  201    HA   ALA  26           HA       ALA  26  -0.690  -8.835   7.173
  202    HB1  ALA  26          1HB       ALA  26  -1.206  -7.742   4.996
  203    HB2  ALA  26          2HB       ALA  26  -1.743  -9.414   5.137
  204    HB3  ALA  26          3HB       ALA  26  -0.296  -9.027   4.202
  205    H    GLN  27           H        GLN  27   1.410 -10.049   4.513
  206    HA   GLN  27           HA       GLN  27   1.649 -12.500   6.128
  207    HB2  GLN  27          2HB       GLN  27   2.094 -12.624   3.197
  208    HB3  GLN  27          1HB       GLN  27   1.518 -13.878   4.290
  209    HG2  GLN  27          2HG       GLN  27  -0.382 -13.454   3.097
  210    HG3  GLN  27          1HG       GLN  27  -0.609 -12.301   4.421
  211   HE21  GLN  27          1HE2      GLN  27  -1.556 -12.236   1.610
  212   HE22  GLN  27          2HE2      GLN  27  -0.952 -10.736   0.979
  213    H    GLY  28           H        GLY  28   3.266 -10.047   4.345
  214    HA2  GLY  28          2HA       GLY  28   5.610  -9.788   4.151
  215    HA3  GLY  28          1HA       GLY  28   5.810 -11.488   4.553
  216    H    GLN  29           H        GLN  29   3.366 -11.764   2.499
  217    HA   GLN  29           HA       GLN  29   5.025 -12.315   0.213
  218    HB2  GLN  29          2HB       GLN  29   2.017 -12.304   0.316
  219    HB3  GLN  29          1HB       GLN  29   3.052 -13.168  -0.810
  220    HG2  GLN  29          2HG       GLN  29   3.912 -14.495   1.094
  221    HG3  GLN  29          1HG       GLN  29   2.711 -13.702   2.113
  222   HE21  GLN  29          1HE2      GLN  29   0.459 -14.036   1.583
  223   HE22  GLN  29          2HE2      GLN  29  -0.030 -15.491   0.790
  224    H    ASP  30           H        ASP  30   3.325 -11.703  -1.892
  225    HA   ASP  30           HA       ASP  30   4.005  -8.912  -2.290
  226    HB2  ASP  30          2HB       ASP  30   2.847 -10.949  -4.204
  227    HB3  ASP  30          1HB       ASP  30   3.386  -9.333  -4.641
  228    H    LYS  31           H        LYS  31   1.413 -10.333  -0.926
  229    HA   LYS  31           HA       LYS  31  -0.436  -8.312  -1.969
  230    HB2  LYS  31          2HB       LYS  31  -1.064 -11.220  -1.401
  231    HB3  LYS  31          1HB       LYS  31  -2.288  -9.985  -1.674
  232    HG2  LYS  31          2HG       LYS  31  -0.879  -9.618  -3.890
  233    HG3  LYS  31          1HG       LYS  31  -0.457 -11.294  -3.599
  234    HD2  LYS  31          2HD       LYS  31  -3.234 -10.158  -3.887
  235    HD3  LYS  31          1HD       LYS  31  -2.397 -11.197  -5.044
  236    HE2  LYS  31          2HE       LYS  31  -3.430 -11.841  -2.324
  237    HE3  LYS  31          1HE       LYS  31  -3.946 -12.527  -3.857
  238    HZ1  LYS  31          1HZ       LYS  31  -1.294 -12.941  -2.585
  239    HZ2  LYS  31          2HZ       LYS  31  -1.770 -13.574  -4.077
  240    HZ3  LYS  31          3HZ       LYS  31  -2.543 -14.078  -2.662
  241    H    VAL  32           H        VAL  32  -2.518  -8.529  -0.313
  242    HA   VAL  32           HA       VAL  32  -1.462  -8.941   2.384
  243    HB   VAL  32           HB       VAL  32  -2.658  -6.412   1.352
  244   HG11  VAL  32          1HG1      VAL  32  -2.834  -7.388   4.197
  245   HG12  VAL  32          2HG1      VAL  32  -4.177  -6.982   3.138
  246   HG13  VAL  32          3HG1      VAL  32  -3.080  -5.720   3.690
  247   HG21  VAL  32          1HG2      VAL  32  -0.945  -5.525   2.900
  248   HG22  VAL  32          2HG2      VAL  32  -0.305  -6.522   1.595
  249   HG23  VAL  32          3HG2      VAL  32  -0.448  -7.183   3.223
  250    H    THR  33           H        THR  33  -2.769  -9.782   3.837
  251    HA   THR  33           HA       THR  33  -5.256 -10.934   3.087
  252    HB   THR  33           HB       THR  33  -5.370 -11.595   5.503
  253    HG1  THR  33          1HG       THR  33  -3.657 -11.038   6.843
  254   HG21  THR  33          1HG2      THR  33  -3.428 -13.099   5.429
  255   HG22  THR  33          2HG2      THR  33  -2.754 -12.154   4.102
  256   HG23  THR  33          3HG2      THR  33  -4.262 -13.041   3.876
  257    H    GLU  34           H        GLU  34  -7.092 -10.624   4.866
  258    HA   GLU  34           HA       GLU  34  -8.238  -8.157   4.243
  259    HB2  GLU  34          2HB       GLU  34  -9.522 -10.144   4.817
  260    HB3  GLU  34          1HB       GLU  34  -8.987 -10.025   6.491
  261    HG2  GLU  34          2HG       GLU  34 -11.174  -9.135   6.404
  262    HG3  GLU  34          1HG       GLU  34 -10.079  -7.759   6.554
  263    H    ALA  35           H        ALA  35  -6.117  -8.917   6.874
  264    HA   ALA  35           HA       ALA  35  -7.256  -7.229   8.851
  265    HB1  ALA  35          1HB       ALA  35  -5.857  -9.153   9.424
  266    HB2  ALA  35          2HB       ALA  35  -5.224  -7.661  10.121
  267    HB3  ALA  35          3HB       ALA  35  -4.465  -8.355   8.689
  268    H    MET  36           H        MET  36  -4.232  -6.949   6.999
  269    HA   MET  36           HA       MET  36  -3.761  -4.277   7.776
  270    HB2  MET  36          2HB       MET  36  -2.623  -6.146   5.766
  271    HB3  MET  36          1HB       MET  36  -2.245  -4.442   5.626
  272    HG2  MET  36          2HG       MET  36  -1.782  -6.136   8.062
  273    HG3  MET  36          1HG       MET  36  -0.552  -5.672   6.883
  274    HE1  MET  36          1HE       MET  36  -0.097  -3.076   6.294
  275    HE2  MET  36          2HE       MET  36  -0.697  -1.733   7.268
  276    HE3  MET  36          3HE       MET  36  -1.814  -2.675   6.280
  277    H    ILE  37           H        ILE  37  -5.701  -5.773   5.345
  278    HA   ILE  37           HA       ILE  37  -5.827  -3.520   3.596
  279    HB   ILE  37           HB       ILE  37  -7.297  -6.053   3.868
  280   HG12  ILE  37          2HG1      ILE  37  -5.728  -6.453   2.309
  281   HG13  ILE  37          1HG1      ILE  37  -6.676  -5.428   1.269
  282   HG21  ILE  37          1HG2      ILE  37  -8.252  -3.700   2.253
  283   HG22  ILE  37          2HG2      ILE  37  -9.107  -4.495   3.578
  284   HG23  ILE  37          3HG2      ILE  37  -8.820  -5.359   2.066
  285   HD11  ILE  37          1HD1      ILE  37  -4.353  -4.794   1.224
  286   HD12  ILE  37          2HD1      ILE  37  -4.407  -4.481   2.954
  287   HD13  ILE  37          3HD1      ILE  37  -5.374  -3.502   1.848
  288    H    ASP  38           H        ASP  38  -7.945  -4.779   6.158
  289    HA   ASP  38           HA       ASP  38  -9.884  -2.817   6.188
  290    HB2  ASP  38          2HB       ASP  38  -9.641  -5.064   7.377
  291    HB3  ASP  38          1HB       ASP  38  -8.774  -4.173   8.619
  292    H    GLN  39           H        GLN  39  -6.666  -2.852   7.642
  293    HA   GLN  39           HA       GLN  39  -6.977  -0.609   9.309
  294    HB2  GLN  39          2HB       GLN  39  -4.793  -0.923   9.820
  295    HB3  GLN  39          1HB       GLN  39  -4.938  -2.381   8.858
  296    HG2  GLN  39          2HG       GLN  39  -3.004  -1.434   8.030
  297    HG3  GLN  39          1HG       GLN  39  -4.209  -0.858   6.887
  298   HE21  GLN  39          1HE2      GLN  39  -3.042   0.924   6.268
  299   HE22  GLN  39          2HE2      GLN  39  -2.776   2.274   7.315
  300    H    LEU  40           H        LEU  40  -5.904  -0.944   5.966
  301    HA   LEU  40           HA       LEU  40  -5.424   1.824   5.595
  302    HB2  LEU  40          2HB       LEU  40  -4.325   0.166   4.224
  303    HB3  LEU  40          1HB       LEU  40  -5.874  -0.387   3.582
  304    HG   LEU  40           HG       LEU  40  -5.849   2.313   2.988
  305   HD11  LEU  40          1HD1      LEU  40  -3.253   1.635   3.653
  306   HD12  LEU  40          2HD1      LEU  40  -3.773   3.065   2.758
  307   HD13  LEU  40          3HD1      LEU  40  -3.271   1.613   1.888
  308   HD21  LEU  40          1HD2      LEU  40  -4.967  -0.031   1.301
  309   HD22  LEU  40          2HD2      LEU  40  -5.433   1.554   0.684
  310   HD23  LEU  40          3HD2      LEU  40  -6.623   0.547   1.510
  311    H    ILE  41           H        ILE  41  -8.099  -0.311   4.586
  312    HA   ILE  41           HA       ILE  41  -9.483   1.707   3.204
  313    HB   ILE  41           HB       ILE  41 -10.427  -0.899   4.368
  314   HG12  ILE  41          2HG1      ILE  41  -8.783  -0.681   2.377
  315   HG13  ILE  41          1HG1      ILE  41 -10.161  -1.758   2.203
  316   HG21  ILE  41          1HG2      ILE  41 -12.351   0.533   4.321
  317   HG22  ILE  41          2HG2      ILE  41 -12.454  -0.587   2.962
  318   HG23  ILE  41          3HG2      ILE  41 -11.958   1.081   2.693
  319   HD11  ILE  41          1HD1      ILE  41 -11.330  -0.050   0.915
  320   HD12  ILE  41          2HD1      ILE  41  -9.763  -0.441   0.197
  321   HD13  ILE  41          3HD1      ILE  41  -9.958   1.044   1.126
  322    H    CYS  42           H        CYS  42  -9.841   0.594   6.577
  323    HA   CYS  42           HA       CYS  42 -12.028   2.372   7.099
  324    HB2  CYS  42          2HB       CYS  42 -10.185   0.926   9.017
  325    HB3  CYS  42          1HB       CYS  42 -11.661   1.770   9.473
  326    HG   CYS  42           HG       CYS  42 -11.321  -1.336   8.649
  327    H    GLY  43           H        GLY  43  -8.670   2.673   6.863
  328    HA2  GLY  43          2HA       GLY  43  -7.968   4.721   8.557
  329    HA3  GLY  43          1HA       GLY  43  -7.311   4.497   6.946
  330    H    ALA  44           H        ALA  44  -9.332   5.175   5.260
  331    HA   ALA  44           HA       ALA  44  -9.594   8.029   5.858
  332    HB1  ALA  44          1HB       ALA  44 -10.026   8.368   3.522
  333    HB2  ALA  44          2HB       ALA  44 -10.211   6.636   3.254
  334    HB3  ALA  44          3HB       ALA  44  -8.628   7.297   3.667
  335    H    PHE  45           H        PHE  45 -11.621   5.327   4.744
  336    HA   PHE  45           HA       PHE  45 -13.936   6.791   5.810
  337    HB2  PHE  45          2HB       PHE  45 -15.018   4.990   4.084
  338    HB3  PHE  45          1HB       PHE  45 -14.822   6.727   3.820
  339    HD1  PHE  45          1HD       PHE  45 -12.767   3.646   3.618
  340    HD2  PHE  45          2HD       PHE  45 -13.853   7.313   1.773
  341    HE1  PHE  45          1HE       PHE  45 -11.297   3.114   1.712
  342    HE2  PHE  45          2HE       PHE  45 -12.376   6.805  -0.130
  343    HZ   PHE  45           HZ       PHE  45 -11.085   4.698  -0.158
  344    HA   PRO  46           HA       PRO  46 -14.284   3.007   8.072
  345    HB2  PRO  46          2HB       PRO  46 -14.880   4.129  10.411
  346    HB3  PRO  46          1HB       PRO  46 -13.239   4.142   9.775
  347    HG2  PRO  46          2HG       PRO  46 -15.257   6.334   9.840
  348    HG3  PRO  46          1HG       PRO  46 -13.498   6.429  10.021
  349    HD2  PRO  46          2HD       PRO  46 -14.969   6.915   7.644
  350    HD3  PRO  46          1HD       PRO  46 -13.212   6.710   7.778
  351    H    GLY  47           H        GLY  47 -16.170   2.603   9.884
  352    HA2  GLY  47          2HA       GLY  47 -18.432   2.404  10.309
  353    HA3  GLY  47          1HA       GLY  47 -18.709   3.768   9.234
  354    H    LEU  48           H        LEU  48 -16.915   0.995   8.204
  355    HA   LEU  48           HA       LEU  48 -18.979   0.479   6.198
  356    HB2  LEU  48          2HB       LEU  48 -16.125  -0.494   6.320
  357    HB3  LEU  48          1HB       LEU  48 -17.230  -0.716   4.980
  358    HG   LEU  48           HG       LEU  48 -16.056   1.898   5.928
  359   HD11  LEU  48          1HD1      LEU  48 -15.669   0.287   3.410
  360   HD12  LEU  48          2HD1      LEU  48 -14.495   0.504   4.708
  361   HD13  LEU  48          3HD1      LEU  48 -14.985   1.882   3.724
  362   HD21  LEU  48          1HD2      LEU  48 -18.010   1.348   3.696
  363   HD22  LEU  48          2HD2      LEU  48 -17.187   2.882   3.979
  364   HD23  LEU  48          3HD2      LEU  48 -18.330   2.263   5.169
  365    H    SER  49           H        SER  49 -20.283  -1.222   6.448
  366    HA   SER  49           HA       SER  49 -19.719  -3.387   8.214
  367    HB2  SER  49          2HB       SER  49 -22.033  -2.755   7.513
  368    HB3  SER  49          1HB       SER  49 -21.657  -3.299   5.878
  369    HG   SER  49           HG       SER  49 -22.382  -4.742   8.056
  370    H    TRP  50           H        TRP  50 -19.195  -5.624   7.508
  371    HA   TRP  50           HA       TRP  50 -16.891  -5.573   5.957
  372    HB2  TRP  50          2HB       TRP  50 -17.381  -7.359   7.610
  373    HB3  TRP  50          1HB       TRP  50 -18.566  -8.029   6.488
  374    HD1  TRP  50           HD       TRP  50 -14.791  -7.170   6.397
  375    HE1  TRP  50          1HE       TRP  50 -13.639  -8.960   4.946
  376    HE3  TRP  50          3HE       TRP  50 -18.912  -9.872   5.064
  377    HZ2  TRP  50          2HZ       TRP  50 -14.412 -11.218   3.469
  378    HZ3  TRP  50          3HZ       TRP  50 -18.619 -11.840   3.621
  379    HH2  TRP  50           HH       TRP  50 -16.403 -12.505   2.837
  380    H    GLU  51           H        GLU  51 -20.171  -6.456   5.038
  381    HA   GLU  51           HA       GLU  51 -19.678  -7.404   2.466
  382    HB2  GLU  51          2HB       GLU  51 -22.056  -5.848   3.486
  383    HB3  GLU  51          1HB       GLU  51 -22.013  -6.738   1.971
  384    HG2  GLU  51          2HG       GLU  51 -21.568  -8.803   3.273
  385    HG3  GLU  51          1HG       GLU  51 -21.786  -7.879   4.740
  386    H    GLN  52           H        GLN  52 -20.165  -4.090   3.599
  387    HA   GLN  52           HA       GLN  52 -20.104  -2.936   0.993
  388    HB2  GLN  52          2HB       GLN  52 -20.971  -2.052   3.377
  389    HB3  GLN  52          1HB       GLN  52 -19.382  -1.304   3.374
  390    HG2  GLN  52          2HG       GLN  52 -21.339  -0.981   1.118
  391    HG3  GLN  52          1HG       GLN  52 -21.297   0.093   2.513
  392   HE21  GLN  52          1HE2      GLN  52 -19.634  -0.940  -0.362
  393   HE22  GLN  52          2HE2      GLN  52 -18.511   0.371  -0.419
  394    H    LEU  53           H        LEU  53 -17.690  -3.683   3.436
  395    HA   LEU  53           HA       LEU  53 -15.693  -2.054   2.178
  396    HB2  LEU  53          2HB       LEU  53 -15.704  -2.542   4.615
  397    HB3  LEU  53          1HB       LEU  53 -15.338  -4.217   4.256
  398    HG   LEU  53           HG       LEU  53 -13.492  -2.130   3.204
  399   HD11  LEU  53          1HD1      LEU  53 -13.874  -1.441   5.526
  400   HD12  LEU  53          2HD1      LEU  53 -12.251  -2.094   5.311
  401   HD13  LEU  53          3HD1      LEU  53 -13.504  -3.076   6.074
  402   HD21  LEU  53          1HD2      LEU  53 -13.152  -4.490   2.655
  403   HD22  LEU  53          2HD2      LEU  53 -13.060  -4.879   4.374
  404   HD23  LEU  53          3HD2      LEU  53 -11.826  -3.858   3.632
  405    H    GLN  54           H        GLN  54 -16.600  -5.457   2.165
  406    HA   GLN  54           HA       GLN  54 -14.360  -6.442   0.803
  407    HB2  GLN  54          2HB       GLN  54 -15.585  -8.413   0.401
  408    HB3  GLN  54          1HB       GLN  54 -16.117  -7.804   1.948
  409    HG2  GLN  54          2HG       GLN  54 -18.191  -7.181   1.153
  410    HG3  GLN  54          1HG       GLN  54 -17.651  -7.152  -0.522
  411   HE21  GLN  54          1HE2      GLN  54 -18.661  -9.182   2.129
  412   HE22  GLN  54          2HE2      GLN  54 -18.961 -10.594   1.182
  413    H    GLU  55           H        GLU  55 -17.425  -5.120  -0.413
  414    HA   GLU  55           HA       GLU  55 -16.799  -5.532  -3.153
  415    HB2  GLU  55          2HB       GLU  55 -18.650  -3.938  -3.598
  416    HB3  GLU  55          1HB       GLU  55 -19.102  -5.233  -2.499
  417    HG2  GLU  55          2HG       GLU  55 -18.743  -3.678  -0.616
  418    HG3  GLU  55          1HG       GLU  55 -18.429  -2.409  -1.756
  419    H    LYS  56           H        LYS  56 -16.066  -2.987  -0.858
  420    HA   LYS  56           HA       LYS  56 -15.287  -0.888  -2.458
  421    HB2  LYS  56          2HB       LYS  56 -15.101  -1.070   0.127
  422    HB3  LYS  56          1HB       LYS  56 -13.536  -1.832  -0.186
  423    HG2  LYS  56          2HG       LYS  56 -12.565   0.095  -0.851
  424    HG3  LYS  56          1HG       LYS  56 -14.049   0.749  -1.543
  425    HD2  LYS  56          2HD       LYS  56 -13.689   0.455   1.420
  426    HD3  LYS  56          1HD       LYS  56 -13.105   1.876   0.555
  427    HE2  LYS  56          2HE       LYS  56 -15.953   0.877   0.610
  428    HE3  LYS  56          1HE       LYS  56 -15.325   2.251   1.517
  429    HZ1  LYS  56          1HZ       LYS  56 -16.389   3.097  -0.401
  430    HZ2  LYS  56          2HZ       LYS  56 -15.607   2.006  -1.423
  431    HZ3  LYS  56          3HZ       LYS  56 -14.727   3.248  -0.686
  432    H    LYS  57           H        LYS  57 -13.299  -3.644  -1.460
  433    HA   LYS  57           HA       LYS  57 -11.200  -2.716  -3.264
  434    HB2  LYS  57          2HB       LYS  57 -10.491  -5.077  -1.793
  435    HB3  LYS  57          1HB       LYS  57  -9.790  -3.471  -1.717
  436    HG2  LYS  57          2HG       LYS  57 -10.500  -3.570   0.404
  437    HG3  LYS  57          1HG       LYS  57 -12.017  -3.043  -0.317
  438    HD2  LYS  57          2HD       LYS  57 -12.876  -4.820   0.729
  439    HD3  LYS  57          1HD       LYS  57 -12.205  -5.726  -0.629
  440    HE2  LYS  57          2HE       LYS  57 -10.240  -6.281   0.624
  441    HE3  LYS  57          1HE       LYS  57 -10.707  -5.191   1.920
  442    HZ1  LYS  57          1HZ       LYS  57 -11.998  -7.746   1.177
  443    HZ2  LYS  57          2HZ       LYS  57 -12.721  -6.624   2.210
  444    HZ3  LYS  57          3HZ       LYS  57 -11.252  -7.340   2.648
  445    H    LYS  58           H        LYS  58 -13.810  -4.551  -3.730
  446    HA   LYS  58           HA       LYS  58 -12.648  -6.774  -5.080
  447    HB2  LYS  58          2HB       LYS  58 -15.390  -5.560  -5.126
  448    HB3  LYS  58          1HB       LYS  58 -14.940  -6.794  -6.296
  449    HG2  LYS  58          2HG       LYS  58 -14.169  -8.092  -4.148
  450    HG3  LYS  58          1HG       LYS  58 -15.312  -7.011  -3.352
  451    HD2  LYS  58          2HD       LYS  58 -16.466  -9.032  -3.923
  452    HD3  LYS  58          1HD       LYS  58 -17.042  -7.751  -4.993
  453    HE2  LYS  58          2HE       LYS  58 -15.614  -8.551  -6.776
  454    HE3  LYS  58          1HE       LYS  58 -14.913  -9.764  -5.707
  455    HZ1  LYS  58          1HZ       LYS  58 -16.580 -10.711  -7.175
  456    HZ2  LYS  58          2HZ       LYS  58 -17.753  -9.660  -6.565
  457    HZ3  LYS  58          3HZ       LYS  58 -17.070 -10.832  -5.561
  458    H    GLY  59           H        GLY  59 -12.692  -7.120  -7.386
  459    HA2  GLY  59          2HA       GLY  59 -12.540  -6.163  -9.600
  460    HA3  GLY  59          1HA       GLY  59 -12.082  -4.637  -8.850
  461    H    ARG  60           H        ARG  60 -10.375  -6.119  -6.903
  462    HA   ARG  60           HA       ARG  60  -8.328  -7.285  -8.568
  463    HB2  ARG  60          2HB       ARG  60  -8.118  -4.679  -8.475
  464    HB3  ARG  60          1HB       ARG  60  -7.450  -4.982  -6.877
  465    HG2  ARG  60          2HG       ARG  60  -5.750  -4.764  -8.669
  466    HG3  ARG  60          1HG       ARG  60  -5.677  -6.293  -7.791
  467    HD2  ARG  60          2HD       ARG  60  -6.685  -7.477  -9.566
  468    HD3  ARG  60          1HD       ARG  60  -7.186  -5.992 -10.374
  469    HE   ARG  60           HE       ARG  60  -4.696  -5.605 -10.668
  470   HH11  ARG  60          1HH1      ARG  60  -6.084  -8.811 -10.458
  471   HH12  ARG  60          2HH1      ARG  60  -4.858  -9.550 -11.437
  472   HH21  ARG  60          1HH2      ARG  60  -3.096  -6.567 -12.002
  473   HH22  ARG  60          2HH2      ARG  60  -3.168  -8.271 -12.331
  474    H    ALA  61           H        ALA  61  -9.344  -6.252  -5.322
  475    HA   ALA  61           HA       ALA  61  -7.506  -8.133  -4.084
  476    HB1  ALA  61          1HB       ALA  61  -8.368  -5.840  -3.111
  477    HB2  ALA  61          2HB       ALA  61  -8.042  -7.210  -2.052
  478    HB3  ALA  61          3HB       ALA  61  -9.698  -6.840  -2.535
  479    H    ALA  62           H        ALA  62 -10.774  -7.859  -5.071
  480    HA   ALA  62           HA       ALA  62 -12.517  -9.313  -5.195
  481    HB1  ALA  62          1HB       ALA  62 -10.371 -11.405  -4.864
  482    HB2  ALA  62          2HB       ALA  62 -10.809 -10.634  -6.389
  483    HB3  ALA  62          3HB       ALA  62 -11.979 -11.649  -5.545
  484    H    ALA  63           H        ALA  63 -12.487 -11.987  -3.815
  485    HA   ALA  63           HA       ALA  63 -13.390 -11.121  -1.231
  486    HB1  ALA  63          1HB       ALA  63 -14.498 -12.965  -2.384
  487    HB2  ALA  63          2HB       ALA  63 -13.849 -13.491  -0.830
  488    HB3  ALA  63          3HB       ALA  63 -13.009 -13.908  -2.323
  489    H    ASN  64           H        ASN  64 -11.265 -10.114  -0.808
  490    HA   ASN  64           HA       ASN  64  -9.673  -9.985   0.811
  491    HB2  ASN  64          2HB       ASN  64 -10.139 -12.946   1.082
  492    HB3  ASN  64          1HB       ASN  64  -8.870 -12.109   1.971
  493   HD21  ASN  64          1HD2      ASN  64 -10.261  -9.695   2.367
  494   HD22  ASN  64          2HD2      ASN  64 -11.530  -9.982   3.509
  495    H    GLY  65           H        GLY  65  -7.742  -9.452   0.315
  496    HA2  GLY  65          2HA       GLY  65  -5.471 -10.378  -0.133
  497    HA3  GLY  65          1HA       GLY  65  -6.194 -11.180  -1.516
  498    H    TYR  66           H        TYR  66  -5.733  -7.897  -0.148
  499    HA   TYR  66           HA       TYR  66  -5.781  -6.648  -2.722
  500    HB2  TYR  66          2HB       TYR  66  -5.574  -5.716  -0.079
  501    HB3  TYR  66          1HB       TYR  66  -4.084  -5.236  -0.875
  502    HD1  TYR  66          1HD       TYR  66  -5.151  -3.021  -0.080
  503    HD2  TYR  66          2HD       TYR  66  -6.661  -5.286  -3.323
  504    HE1  TYR  66          1HE       TYR  66  -6.248  -1.005  -0.946
  505    HE2  TYR  66          2HE       TYR  66  -7.776  -3.292  -4.207
  506    HH   TYR  66           HH       TYR  66  -8.596  -1.124  -3.412
  507    H    ASP  67           H        ASP  67  -3.892  -5.672  -3.733
  508    HA   ASP  67           HA       ASP  67  -1.452  -7.142  -3.195
  509    HB2  ASP  67          2HB       ASP  67  -1.261  -8.005  -5.365
  510    HB3  ASP  67          1HB       ASP  67  -2.964  -8.257  -4.942
  511    H    ARG  68           H        ARG  68   0.339  -6.189  -4.485
  512    HA   ARG  68           HA       ARG  68   0.591  -3.624  -3.534
  513    HB2  ARG  68          2HB       ARG  68   2.659  -3.487  -4.982
  514    HB3  ARG  68          1HB       ARG  68   2.566  -4.880  -3.911
  515    HG2  ARG  68          2HG       ARG  68   1.910  -6.299  -5.760
  516    HG3  ARG  68          1HG       ARG  68   1.894  -4.911  -6.849
  517    HD2  ARG  68          2HD       ARG  68   4.266  -4.601  -6.559
  518    HD3  ARG  68          1HD       ARG  68   4.317  -5.869  -5.338
  519    HE   ARG  68           HE       ARG  68   3.613  -7.404  -7.209
  520   HH11  ARG  68          1HH1      ARG  68   5.375  -4.437  -7.868
  521   HH12  ARG  68          2HH1      ARG  68   6.144  -5.059  -9.289
  522   HH21  ARG  68          1HH2      ARG  68   4.649  -8.223  -9.079
  523   HH22  ARG  68          2HH2      ARG  68   5.744  -7.212  -9.965
  524    H    SER  69           H        SER  69  -0.361  -4.574  -6.829
  525    HA   SER  69           HA       SER  69  -0.098  -1.941  -7.879
  526    HB2  SER  69          2HB       SER  69  -1.304  -2.770  -9.825
  527    HB3  SER  69          1HB       SER  69  -0.108  -3.958  -9.315
  528    HG   SER  69           HG       SER  69  -1.837  -5.092  -8.254
  529    H    ALA  70           H        ALA  70  -2.836  -3.802  -6.626
  530    HA   ALA  70           HA       ALA  70  -4.812  -1.819  -7.077
  531    HB1  ALA  70          1HB       ALA  70  -5.160  -4.301  -6.631
  532    HB2  ALA  70          2HB       ALA  70  -6.255  -3.185  -5.816
  533    HB3  ALA  70          3HB       ALA  70  -4.919  -3.913  -4.922
  534    H    PHE  71           H        PHE  71  -2.996  -2.821  -4.237
  535    HA   PHE  71           HA       PHE  71  -4.090  -1.046  -2.395
  536    HB2  PHE  71          2HB       PHE  71  -2.723  -3.017  -1.788
  537    HB3  PHE  71          1HB       PHE  71  -1.302  -2.236  -2.463
  538    HD1  PHE  71          1HD       PHE  71  -3.722  -2.164   0.279
  539    HD2  PHE  71          2HD       PHE  71  -0.125  -0.540  -1.269
  540    HE1  PHE  71          1HE       PHE  71  -3.267  -1.150   2.459
  541    HE2  PHE  71          2HE       PHE  71   0.341   0.480   0.915
  542    HZ   PHE  71           HZ       PHE  71  -1.229   0.183   2.779
  543    H    PHE  72           H        PHE  72  -1.213  -0.715  -4.475
  544    HA   PHE  72           HA       PHE  72  -0.426   1.766  -3.387
  545    HB2  PHE  72          2HB       PHE  72   1.104   0.296  -4.637
  546    HB3  PHE  72          1HB       PHE  72   0.228   0.665  -6.118
  547    HD1  PHE  72          1HD       PHE  72   2.012   2.365  -3.325
  548    HD2  PHE  72          2HD       PHE  72   0.980   2.393  -7.452
  549    HE1  PHE  72          1HE       PHE  72   3.449   4.330  -3.664
  550    HE2  PHE  72          2HE       PHE  72   2.414   4.361  -7.800
  551    HZ   PHE  72           HZ       PHE  72   3.653   5.332  -5.904
  552    H    SER  73           H        SER  73  -2.533   0.920  -6.044
  553    HA   SER  73           HA       SER  73  -2.747   3.480  -7.196
  554    HB2  SER  73          2HB       SER  73  -4.788   1.243  -7.148
  555    HB3  SER  73          1HB       SER  73  -4.822   2.633  -8.230
  556    HG   SER  73           HG       SER  73  -2.789   0.645  -8.096
  557    H    LEU  74           H        LEU  74  -4.484   1.923  -4.564
  558    HA   LEU  74           HA       LEU  74  -6.375   4.022  -4.174
  559    HB2  LEU  74          2HB       LEU  74  -6.760   1.710  -3.419
  560    HB3  LEU  74          1HB       LEU  74  -5.431   1.863  -2.289
  561    HG   LEU  74           HG       LEU  74  -6.652   3.450  -0.964
  562   HD11  LEU  74          1HD1      LEU  74  -8.940   4.122  -1.547
  563   HD12  LEU  74          2HD1      LEU  74  -8.778   3.298  -3.099
  564   HD13  LEU  74          3HD1      LEU  74  -7.764   4.692  -2.730
  565   HD21  LEU  74          1HD2      LEU  74  -8.639   2.068  -0.383
  566   HD22  LEU  74          2HD2      LEU  74  -7.132   1.157  -0.491
  567   HD23  LEU  74          3HD2      LEU  74  -8.300   1.084  -1.810
  568    H    VAL  75           H        VAL  75  -3.374   3.095  -2.495
  569    HA   VAL  75           HA       VAL  75  -3.514   5.161  -0.569
  570    HB   VAL  75           HB       VAL  75  -0.979   3.810  -1.503
  571   HG11  VAL  75          1HG1      VAL  75  -0.501   4.027   0.989
  572   HG12  VAL  75          2HG1      VAL  75  -1.778   5.247   0.970
  573   HG13  VAL  75          3HG1      VAL  75  -0.351   5.450  -0.038
  574   HG21  VAL  75          1HG2      VAL  75  -3.129   2.815   0.326
  575   HG22  VAL  75          2HG2      VAL  75  -1.460   2.258   0.450
  576   HG23  VAL  75          3HG2      VAL  75  -2.375   1.988  -1.040
  577    H    ALA  76           H        ALA  76  -1.923   4.967  -3.731
  578    HA   ALA  76           HA       ALA  76  -0.408   7.336  -3.473
  579    HB1  ALA  76          1HB       ALA  76  -1.395   6.030  -6.004
  580    HB2  ALA  76          2HB       ALA  76   0.086   5.612  -5.143
  581    HB3  ALA  76          3HB       ALA  76  -0.087   7.207  -5.876
  582    H    SER  77           H        SER  77  -3.728   6.881  -3.862
  583    HA   SER  77           HA       SER  77  -4.120   9.544  -5.021
  584    HB2  SER  77          2HB       SER  77  -6.200   7.444  -4.366
  585    HB3  SER  77          1HB       SER  77  -6.418   8.884  -5.362
  586    HG   SER  77           HG       SER  77  -5.150   6.461  -5.958
  587    H    ASP  78           H        ASP  78  -3.945   7.972  -2.047
  588    HA   ASP  78           HA       ASP  78  -5.552  10.056  -0.738
  589    HB2  ASP  78          2HB       ASP  78  -5.525   7.094  -0.301
  590    HB3  ASP  78          1HB       ASP  78  -5.911   8.177   1.039
  591    H    GLU  79           H        GLU  79  -4.135  11.363   0.170
  592    HA   GLU  79           HA       GLU  79  -1.542  10.635   1.011
  593    HB2  GLU  79          2HB       GLU  79  -1.261  12.838   1.491
  594    HB3  GLU  79          1HB       GLU  79  -2.700  12.983   0.496
  595    HG2  GLU  79          2HG       GLU  79  -4.049  12.903   2.607
  596    HG3  GLU  79          1HG       GLU  79  -2.522  13.010   3.494
  597    H    GLN  80           H        GLN  80  -4.618  10.528   2.629
  598    HA   GLN  80           HA       GLN  80  -3.649  10.415   5.289
  599    HB2  GLN  80          2HB       GLN  80  -6.082   8.897   4.376
  600    HB3  GLN  80          1HB       GLN  80  -5.794   9.674   5.923
  601    HG2  GLN  80          2HG       GLN  80  -7.308  11.091   4.965
  602    HG3  GLN  80          1HG       GLN  80  -5.785  11.861   4.537
  603   HE21  GLN  80          1HE2      GLN  80  -6.999   8.946   2.995
  604   HE22  GLN  80          2HE2      GLN  80  -7.345   9.673   1.462
  605    H    TYR  81           H        TYR  81  -3.693   8.244   2.666
  606    HA   TYR  81           HA       TYR  81  -3.524   5.851   4.272
  607    HB2  TYR  81          2HB       TYR  81  -3.801   6.386   1.330
  608    HB3  TYR  81          1HB       TYR  81  -3.377   4.785   1.930
  609    HD1  TYR  81          1HD       TYR  81  -5.773   4.956   0.380
  610    HD2  TYR  81          2HD       TYR  81  -5.260   5.816   4.500
  611    HE1  TYR  81          1HE       TYR  81  -8.133   4.366   0.781
  612    HE2  TYR  81          2HE       TYR  81  -7.595   5.273   4.906
  613    HH   TYR  81           HH       TYR  81  -9.522   3.638   2.697
  614    H    VAL  82           H        VAL  82  -1.525   7.734   2.022
  615    HA   VAL  82           HA       VAL  82   0.701   6.073   2.142
  616    HB   VAL  82           HB       VAL  82   1.889   8.045   1.414
  617   HG11  VAL  82          1HG1      VAL  82   0.853   6.783  -0.302
  618   HG12  VAL  82          2HG1      VAL  82   0.659   8.497  -0.681
  619   HG13  VAL  82          3HG1      VAL  82  -0.686   7.584   0.010
  620   HG21  VAL  82          1HG2      VAL  82  -0.559   9.504   2.084
  621   HG22  VAL  82          2HG2      VAL  82   0.541  10.099   0.840
  622   HG23  VAL  82          3HG2      VAL  82   1.116   9.878   2.492
  623    H    ARG  83           H        ARG  83  -0.153   8.972   3.890
  624    HA   ARG  83           HA       ARG  83   1.882   8.965   5.777
  625    HB2  ARG  83          2HB       ARG  83  -0.900  10.086   5.762
  626    HB3  ARG  83          1HB       ARG  83   0.181  10.320   7.104
  627    HG2  ARG  83          2HG       ARG  83   1.770  11.453   5.600
  628    HG3  ARG  83          1HG       ARG  83   0.574  11.276   4.307
  629    HD2  ARG  83          2HD       ARG  83  -0.897  12.658   5.242
  630    HD3  ARG  83          1HD       ARG  83  -0.242  12.505   6.867
  631    HE   ARG  83           HE       ARG  83   1.676  13.709   5.206
  632   HH11  ARG  83          1HH1      ARG  83  -1.436  14.429   6.640
  633   HH12  ARG  83          2HH1      ARG  83  -1.121  16.129   6.784
  634   HH21  ARG  83          1HH2      ARG  83   2.107  15.937   5.419
  635   HH22  ARG  83          2HH2      ARG  83   0.900  16.988   6.086
  636    H    PHE  84           H        PHE  84  -1.180   7.265   5.658
  637    HA   PHE  84           HA       PHE  84  -1.377   6.591   8.372
  638    HB2  PHE  84          2HB       PHE  84  -2.794   5.891   6.100
  639    HB3  PHE  84          1HB       PHE  84  -2.073   4.358   6.608
  640    HD1  PHE  84          1HD       PHE  84  -2.538   3.464   8.834
  641    HD2  PHE  84          2HD       PHE  84  -4.562   6.886   7.338
  642    HE1  PHE  84          1HE       PHE  84  -4.269   3.194  10.568
  643    HE2  PHE  84          2HE       PHE  84  -6.298   6.624   9.061
  644    HZ   PHE  84           HZ       PHE  84  -6.152   4.777  10.682
  645    H    ILE  85           H        ILE  85   0.298   5.011   5.721
  646    HA   ILE  85           HA       ILE  85   1.373   2.970   7.447
  647    HB   ILE  85           HB       ILE  85   1.717   3.592   4.539
  648   HG12  ILE  85          2HG1      ILE  85   0.923   1.141   6.134
  649   HG13  ILE  85          1HG1      ILE  85  -0.156   2.192   5.224
  650   HG21  ILE  85          1HG2      ILE  85   3.505   1.828   6.192
  651   HG22  ILE  85          2HG2      ILE  85   3.972   3.193   5.180
  652   HG23  ILE  85          3HG2      ILE  85   3.376   1.708   4.438
  653   HD11  ILE  85          1HD1      ILE  85   0.228   0.131   4.033
  654   HD12  ILE  85          2HD1      ILE  85   1.971   0.380   4.070
  655   HD13  ILE  85          3HD1      ILE  85   0.936   1.475   3.141
  656    H    ALA  86           H        ALA  86   2.746   5.764   5.720
  657    HA   ALA  86           HA       ALA  86   5.361   5.611   6.522
  658    HB1  ALA  86          1HB       ALA  86   5.483   8.013   6.176
  659    HB2  ALA  86          2HB       ALA  86   3.727   8.130   6.264
  660    HB3  ALA  86          3HB       ALA  86   4.485   7.258   4.934
  661    H    GLN  87           H        GLN  87   2.624   6.821   8.366
  662    HA   GLN  87           HA       GLN  87   4.227   7.831  10.522
  663    HB2  GLN  87          2HB       GLN  87   2.054   8.812   9.965
  664    HB3  GLN  87          1HB       GLN  87   1.261   7.292  10.343
  665    HG2  GLN  87          2HG       GLN  87   2.000   7.507  12.673
  666    HG3  GLN  87          1HG       GLN  87   2.734   9.060  12.278
  667   HE21  GLN  87          1HE2      GLN  87   0.569   9.744  10.422
  668   HE22  GLN  87          2HE2      GLN  87  -0.785  10.170  11.404
  669    H    HIS  88           H        HIS  88   2.377   4.873   9.899
  670    HA   HIS  88           HA       HIS  88   2.911   3.959  12.600
  671    HB2  HIS  88          2HB       HIS  88   1.331   2.292  12.292
  672    HB3  HIS  88          1HB       HIS  88   0.720   3.564  11.252
  673    HD1  HIS  88          1HD       HIS  88   3.009   0.552  10.755
  674    HD2  HIS  88          2HD       HIS  88  -0.198   2.491   8.955
  675    HE1  HIS  88          1HE       HIS  88   2.476  -0.784   8.698
  676    HE2  HIS  88          2HE       HIS  88   0.361   0.246   7.821
  677    H    PHE  89           H        PHE  89   4.585   3.963   9.738
  678    HA   PHE  89           HA       PHE  89   6.632   2.273  10.780
  679    HB2  PHE  89          2HB       PHE  89   4.947   0.641   9.833
  680    HB3  PHE  89          1HB       PHE  89   5.270   1.343   8.254
  681    HD1  PHE  89          1HD       PHE  89   6.947   0.433   6.928
  682    HD2  PHE  89          2HD       PHE  89   6.994  -0.259  11.128
  683    HE1  PHE  89          1HE       PHE  89   8.812  -1.147   6.649
  684    HE2  PHE  89          2HE       PHE  89   8.862  -1.831  10.855
  685    HZ   PHE  89           HZ       PHE  89   9.773  -2.278   8.613
  686    HA   PRO  90           HA       PRO  90   8.501   5.392   8.077
  687    HB2  PRO  90          2HB       PRO  90  11.044   4.982   8.950
  688    HB3  PRO  90          1HB       PRO  90   9.870   5.968   9.829
  689    HG2  PRO  90          2HG       PRO  90  10.695   3.131  10.302
  690    HG3  PRO  90          1HG       PRO  90  10.414   4.428  11.480
  691    HD2  PRO  90          2HD       PRO  90   8.587   2.498  10.977
  692    HD3  PRO  90          1HD       PRO  90   8.125   4.153  11.424
  693    H    CYS  91           H        CYS  91  10.377   5.306   6.486
  694    HA   CYS  91           HA       CYS  91   9.982   2.994   4.860
  695    HB2  CYS  91          2HB       CYS  91  10.281   5.097   3.721
  696    HB3  CYS  91          1HB       CYS  91  11.806   5.385   4.537
  697    HG   CYS  91           HG       CYS  91  12.885   2.928   3.316
  698    H    ALA  92           H        ALA  92  11.236   1.383   4.408
  699    HA   ALA  92           HA       ALA  92  12.829   0.356   6.463
  700    HB1  ALA  92          1HB       ALA  92  12.809  -0.538   3.586
  701    HB2  ALA  92          2HB       ALA  92  11.649  -1.040   4.816
  702    HB3  ALA  92          3HB       ALA  92  13.355  -1.471   4.984
  703    HA   PRO  93           HA       PRO  93  16.791   2.091   5.648
  704    HB2  PRO  93          2HB       PRO  93  18.273   0.485   7.168
  705    HB3  PRO  93          1HB       PRO  93  17.054   1.531   7.897
  706    HG2  PRO  93          2HG       PRO  93  16.866  -1.385   7.208
  707    HG3  PRO  93          1HG       PRO  93  16.402  -0.570   8.715
  708    HD2  PRO  93          2HD       PRO  93  14.622  -1.207   6.742
  709    HD3  PRO  93          1HD       PRO  93  14.415   0.180   7.837
  710    H    GLU  94           H        GLU  94  18.752   1.689   4.555
  711    HA   GLU  94           HA       GLU  94  18.695  -0.472   2.656
  712    HB2  GLU  94          2HB       GLU  94  20.776   1.656   3.200
  713    HB3  GLU  94          1HB       GLU  94  20.844   0.509   1.868
  714    HG2  GLU  94          2HG       GLU  94  18.763   1.425   0.973
  715    HG3  GLU  94          1HG       GLU  94  18.697   2.573   2.308
  716    H    GLU  95           H        GLU  95  18.664  -2.102   4.391
  717    HA   GLU  95           HA       GLU  95  20.734  -2.618   6.167
  718    HB2  GLU  95          2HB       GLU  95  19.141  -4.721   4.702
  719    HB3  GLU  95          1HB       GLU  95  19.911  -4.872   6.270
  720    HG2  GLU  95          2HG       GLU  95  18.378  -3.380   7.264
  721    HG3  GLU  95          1HG       GLU  95  17.675  -2.960   5.702
  722    H    GLU  96           H        GLU  96  20.267  -4.595   3.242
  723    HA   GLU  96           HA       GLU  96  23.172  -4.507   2.832
  724    HB2  GLU  96          2HB       GLU  96  21.082  -6.460   1.865
  725    HB3  GLU  96          1HB       GLU  96  22.732  -6.445   1.259
  726    HG2  GLU  96          2HG       GLU  96  21.888  -6.912   4.108
  727    HG3  GLU  96          1HG       GLU  96  22.452  -8.133   2.966
  728    H    LYS  97           H        LYS  97  20.676  -5.207   0.463
  729    HA   LYS  97           HA       LYS  97  20.952  -2.588  -0.757
  730    HB2  LYS  97          2HB       LYS  97  21.689  -5.148  -2.176
  731    HB3  LYS  97          1HB       LYS  97  21.261  -3.677  -3.030
  732    HG2  LYS  97          2HG       LYS  97  23.143  -2.537  -1.852
  733    HG3  LYS  97          1HG       LYS  97  23.615  -4.111  -1.211
  734    HD2  LYS  97          2HD       LYS  97  24.916  -3.553  -3.202
  735    HD3  LYS  97          1HD       LYS  97  23.889  -4.958  -3.493
  736    HE2  LYS  97          2HE       LYS  97  22.278  -3.571  -4.662
  737    HE3  LYS  97          1HE       LYS  97  23.219  -2.128  -4.301
  738    HZ1  LYS  97          1HZ       LYS  97  24.209  -4.403  -5.923
  739    HZ2  LYS  97          2HZ       LYS  97  24.981  -2.921  -5.679
  740    HZ3  LYS  97          3HZ       LYS  97  23.548  -2.989  -6.571
  741    HA   PRO  98           HA       PRO  98  16.627  -3.665  -1.396
  742    HB2  PRO  98          2HB       PRO  98  15.856  -1.221  -2.260
  743    HB3  PRO  98          1HB       PRO  98  16.139  -1.563  -0.551
  744    HG2  PRO  98          2HG       PRO  98  17.912  -0.196  -2.530
  745    HG3  PRO  98          1HG       PRO  98  17.596   0.216  -0.835
  746    HD2  PRO  98          2HD       PRO  98  19.825  -1.120  -1.684
  747    HD3  PRO  98          1HD       PRO  98  19.137  -1.292  -0.056
  748    HA   PRO  99           HA       PRO  99  16.224  -4.675  -5.682
  749    HB2  PRO  99          2HB       PRO  99  14.053  -3.040  -6.451
  750    HB3  PRO  99          1HB       PRO  99  13.975  -4.713  -5.903
  751    HG2  PRO  99          2HG       PRO  99  13.519  -2.196  -4.385
  752    HG3  PRO  99          1HG       PRO  99  12.754  -3.783  -4.189
  753    HD2  PRO  99          2HD       PRO  99  14.593  -2.916  -2.455
  754    HD3  PRO  99          1HD       PRO  99  14.539  -4.622  -2.947
  755    H    GLU 100           H        GLU 100  15.523  -1.242  -5.208
  756    HA   GLU 100           HA       GLU 100  17.844  -0.392  -6.580
  757    HB2  GLU 100          2HB       GLU 100  16.338  -1.041  -8.511
  758    HB3  GLU 100          1HB       GLU 100  15.243   0.230  -7.983
  759    HG2  GLU 100          2HG       GLU 100  16.782   1.911  -8.455
  760    HG3  GLU 100          1HG       GLU 100  18.107   0.767  -8.657
  761    H    ILE 101           H        ILE 101  14.501   0.662  -5.921
  762    HA   ILE 101           HA       ILE 101  15.627   2.699  -4.140
  763    HB   ILE 101           HB       ILE 101  13.752   4.248  -4.902
  764   HG12  ILE 101          2HG1      ILE 101  13.795   2.351  -7.254
  765   HG13  ILE 101          1HG1      ILE 101  12.439   2.633  -6.174
  766   HG21  ILE 101          1HG2      ILE 101  16.087   4.677  -5.376
  767   HG22  ILE 101          2HG2      ILE 101  15.093   5.120  -6.764
  768   HG23  ILE 101          3HG2      ILE 101  16.019   3.619  -6.786
  769   HD11  ILE 101          1HD1      ILE 101  12.327   3.720  -8.388
  770   HD12  ILE 101          2HD1      ILE 101  13.683   4.727  -7.904
  771   HD13  ILE 101          3HD1      ILE 101  12.159   4.820  -7.024
  772    H    ASP 102           H        ASP 102  13.655   0.110  -4.354
  773    HA   ASP 102           HA       ASP 102  12.435  -0.976  -2.807
  774    HB2  ASP 102          2HB       ASP 102  14.149   0.236  -1.265
  775    HB3  ASP 102          1HB       ASP 102  12.788   1.253  -0.813
  776    H    ALA 103           H        ALA 103  11.371   1.341  -4.473
  777    HA   ALA 103           HA       ALA 103   8.717   1.341  -3.252
  778    HB1  ALA 103          1HB       ALA 103   9.374   3.434  -2.463
  779    HB2  ALA 103          2HB       ALA 103   8.544   3.819  -3.981
  780    HB3  ALA 103          3HB       ALA 103  10.310   3.795  -3.917
  781    H    LEU 104           H        LEU 104  10.248   2.996  -5.994
  782    HA   LEU 104           HA       LEU 104   7.912   2.432  -7.590
  783    HB2  LEU 104          2HB       LEU 104  10.417   3.848  -8.463
  784    HB3  LEU 104          1HB       LEU 104   8.830   3.946  -9.192
  785    HG   LEU 104           HG       LEU 104   9.608   5.034  -6.486
  786   HD11  LEU 104          1HD1      LEU 104   8.894   6.440  -9.052
  787   HD12  LEU 104          2HD1      LEU 104  10.505   6.331  -8.344
  788   HD13  LEU 104          3HD1      LEU 104   9.231   7.213  -7.504
  789   HD21  LEU 104          1HD2      LEU 104   6.974   5.008  -7.941
  790   HD22  LEU 104          2HD2      LEU 104   7.337   6.077  -6.588
  791   HD23  LEU 104          3HD2      LEU 104   7.347   4.327  -6.354
  792    H    GLU 105           H        GLU 105  11.414   1.902  -8.044
  793    HA   GLU 105           HA       GLU 105  10.822   0.191 -10.315
  794    HB2  GLU 105          2HB       GLU 105  13.420   1.269  -9.232
  795    HB3  GLU 105          1HB       GLU 105  13.296   0.235 -10.648
  796    HG2  GLU 105          2HG       GLU 105  11.995   2.932 -10.355
  797    HG3  GLU 105          1HG       GLU 105  13.503   2.613 -11.211
  798    H    LEU 106           H        LEU 106  10.766  -1.898 -10.246
  799    HA   LEU 106           HA       LEU 106  11.212  -4.063  -9.824
  800    HB2  LEU 106          2HB       LEU 106  13.612  -2.823  -8.548
  801    HB3  LEU 106          1HB       LEU 106  13.310  -4.538  -8.368
  802    HG   LEU 106           HG       LEU 106  13.253  -4.657 -10.908
  803   HD11  LEU 106          1HD1      LEU 106  12.957  -2.276 -11.356
  804   HD12  LEU 106          2HD1      LEU 106  14.423  -2.894 -12.115
  805   HD13  LEU 106          3HD1      LEU 106  14.533  -1.941 -10.635
  806   HD21  LEU 106          1HD2      LEU 106  15.814  -3.865  -9.534
  807   HD22  LEU 106          2HD2      LEU 106  15.686  -4.741 -11.058
  808   HD23  LEU 106          3HD2      LEU 106  15.106  -5.479  -9.567
  809    H    LYS 107           H        LYS 107  11.024  -5.720  -8.244
  810    HA   LYS 107           HA       LYS 107  10.636  -4.853  -5.486
  811    HB2  LYS 107          2HB       LYS 107   8.380  -4.942  -6.521
  812    HB3  LYS 107          1HB       LYS 107   8.653  -6.637  -6.909
  813    HG2  LYS 107          2HG       LYS 107   8.928  -7.103  -4.497
  814    HG3  LYS 107          1HG       LYS 107   8.533  -5.419  -4.156
  815    HD2  LYS 107          2HD       LYS 107   6.343  -5.725  -5.193
  816    HD3  LYS 107          1HD       LYS 107   6.740  -7.411  -5.537
  817    HE2  LYS 107          2HE       LYS 107   6.592  -6.166  -2.794
  818    HE3  LYS 107          1HE       LYS 107   5.346  -7.176  -3.525
  819    HZ1  LYS 107          1HZ       LYS 107   8.122  -8.032  -2.887
  820    HZ2  LYS 107          2HZ       LYS 107   6.927  -9.003  -3.605
  821    HZ3  LYS 107          3HZ       LYS 107   6.729  -8.448  -2.020
  822    H    THR 108           H        THR 108  12.806  -5.845  -5.586
  823    HA   THR 108           HA       THR 108  12.780  -8.758  -5.425
  824    HB   THR 108           HB       THR 108  15.173  -7.042  -4.824
  825    HG1  THR 108          1HG       THR 108  14.347  -7.803  -7.452
  826   HG21  THR 108          1HG2      THR 108  14.841  -9.726  -6.176
  827   HG22  THR 108          2HG2      THR 108  15.328  -9.472  -4.500
  828   HG23  THR 108          3HG2      THR 108  16.373  -8.934  -5.813
  829    H    GLN 109           H        GLN 109  11.398  -6.894  -3.586
  830    HA   GLN 109           HA       GLN 109  12.615  -7.733  -1.065
  831    HB2  GLN 109          2HB       GLN 109  11.982  -5.481  -0.128
  832    HB3  GLN 109          1HB       GLN 109  13.309  -5.462  -1.276
  833    HG2  GLN 109          2HG       GLN 109  12.140  -3.689  -2.054
  834    HG3  GLN 109          1HG       GLN 109  11.352  -4.961  -2.983
  835   HE21  GLN 109          1HE2      GLN 109  11.068  -2.707  -0.373
  836   HE22  GLN 109          2HE2      GLN 109   9.352  -2.847  -0.169
  837    H    LYS 110           H        LYS 110  11.086  -7.579   0.750
  838    HA   LYS 110           HA       LYS 110   8.273  -7.775  -0.089
  839    HB2  LYS 110          2HB       LYS 110   9.679  -9.605   1.867
  840    HB3  LYS 110          1HB       LYS 110   7.968  -9.652   1.470
  841    HG2  LYS 110          2HG       LYS 110   8.469 -10.304  -0.801
  842    HG3  LYS 110          1HG       LYS 110  10.199 -10.142  -0.495
  843    HD2  LYS 110          2HD       LYS 110   8.348 -12.090   0.877
  844    HD3  LYS 110          1HD       LYS 110   9.464 -12.485  -0.430
  845    HE2  LYS 110          2HE       LYS 110  11.347 -11.781   0.986
  846    HE3  LYS 110          1HE       LYS 110  10.219 -11.430   2.293
  847    HZ1  LYS 110          1HZ       LYS 110   9.572 -13.773   2.287
  848    HZ2  LYS 110          2HZ       LYS 110  11.217 -13.576   2.615
  849    HZ3  LYS 110          3HZ       LYS 110  10.717 -14.093   1.084
  850    H    GLY 111           H        GLY 111  10.598  -6.415   1.890
  851    HA2  GLY 111          2HA       GLY 111  10.373  -4.799   3.531
  852    HA3  GLY 111          1HA       GLY 111   8.633  -5.052   3.500
  853    H    PHE 112           H        PHE 112   9.645  -8.049   3.757
  854    HA   PHE 112           HA       PHE 112   9.355  -8.036   6.659
  855    HB2  PHE 112          2HB       PHE 112   7.886  -9.460   5.136
  856    HB3  PHE 112          1HB       PHE 112   9.313 -10.443   4.834
  857    HD1  PHE 112          1HD       PHE 112   6.750  -9.518   7.243
  858    HD2  PHE 112          2HD       PHE 112  10.257 -11.840   6.598
  859    HE1  PHE 112          1HE       PHE 112   6.262 -10.816   9.275
  860    HE2  PHE 112          2HE       PHE 112   9.774 -13.141   8.628
  861    HZ   PHE 112           HZ       PHE 112   7.773 -12.628   9.970
  Start of MODEL   15
    1    H1   GLY   1          1HT       GLY   1  -6.018  -0.411 -13.015
    2    H2   GLY   1          2HT       GLY   1  -4.650  -1.222 -12.445
    3    H    GLY   1           H        GLY   1  -4.220  -0.877 -13.221
    4    H3   GLY   1          3HT       GLY   1  -4.528  -0.197 -13.783
    5    HA2  GLY   1          1HA       GLY   1  -5.070   1.712 -12.406
    6    HA3  GLY   1          2HA       GLY   1  -5.181   0.641 -11.014
    7    H    SER   2           H        SER   2  -3.544   1.937 -10.029
    8    HA   SER   2           HA       SER   2  -1.430   2.340  -9.325
    9    HB2  SER   2          2HB       SER   2  -1.242  -0.135  -9.384
   10    HB3  SER   2          1HB       SER   2  -0.684  -0.037 -11.053
   11    HG   SER   2           HG       SER   2   1.179   0.892 -10.394
   12    H    ALA   3           H        ALA   3  -2.354   3.885 -11.384
   13    HA   ALA   3           HA       ALA   3   0.159   4.589 -12.704
   14    HB1  ALA   3          1HB       ALA   3  -2.462   4.358 -14.180
   15    HB2  ALA   3          2HB       ALA   3  -1.101   3.246 -14.326
   16    HB3  ALA   3          3HB       ALA   3  -0.932   4.921 -14.854
   17    H    MET   4           H        MET   4  -1.860   5.568 -10.559
   18    HA   MET   4           HA       MET   4  -2.132   8.311 -11.603
   19    HB2  MET   4          2HB       MET   4  -4.242   7.087 -10.915
   20    HB3  MET   4          1HB       MET   4  -3.634   7.113  -9.268
   21    HG2  MET   4          2HG       MET   4  -3.568   9.596  -9.397
   22    HG3  MET   4          1HG       MET   4  -4.341   9.486 -10.976
   23    HE1  MET   4          1HE       MET   4  -6.340   7.012 -10.503
   24    HE2  MET   4          2HE       MET   4  -6.778   8.490 -11.357
   25    HE3  MET   4          3HE       MET   4  -7.805   7.885 -10.056
   26    H    GLY   5           H        GLY   5   0.214   6.953 -10.351
   27    HA2  GLY   5          2HA       GLY   5   0.465   8.124  -7.720
   28    HA3  GLY   5          1HA       GLY   5   1.699   7.214  -8.582
   29    H    HIS   6           H        HIS   6   0.070  10.352  -8.437
   30    HA   HIS   6           HA       HIS   6   2.203  11.564 -10.014
   31    HB2  HIS   6          2HB       HIS   6  -0.430  12.596  -8.984
   32    HB3  HIS   6          1HB       HIS   6   0.776  13.666  -9.685
   33    HD1  HIS   6          1HD       HIS   6   0.967  13.723 -12.199
   34    HD2  HIS   6          2HD       HIS   6  -1.583  10.741 -10.834
   35    HE1  HIS   6          1HE       HIS   6  -0.203  12.849 -14.244
   36    HE2  HIS   6          2HE       HIS   6  -1.881  11.193 -13.361
   37    H    MET   7           H        MET   7   2.119  10.635  -7.021
   38    HA   MET   7           HA       MET   7   3.342  11.092  -5.178
   39    HB2  MET   7          2HB       MET   7   4.544  13.254  -6.911
   40    HB3  MET   7          1HB       MET   7   5.125  12.834  -5.307
   41    HG2  MET   7          2HG       MET   7   5.676  10.599  -6.063
   42    HG3  MET   7          1HG       MET   7   5.028  10.962  -7.661
   43    HE1  MET   7          1HE       MET   7   8.796  12.958  -5.886
   44    HE2  MET   7          2HE       MET   7   7.833  11.742  -5.045
   45    HE3  MET   7          3HE       MET   7   7.165  13.347  -5.340
   46    H    VAL   8           H        VAL   8   1.767  11.667  -3.776
   47    HA   VAL   8           HA       VAL   8   1.048  14.486  -3.617
   48    HB   VAL   8           HB       VAL   8  -0.893  13.139  -3.665
   49   HG11  VAL   8          1HG1      VAL   8  -1.358  11.378  -1.976
   50   HG12  VAL   8          2HG1      VAL   8   0.323  11.490  -1.461
   51   HG13  VAL   8          3HG1      VAL   8  -0.061  10.986  -3.103
   52   HG21  VAL   8          1HG2      VAL   8  -1.001  15.019  -2.131
   53   HG22  VAL   8          2HG2      VAL   8  -0.430  13.997  -0.813
   54   HG23  VAL   8          3HG2      VAL   8  -1.996  13.680  -1.561
   55    H    LYS   9           H        LYS   9   0.814  12.774  -0.716
   56    HA   LYS   9           HA       LYS   9   3.102  14.090   0.413
   57    HB2  LYS   9          2HB       LYS   9   1.141  12.082   1.568
   58    HB3  LYS   9          1HB       LYS   9   2.489  12.774   2.474
   59    HG2  LYS   9          2HG       LYS   9   0.352  14.427   1.168
   60    HG3  LYS   9          1HG       LYS   9   0.296  13.881   2.840
   61    HD2  LYS   9          2HD       LYS   9   2.529  15.531   1.670
   62    HD3  LYS   9          1HD       LYS   9   1.157  16.205   2.547
   63    HE2  LYS   9          2HE       LYS   9   1.778  14.971   4.531
   64    HE3  LYS   9          1HE       LYS   9   3.093  14.183   3.664
   65    HZ1  LYS   9          1HZ       LYS   9   3.897  16.012   5.012
   66    HZ2  LYS   9          2HZ       LYS   9   2.883  17.095   4.198
   67    HZ3  LYS   9          3HZ       LYS   9   4.144  16.330   3.371
   68    H    ILE  10           H        ILE  10   3.308  12.076  -1.750
   69    HA   ILE  10           HA       ILE  10   4.810   9.975  -0.420
   70    HB   ILE  10           HB       ILE  10   3.705  10.097  -3.230
   71   HG12  ILE  10          2HG1      ILE  10   2.955   8.424  -0.827
   72   HG13  ILE  10          1HG1      ILE  10   2.010   9.760  -1.481
   73   HG21  ILE  10          1HG2      ILE  10   5.801   8.853  -3.185
   74   HG22  ILE  10          2HG2      ILE  10   4.435   7.760  -3.418
   75   HG23  ILE  10          3HG2      ILE  10   5.207   7.882  -1.836
   76   HD11  ILE  10          1HD1      ILE  10   1.674   8.517  -3.550
   77   HD12  ILE  10          2HD1      ILE  10   1.090   7.616  -2.150
   78   HD13  ILE  10          3HD1      ILE  10   2.624   7.179  -2.902
   79    H    SER  11           H        SER  11   6.715  10.824  -0.076
   80    HA   SER  11           HA       SER  11   8.329  11.820  -2.285
   81    HB2  SER  11          2HB       SER  11  10.085  11.978  -0.469
   82    HB3  SER  11          1HB       SER  11   8.640  12.943  -0.152
   83    HG   SER  11           HG       SER  11   8.252  11.763   1.544
   84    H    HIS  12           H        HIS  12  10.771  10.594  -1.899
   85    HA   HIS  12           HA       HIS  12  10.486   8.022  -2.936
   86    HB2  HIS  12          2HB       HIS  12  12.709   8.960  -1.125
   87    HB3  HIS  12          1HB       HIS  12  12.779   7.583  -2.214
   88    HD1  HIS  12          1HD       HIS  12  12.128   8.556  -4.879
   89    HD2  HIS  12          2HD       HIS  12  14.133  10.957  -2.147
   90    HE1  HIS  12          1HE       HIS  12  13.320  10.289  -6.253
   91    HE2  HIS  12          2HE       HIS  12  14.664  11.617  -4.588
   92    H    GLU  13           H        GLU  13  10.933   9.136   0.384
   93    HA   GLU  13           HA       GLU  13  11.059   6.539   1.466
   94    HB2  GLU  13          2HB       GLU  13  10.958   7.595   3.661
   95    HB3  GLU  13          1HB       GLU  13  12.108   8.406   2.601
   96    HG2  GLU  13          2HG       GLU  13  10.365  10.136   2.160
   97    HG3  GLU  13          1HG       GLU  13   9.372   9.361   3.395
   98    H    ASP  14           H        ASP  14   8.267   8.718   0.917
   99    HA   ASP  14           HA       ASP  14   6.636   7.185   2.684
  100    HB2  ASP  14          2HB       ASP  14   6.247   9.531   1.129
  101    HB3  ASP  14          1HB       ASP  14   4.950   8.424   0.788
  102    H    THR  15           H        THR  15   7.177   7.113  -0.829
  103    HA   THR  15           HA       THR  15   5.358   5.061  -1.414
  104    HB   THR  15           HB       THR  15   7.884   4.791  -2.854
  105    HG1  THR  15          1HG       THR  15   8.118   6.990  -2.501
  106   HG21  THR  15          1HG2      THR  15   5.763   3.880  -3.636
  107   HG22  THR  15          2HG2      THR  15   6.396   5.062  -4.783
  108   HG23  THR  15          3HG2      THR  15   5.079   5.505  -3.694
  109    H    GLN  16           H        GLN  16   8.741   4.951  -0.409
  110    HA   GLN  16           HA       GLN  16   9.099   2.183  -0.304
  111    HB2  GLN  16          2HB       GLN  16  10.292   4.347   1.449
  112    HB3  GLN  16          1HB       GLN  16  10.895   2.696   1.345
  113    HG2  GLN  16          2HG       GLN  16  11.583   2.985  -0.895
  114    HG3  GLN  16          1HG       GLN  16  10.703   4.502  -1.045
  115   HE21  GLN  16          1HE2      GLN  16  12.649   3.653   1.738
  116   HE22  GLN  16          2HE2      GLN  16  13.869   4.845   1.473
  117    H    ARG  17           H        ARG  17   7.825   4.461   2.049
  118    HA   ARG  17           HA       ARG  17   7.454   2.716   4.210
  119    HB2  ARG  17          2HB       ARG  17   6.249   5.323   3.373
  120    HB3  ARG  17          1HB       ARG  17   5.537   4.448   4.718
  121    HG2  ARG  17          2HG       ARG  17   7.237   4.935   6.104
  122    HG3  ARG  17          1HG       ARG  17   8.451   4.773   4.838
  123    HD2  ARG  17          2HD       ARG  17   8.100   6.958   4.060
  124    HD3  ARG  17          1HD       ARG  17   6.569   7.111   4.931
  125    HE   ARG  17           HE       ARG  17   8.906   6.734   6.596
  126   HH11  ARG  17          1HH1      ARG  17   6.801   9.089   5.053
  127   HH12  ARG  17          2HH1      ARG  17   7.196  10.340   6.194
  128   HH21  ARG  17          1HH2      ARG  17   9.399   8.394   8.077
  129   HH22  ARG  17          2HH2      ARG  17   8.654   9.952   7.896
  130    H    ILE  18           H        ILE  18   5.097   3.789   1.722
  131    HA   ILE  18           HA       ILE  18   2.908   2.392   2.706
  132    HB   ILE  18           HB       ILE  18   3.558   3.074  -0.159
  133   HG12  ILE  18          2HG1      ILE  18   1.452   4.556   1.214
  134   HG13  ILE  18          1HG1      ILE  18   3.028   4.747   1.977
  135   HG21  ILE  18          1HG2      ILE  18   1.002   2.129   1.126
  136   HG22  ILE  18          2HG2      ILE  18   1.922   1.347  -0.171
  137   HG23  ILE  18          3HG2      ILE  18   1.086   2.873  -0.476
  138   HD11  ILE  18          1HD1      ILE  18   2.462   5.206  -0.938
  139   HD12  ILE  18          2HD1      ILE  18   3.985   5.486  -0.086
  140   HD13  ILE  18          3HD1      ILE  18   2.567   6.464   0.294
  141    H    LYS  19           H        LYS  19   5.255   1.370   0.244
  142    HA   LYS  19           HA       LYS  19   3.999  -1.078  -0.350
  143    HB2  LYS  19          2HB       LYS  19   6.130   0.331  -1.342
  144    HB3  LYS  19          1HB       LYS  19   6.912  -1.048  -0.551
  145    HG2  LYS  19          2HG       LYS  19   5.639  -2.588  -1.875
  146    HG3  LYS  19          1HG       LYS  19   4.703  -1.268  -2.585
  147    HD2  LYS  19          2HD       LYS  19   6.508  -0.509  -3.844
  148    HD3  LYS  19          1HD       LYS  19   7.691  -1.324  -2.821
  149    HE2  LYS  19          2HE       LYS  19   5.733  -2.666  -4.667
  150    HE3  LYS  19          1HE       LYS  19   7.442  -2.409  -5.003
  151    HZ1  LYS  19          1HZ       LYS  19   7.836  -3.700  -2.858
  152    HZ2  LYS  19          2HZ       LYS  19   7.323  -4.582  -4.210
  153    HZ3  LYS  19          3HZ       LYS  19   6.222  -4.195  -2.993
  154    H    THR  20           H        THR  20   6.752  -0.282   1.734
  155    HA   THR  20           HA       THR  20   7.423  -2.911   2.276
  156    HB   THR  20           HB       THR  20   8.949  -0.971   2.626
  157    HG1  THR  20          1HG       THR  20   9.752  -2.736   3.569
  158   HG21  THR  20          1HG2      THR  20   7.385   0.520   3.793
  159   HG22  THR  20          2HG2      THR  20   8.855   0.265   4.733
  160   HG23  THR  20          3HG2      THR  20   7.369  -0.578   5.172
  161    H    ALA  21           H        ALA  21   5.232  -0.721   3.946
  162    HA   ALA  21           HA       ALA  21   4.944  -2.421   6.198
  163    HB1  ALA  21          1HB       ALA  21   3.020  -0.975   6.761
  164    HB2  ALA  21          2HB       ALA  21   3.197  -0.184   5.192
  165    HB3  ALA  21          3HB       ALA  21   4.482  -0.061   6.394
  166    H    PHE  22           H        PHE  22   2.703  -1.602   3.578
  167    HA   PHE  22           HA       PHE  22   0.621  -3.281   3.935
  168    HB2  PHE  22          2HB       PHE  22   0.525  -1.886   2.130
  169    HB3  PHE  22          1HB       PHE  22   2.146  -2.258   1.589
  170    HD1  PHE  22          1HD       PHE  22  -1.179  -3.843   1.874
  171    HD2  PHE  22          2HD       PHE  22   2.373  -3.422  -0.365
  172    HE1  PHE  22          1HE       PHE  22  -2.204  -5.168   0.040
  173    HE2  PHE  22          2HE       PHE  22   1.409  -4.784  -2.165
  174    HZ   PHE  22           HZ       PHE  22  -0.879  -5.660  -1.946
  175    H    LEU  23           H        LEU  23   3.523  -4.310   2.091
  176    HA   LEU  23           HA       LEU  23   2.578  -6.941   1.673
  177    HB2  LEU  23          2HB       LEU  23   5.444  -6.024   1.691
  178    HB3  LEU  23          1HB       LEU  23   4.761  -7.375   0.801
  179    HG   LEU  23           HG       LEU  23   3.787  -4.596   0.275
  180   HD11  LEU  23          1HD1      LEU  23   6.195  -4.432   0.130
  181   HD12  LEU  23          2HD1      LEU  23   5.499  -4.426  -1.491
  182   HD13  LEU  23          3HD1      LEU  23   6.264  -5.885  -0.868
  183   HD21  LEU  23          1HD2      LEU  23   3.474  -5.594  -1.992
  184   HD22  LEU  23          2HD2      LEU  23   2.514  -6.342  -0.713
  185   HD23  LEU  23          3HD2      LEU  23   3.970  -7.146  -1.310
  186    H    SER  24           H        SER  24   5.184  -5.748   3.789
  187    HA   SER  24           HA       SER  24   5.852  -8.259   4.865
  188    HB2  SER  24          2HB       SER  24   6.351  -5.695   6.304
  189    HB3  SER  24          1HB       SER  24   7.329  -7.160   6.212
  190    HG   SER  24           HG       SER  24   7.097  -5.057   4.397
  191    H    TYR  25           H        TYR  25   3.459  -5.926   5.730
  192    HA   TYR  25           HA       TYR  25   3.175  -6.734   8.426
  193    HB2  TYR  25          2HB       TYR  25   1.663  -4.952   6.571
  194    HB3  TYR  25          1HB       TYR  25   0.777  -5.632   7.952
  195    HD1  TYR  25          1HD       TYR  25   4.117  -4.074   7.310
  196    HD2  TYR  25          2HD       TYR  25   0.774  -4.406   9.911
  197    HE1  TYR  25          1HE       TYR  25   5.140  -2.432   8.805
  198    HE2  TYR  25          2HE       TYR  25   1.784  -2.755  11.426
  199    HH   TYR  25           HH       TYR  25   4.095  -1.912  11.954
  200    H    ALA  26           H        ALA  26   1.207  -7.429   5.511
  201    HA   ALA  26           HA       ALA  26  -0.475  -9.138   7.089
  202    HB1  ALA  26          1HB       ALA  26  -1.545  -9.714   5.003
  203    HB2  ALA  26          2HB       ALA  26  -0.239  -8.941   4.104
  204    HB3  ALA  26          3HB       ALA  26  -1.306  -7.972   5.122
  205    H    GLN  27           H        GLN  27   1.519 -10.065   4.225
  206    HA   GLN  27           HA       GLN  27   1.926 -12.623   5.624
  207    HB2  GLN  27          2HB       GLN  27   2.264 -12.577   2.682
  208    HB3  GLN  27          1HB       GLN  27   1.675 -13.863   3.727
  209    HG2  GLN  27          2HG       GLN  27  -0.215 -13.342   2.555
  210    HG3  GLN  27          1HG       GLN  27  -0.428 -12.300   3.969
  211   HE21  GLN  27          1HE2      GLN  27  -1.395 -12.050   1.180
  212   HE22  GLN  27          2HE2      GLN  27  -0.847 -10.484   0.670
  213    H    GLY  28           H        GLY  28   3.407  -9.988   3.973
  214    HA2  GLY  28          2HA       GLY  28   5.747  -9.665   3.712
  215    HA3  GLY  28          1HA       GLY  28   5.986 -11.394   3.926
  216    H    GLN  29           H        GLN  29   3.522 -11.673   2.056
  217    HA   GLN  29           HA       GLN  29   5.017 -12.040  -0.353
  218    HB2  GLN  29          2HB       GLN  29   2.025 -12.134   0.032
  219    HB3  GLN  29          1HB       GLN  29   2.948 -12.885  -1.261
  220    HG2  GLN  29          2HG       GLN  29   4.029 -14.356   0.354
  221    HG3  GLN  29          1HG       GLN  29   3.120 -13.587   1.656
  222   HE21  GLN  29          1HE2      GLN  29   0.683 -13.386   0.013
  223   HE22  GLN  29          2HE2      GLN  29   0.033 -14.985  -0.059
  224    H    ASP  30           H        ASP  30   3.312 -11.336  -2.388
  225    HA   ASP  30           HA       ASP  30   3.857  -8.499  -2.619
  226    HB2  ASP  30          2HB       ASP  30   2.746 -10.503  -4.586
  227    HB3  ASP  30          1HB       ASP  30   3.010  -8.807  -4.966
  228    H    LYS  31           H        LYS  31   1.588  -9.639  -0.918
  229    HA   LYS  31           HA       LYS  31  -0.520  -7.920  -1.950
  230    HB2  LYS  31          2HB       LYS  31  -0.870 -10.860  -1.352
  231    HB3  LYS  31          1HB       LYS  31  -2.210  -9.733  -1.489
  232    HG2  LYS  31          2HG       LYS  31  -1.022  -9.244  -3.820
  233    HG3  LYS  31          1HG       LYS  31  -0.493 -10.899  -3.587
  234    HD2  LYS  31          2HD       LYS  31  -3.344  -9.913  -3.575
  235    HD3  LYS  31          1HD       LYS  31  -2.571 -10.872  -4.833
  236    HE2  LYS  31          2HE       LYS  31  -2.912 -11.766  -1.988
  237    HE3  LYS  31          1HE       LYS  31  -4.066 -12.100  -3.271
  238    HZ1  LYS  31          1HZ       LYS  31  -2.342 -13.287  -4.470
  239    HZ2  LYS  31          2HZ       LYS  31  -2.544 -13.950  -2.927
  240    HZ3  LYS  31          3HZ       LYS  31  -1.223 -12.947  -3.251
  241    H    VAL  32           H        VAL  32  -2.480  -8.300  -0.228
  242    HA   VAL  32           HA       VAL  32  -1.323  -8.600   2.448
  243    HB   VAL  32           HB       VAL  32  -2.764  -6.284   1.357
  244   HG11  VAL  32          1HG1      VAL  32  -3.440  -7.364   4.069
  245   HG12  VAL  32          2HG1      VAL  32  -4.550  -7.092   2.725
  246   HG13  VAL  32          3HG1      VAL  32  -3.782  -5.722   3.528
  247   HG21  VAL  32          1HG2      VAL  32  -1.598  -5.237   3.303
  248   HG22  VAL  32          2HG2      VAL  32  -0.572  -5.981   2.073
  249   HG23  VAL  32          3HG2      VAL  32  -0.871  -6.818   3.603
  250    H    THR  33           H        THR  33  -2.414 -10.050   3.696
  251    HA   THR  33           HA       THR  33  -5.007 -10.985   2.951
  252    HB   THR  33           HB       THR  33  -5.020 -11.981   5.268
  253    HG1  THR  33          1HG       THR  33  -3.733 -10.845   6.559
  254   HG21  THR  33          1HG2      THR  33  -2.554 -12.509   3.611
  255   HG22  THR  33          2HG2      THR  33  -4.141 -13.239   3.366
  256   HG23  THR  33          3HG2      THR  33  -3.225 -13.591   4.831
  257    H    GLU  34           H        GLU  34  -6.919 -10.594   4.420
  258    HA   GLU  34           HA       GLU  34  -7.343  -7.927   3.736
  259    HB2  GLU  34          2HB       GLU  34  -9.061  -9.492   3.427
  260    HB3  GLU  34          1HB       GLU  34  -9.171  -9.830   5.159
  261    HG2  GLU  34          2HG       GLU  34 -10.101  -7.701   5.601
  262    HG3  GLU  34          1HG       GLU  34  -9.696  -7.111   3.991
  263    H    ALA  35           H        ALA  35  -6.530  -9.161   6.863
  264    HA   ALA  35           HA       ALA  35  -7.623  -7.261   8.565
  265    HB1  ALA  35          1HB       ALA  35  -4.897  -8.522   8.816
  266    HB2  ALA  35          2HB       ALA  35  -6.414  -9.260   9.336
  267    HB3  ALA  35          3HB       ALA  35  -5.835  -7.786  10.115
  268    H    MET  36           H        MET  36  -4.488  -7.122   6.843
  269    HA   MET  36           HA       MET  36  -3.826  -4.543   7.802
  270    HB2  MET  36          2HB       MET  36  -2.819  -6.316   5.630
  271    HB3  MET  36          1HB       MET  36  -2.315  -4.642   5.658
  272    HG2  MET  36          2HG       MET  36  -1.972  -6.624   7.890
  273    HG3  MET  36          1HG       MET  36  -0.704  -6.061   6.796
  274    HE1  MET  36          1HE       MET  36  -0.773  -2.190   7.650
  275    HE2  MET  36          2HE       MET  36  -1.976  -2.948   6.608
  276    HE3  MET  36          3HE       MET  36  -0.277  -3.407   6.474
  277    H    ILE  37           H        ILE  37  -5.823  -5.738   5.275
  278    HA   ILE  37           HA       ILE  37  -5.892  -3.352   3.711
  279    HB   ILE  37           HB       ILE  37  -7.293  -5.908   3.725
  280   HG12  ILE  37          2HG1      ILE  37  -5.893  -6.022   1.995
  281   HG13  ILE  37          1HG1      ILE  37  -6.904  -4.842   1.200
  282   HG21  ILE  37          1HG2      ILE  37  -9.011  -5.117   2.173
  283   HG22  ILE  37          2HG2      ILE  37  -8.524  -3.453   2.488
  284   HG23  ILE  37          3HG2      ILE  37  -9.212  -4.431   3.783
  285   HD11  ILE  37          1HD1      ILE  37  -4.544  -4.246   1.149
  286   HD12  ILE  37          2HD1      ILE  37  -4.547  -4.142   2.903
  287   HD13  ILE  37          3HD1      ILE  37  -5.541  -3.037   1.948
  288    H    ASP  38           H        ASP  38  -7.837  -4.706   6.341
  289    HA   ASP  38           HA       ASP  38  -9.842  -2.811   6.506
  290    HB2  ASP  38          2HB       ASP  38  -9.367  -5.026   7.750
  291    HB3  ASP  38          1HB       ASP  38  -8.514  -4.011   8.906
  292    H    GLN  39           H        GLN  39  -6.539  -2.760   7.797
  293    HA   GLN  39           HA       GLN  39  -6.792  -0.438   9.360
  294    HB2  GLN  39          2HB       GLN  39  -4.614  -0.782   9.825
  295    HB3  GLN  39          1HB       GLN  39  -4.738  -2.214   8.823
  296    HG2  GLN  39          2HG       GLN  39  -2.815  -1.130   8.064
  297    HG3  GLN  39          1HG       GLN  39  -4.042  -0.712   6.876
  298   HE21  GLN  39          1HE2      GLN  39  -2.968   1.124   6.201
  299   HE22  GLN  39          2HE2      GLN  39  -2.847   2.541   7.186
  300    H    LEU  40           H        LEU  40  -5.793  -0.886   5.997
  301    HA   LEU  40           HA       LEU  40  -5.372   1.875   5.502
  302    HB2  LEU  40          2HB       LEU  40  -4.319   0.127   4.172
  303    HB3  LEU  40          1HB       LEU  40  -5.895  -0.379   3.553
  304    HG   LEU  40           HG       LEU  40  -5.821   2.285   2.900
  305   HD11  LEU  40          1HD1      LEU  40  -3.085   1.202   3.152
  306   HD12  LEU  40          2HD1      LEU  40  -3.671   2.857   3.363
  307   HD13  LEU  40          3HD1      LEU  40  -3.433   2.196   1.739
  308   HD21  LEU  40          1HD2      LEU  40  -6.546   0.496   1.427
  309   HD22  LEU  40          2HD2      LEU  40  -4.886  -0.083   1.278
  310   HD23  LEU  40          3HD2      LEU  40  -5.333   1.489   0.618
  311    H    ILE  41           H        ILE  41  -8.083  -0.294   4.682
  312    HA   ILE  41           HA       ILE  41  -9.517   1.717   3.321
  313    HB   ILE  41           HB       ILE  41 -10.381  -0.906   4.504
  314   HG12  ILE  41          2HG1      ILE  41  -8.867  -0.790   2.495
  315   HG13  ILE  41          1HG1      ILE  41 -10.370  -1.661   2.230
  316   HG21  ILE  41          1HG2      ILE  41 -12.063   0.997   2.878
  317   HG22  ILE  41          2HG2      ILE  41 -12.309   0.581   4.575
  318   HG23  ILE  41          3HG2      ILE  41 -12.511  -0.648   3.327
  319   HD11  ILE  41          1HD1      ILE  41  -9.744   1.152   1.361
  320   HD12  ILE  41          2HD1      ILE  41 -11.286   0.329   1.116
  321   HD13  ILE  41          3HD1      ILE  41  -9.825  -0.275   0.329
  322    H    CYS  42           H        CYS  42  -9.730   0.619   6.711
  323    HA   CYS  42           HA       CYS  42 -11.903   2.396   7.296
  324    HB2  CYS  42          2HB       CYS  42 -10.022   0.947   9.168
  325    HB3  CYS  42          1HB       CYS  42 -11.504   1.772   9.646
  326    HG   CYS  42           HG       CYS  42 -11.227  -1.312   9.025
  327    H    GLY  43           H        GLY  43  -8.580   2.748   6.904
  328    HA2  GLY  43          2HA       GLY  43  -7.837   4.736   8.686
  329    HA3  GLY  43          1HA       GLY  43  -7.195   4.562   7.062
  330    H    ALA  44           H        ALA  44  -9.304   5.245   5.449
  331    HA   ALA  44           HA       ALA  44  -9.608   8.084   6.131
  332    HB1  ALA  44          1HB       ALA  44  -9.982   8.500   3.793
  333    HB2  ALA  44          2HB       ALA  44 -10.083   6.771   3.459
  334    HB3  ALA  44          3HB       ALA  44  -8.547   7.480   3.953
  335    H    PHE  45           H        PHE  45 -11.486   5.340   4.893
  336    HA   PHE  45           HA       PHE  45 -13.891   6.690   5.909
  337    HB2  PHE  45          2HB       PHE  45 -14.813   4.774   4.196
  338    HB3  PHE  45          1HB       PHE  45 -14.763   6.521   3.927
  339    HD1  PHE  45          1HD       PHE  45 -12.472   3.610   3.750
  340    HD2  PHE  45          2HD       PHE  45 -13.807   7.190   1.898
  341    HE1  PHE  45          1HE       PHE  45 -10.945   3.189   1.863
  342    HE2  PHE  45          2HE       PHE  45 -12.268   6.796   0.014
  343    HZ   PHE  45           HZ       PHE  45 -10.826   4.789   0.001
  344    HA   PRO  46           HA       PRO  46 -13.969   2.932   8.249
  345    HB2  PRO  46          2HB       PRO  46 -14.537   4.064  10.593
  346    HB3  PRO  46          1HB       PRO  46 -12.915   4.124   9.909
  347    HG2  PRO  46          2HG       PRO  46 -15.006   6.249  10.000
  348    HG3  PRO  46          1HG       PRO  46 -13.247   6.406  10.136
  349    HD2  PRO  46          2HD       PRO  46 -14.781   6.821   7.788
  350    HD3  PRO  46          1HD       PRO  46 -13.016   6.648   7.883
  351    H    GLY  47           H        GLY  47 -15.758   2.239   9.911
  352    HA2  GLY  47          2HA       GLY  47 -17.983   1.887  10.392
  353    HA3  GLY  47          1HA       GLY  47 -18.355   3.392   9.564
  354    H    LEU  48           H        LEU  48 -16.517   0.993   7.911
  355    HA   LEU  48           HA       LEU  48 -18.682   0.682   6.000
  356    HB2  LEU  48          2HB       LEU  48 -15.798  -0.200   5.955
  357    HB3  LEU  48          1HB       LEU  48 -16.937  -0.564   4.673
  358    HG   LEU  48           HG       LEU  48 -15.915   2.152   5.501
  359   HD11  LEU  48          1HD1      LEU  48 -15.077   2.225   3.212
  360   HD12  LEU  48          2HD1      LEU  48 -15.712   0.605   2.924
  361   HD13  LEU  48          3HD1      LEU  48 -14.416   0.848   4.094
  362   HD21  LEU  48          1HD2      LEU  48 -18.081   1.463   3.521
  363   HD22  LEU  48          2HD2      LEU  48 -17.319   3.045   3.678
  364   HD23  LEU  48          3HD2      LEU  48 -18.266   2.388   5.012
  365    H    SER  49           H        SER  49 -20.017  -0.966   6.038
  366    HA   SER  49           HA       SER  49 -19.622  -3.272   7.664
  367    HB2  SER  49          2HB       SER  49 -21.553  -2.888   5.358
  368    HB3  SER  49          1HB       SER  49 -21.685  -4.076   6.656
  369    HG   SER  49           HG       SER  49 -21.501  -1.876   7.937
  370    H    TRP  50           H        TRP  50 -19.239  -5.492   6.848
  371    HA   TRP  50           HA       TRP  50 -17.009  -5.501   5.173
  372    HB2  TRP  50          2HB       TRP  50 -17.563  -7.313   6.823
  373    HB3  TRP  50          1HB       TRP  50 -18.746  -7.916   5.664
  374    HD1  TRP  50           HD       TRP  50 -14.949  -7.198   5.742
  375    HE1  TRP  50          1HE       TRP  50 -13.812  -8.918   4.200
  376    HE3  TRP  50          3HE       TRP  50 -19.115  -9.582   4.026
  377    HZ2  TRP  50          2HZ       TRP  50 -14.616 -11.009   2.507
  378    HZ3  TRP  50          3HZ       TRP  50 -18.846 -11.442   2.439
  379    HH2  TRP  50           HH       TRP  50 -16.631 -12.143   1.691
  380    H    GLU  51           H        GLU  51 -20.394  -5.997   4.421
  381    HA   GLU  51           HA       GLU  51 -20.126  -6.923   1.801
  382    HB2  GLU  51          2HB       GLU  51 -22.256  -5.244   3.112
  383    HB3  GLU  51          1HB       GLU  51 -22.393  -5.828   1.461
  384    HG2  GLU  51          2HG       GLU  51 -22.089  -7.551   3.903
  385    HG3  GLU  51          1HG       GLU  51 -23.583  -7.252   3.044
  386    H    GLN  52           H        GLN  52 -20.488  -3.538   2.921
  387    HA   GLN  52           HA       GLN  52 -20.120  -2.365   0.371
  388    HB2  GLN  52          2HB       GLN  52 -20.950  -1.394   2.715
  389    HB3  GLN  52          1HB       GLN  52 -19.269  -0.907   2.834
  390    HG2  GLN  52          2HG       GLN  52 -21.118  -0.169   0.576
  391    HG3  GLN  52          1HG       GLN  52 -20.767   0.853   1.962
  392   HE21  GLN  52          1HE2      GLN  52 -19.642  -0.355  -1.070
  393   HE22  GLN  52          2HE2      GLN  52 -18.219   0.624  -1.168
  394    H    LEU  53           H        LEU  53 -17.924  -3.539   2.779
  395    HA   LEU  53           HA       LEU  53 -15.678  -2.049   1.814
  396    HB2  LEU  53          2HB       LEU  53 -15.850  -2.717   4.169
  397    HB3  LEU  53          1HB       LEU  53 -15.781  -4.407   3.699
  398    HG   LEU  53           HG       LEU  53 -13.506  -2.697   2.844
  399   HD11  LEU  53          1HD1      LEU  53 -12.419  -2.912   5.030
  400   HD12  LEU  53          2HD1      LEU  53 -13.912  -3.567   5.703
  401   HD13  LEU  53          3HD1      LEU  53 -13.864  -1.905   5.113
  402   HD21  LEU  53          1HD2      LEU  53 -12.243  -4.722   3.388
  403   HD22  LEU  53          2HD2      LEU  53 -13.586  -5.082   2.304
  404   HD23  LEU  53          3HD2      LEU  53 -13.709  -5.474   4.019
  405    H    GLN  54           H        GLN  54 -16.894  -5.355   1.459
  406    HA   GLN  54           HA       GLN  54 -14.669  -6.339   0.063
  407    HB2  GLN  54          2HB       GLN  54 -15.933  -8.235  -0.425
  408    HB3  GLN  54          1HB       GLN  54 -16.560  -7.658   1.096
  409    HG2  GLN  54          2HG       GLN  54 -18.538  -6.880   0.134
  410    HG3  GLN  54          1HG       GLN  54 -17.872  -6.954  -1.497
  411   HE21  GLN  54          1HE2      GLN  54 -19.237  -8.776   1.127
  412   HE22  GLN  54          2HE2      GLN  54 -19.522 -10.223   0.231
  413    H    GLU  55           H        GLU  55 -17.635  -4.734  -1.065
  414    HA   GLU  55           HA       GLU  55 -16.959  -4.868  -3.810
  415    HB2  GLU  55          2HB       GLU  55 -18.663  -2.916  -3.940
  416    HB3  GLU  55          1HB       GLU  55 -19.198  -4.530  -3.502
  417    HG2  GLU  55          2HG       GLU  55 -19.389  -3.954  -1.235
  418    HG3  GLU  55          1HG       GLU  55 -18.570  -2.438  -1.454
  419    H    LYS  56           H        LYS  56 -16.137  -2.615  -1.259
  420    HA   LYS  56           HA       LYS  56 -15.117  -0.458  -2.619
  421    HB2  LYS  56          2HB       LYS  56 -14.480  -1.835  -0.107
  422    HB3  LYS  56          1HB       LYS  56 -13.122  -0.937  -0.772
  423    HG2  LYS  56          2HG       LYS  56 -15.868   0.174  -0.144
  424    HG3  LYS  56          1HG       LYS  56 -14.417   0.383   0.841
  425    HD2  LYS  56          2HD       LYS  56 -13.342   1.545  -1.053
  426    HD3  LYS  56          1HD       LYS  56 -14.838   1.386  -1.973
  427    HE2  LYS  56          2HE       LYS  56 -14.588   2.826   0.664
  428    HE3  LYS  56          1HE       LYS  56 -14.559   3.611  -0.914
  429    HZ1  LYS  56          1HZ       LYS  56 -16.822   2.060   0.233
  430    HZ2  LYS  56          2HZ       LYS  56 -16.794   2.731  -1.320
  431    HZ3  LYS  56          3HZ       LYS  56 -16.749   3.737   0.035
  432    H    LYS  57           H        LYS  57 -13.380  -3.454  -1.878
  433    HA   LYS  57           HA       LYS  57 -11.336  -2.675  -3.843
  434    HB2  LYS  57          2HB       LYS  57 -10.509  -4.795  -2.088
  435    HB3  LYS  57          1HB       LYS  57  -9.785  -3.215  -2.337
  436    HG2  LYS  57          2HG       LYS  57 -10.287  -3.119  -0.111
  437    HG3  LYS  57          1HG       LYS  57 -11.751  -2.415  -0.796
  438    HD2  LYS  57          2HD       LYS  57 -12.525  -3.973   0.764
  439    HD3  LYS  57          1HD       LYS  57 -12.680  -4.791  -0.788
  440    HE2  LYS  57          2HE       LYS  57 -10.406  -5.826  -0.269
  441    HE3  LYS  57          1HE       LYS  57 -10.648  -5.237   1.366
  442    HZ1  LYS  57          1HZ       LYS  57 -12.909  -6.435   1.151
  443    HZ2  LYS  57          2HZ       LYS  57 -11.526  -7.340   1.502
  444    HZ3  LYS  57          3HZ       LYS  57 -12.144  -7.312  -0.078
  445    H    LYS  58           H        LYS  58 -13.928  -4.292  -4.111
  446    HA   LYS  58           HA       LYS  58 -13.654  -6.951  -4.574
  447    HB2  LYS  58          2HB       LYS  58 -15.342  -6.705  -6.377
  448    HB3  LYS  58          1HB       LYS  58 -15.760  -5.841  -4.905
  449    HG2  LYS  58          2HG       LYS  58 -15.036  -3.749  -5.899
  450    HG3  LYS  58          1HG       LYS  58 -14.538  -4.599  -7.361
  451    HD2  LYS  58          2HD       LYS  58 -16.807  -5.210  -7.848
  452    HD3  LYS  58          1HD       LYS  58 -17.360  -4.567  -6.298
  453    HE2  LYS  58          2HE       LYS  58 -17.823  -3.058  -8.208
  454    HE3  LYS  58          1HE       LYS  58 -16.807  -2.325  -6.967
  455    HZ1  LYS  58          1HZ       LYS  58 -14.875  -2.721  -8.321
  456    HZ2  LYS  58          2HZ       LYS  58 -16.021  -1.880  -9.236
  457    HZ3  LYS  58          3HZ       LYS  58 -15.792  -3.539  -9.482
  458    H    GLY  59           H        GLY  59 -13.253  -8.267  -6.393
  459    HA2  GLY  59          2HA       GLY  59 -12.141  -8.928  -8.304
  460    HA3  GLY  59          1HA       GLY  59 -11.816  -7.238  -8.659
  461    H    ARG  60           H        ARG  60 -10.457  -6.473  -6.396
  462    HA   ARG  60           HA       ARG  60  -7.893  -7.716  -6.993
  463    HB2  ARG  60          2HB       ARG  60  -8.465  -5.269  -5.335
  464    HB3  ARG  60          1HB       ARG  60  -6.909  -5.757  -5.980
  465    HG2  ARG  60          2HG       ARG  60  -9.319  -4.806  -7.499
  466    HG3  ARG  60          1HG       ARG  60  -7.776  -3.971  -7.294
  467    HD2  ARG  60          2HD       ARG  60  -8.153  -6.610  -8.693
  468    HD3  ARG  60          1HD       ARG  60  -8.019  -5.044  -9.482
  469    HE   ARG  60           HE       ARG  60  -5.824  -5.905  -7.743
  470   HH11  ARG  60          1HH1      ARG  60  -7.036  -5.347 -10.985
  471   HH12  ARG  60          2HH1      ARG  60  -5.459  -5.325 -11.706
  472   HH21  ARG  60          1HH2      ARG  60  -3.751  -5.856  -8.680
  473   HH22  ARG  60          2HH2      ARG  60  -3.589  -5.625 -10.399
  474    H    ALA  61           H        ALA  61  -9.863  -6.912  -4.162
  475    HA   ALA  61           HA       ALA  61  -8.313  -8.886  -2.614
  476    HB1  ALA  61          1HB       ALA  61  -7.663  -6.817  -1.676
  477    HB2  ALA  61          2HB       ALA  61  -8.906  -7.440  -0.593
  478    HB3  ALA  61          3HB       ALA  61  -9.297  -6.177  -1.757
  479    H    ALA  62           H        ALA  62 -10.696  -8.965  -4.239
  480    HA   ALA  62           HA       ALA  62 -13.115  -9.056  -2.969
  481    HB1  ALA  62          1HB       ALA  62 -12.117 -11.095  -4.941
  482    HB2  ALA  62          2HB       ALA  62 -12.653  -9.474  -5.372
  483    HB3  ALA  62          3HB       ALA  62 -13.791 -10.619  -4.657
  484    H    ALA  63           H        ALA  63 -11.143 -11.995  -3.456
  485    HA   ALA  63           HA       ALA  63 -12.488 -13.259  -1.214
  486    HB1  ALA  63          1HB       ALA  63 -11.330 -15.279  -1.893
  487    HB2  ALA  63          2HB       ALA  63 -10.386 -14.364  -3.068
  488    HB3  ALA  63          3HB       ALA  63 -12.130 -14.528  -3.273
  489    H    ASN  64           H        ASN  64 -10.861 -11.052  -0.612
  490    HA   ASN  64           HA       ASN  64  -9.533 -10.383   1.076
  491    HB2  ASN  64          2HB       ASN  64  -9.465 -13.304   1.828
  492    HB3  ASN  64          1HB       ASN  64  -8.866 -11.983   2.831
  493   HD21  ASN  64          1HD2      ASN  64 -11.011 -10.261   1.718
  494   HD22  ASN  64          2HD2      ASN  64 -12.438 -10.698   2.602
  495    H    GLY  65           H        GLY  65  -8.048  -9.601  -0.159
  496    HA2  GLY  65          2HA       GLY  65  -5.432 -10.206   0.298
  497    HA3  GLY  65          1HA       GLY  65  -5.825 -11.207  -1.086
  498    H    TYR  66           H        TYR  66  -5.880  -7.809   0.043
  499    HA   TYR  66           HA       TYR  66  -5.955  -6.666  -2.549
  500    HB2  TYR  66          2HB       TYR  66  -5.725  -5.612   0.021
  501    HB3  TYR  66          1HB       TYR  66  -4.218  -5.173  -0.769
  502    HD1  TYR  66          1HD       TYR  66  -5.062  -2.870  -0.254
  503    HD2  TYR  66          2HD       TYR  66  -6.986  -5.368  -3.098
  504    HE1  TYR  66          1HE       TYR  66  -6.092  -0.886  -1.262
  505    HE2  TYR  66          2HE       TYR  66  -8.035  -3.401  -4.122
  506    HH   TYR  66           HH       TYR  66  -8.668  -1.045  -3.389
  507    H    ASP  67           H        ASP  67  -4.335  -5.914  -3.894
  508    HA   ASP  67           HA       ASP  67  -1.883  -7.451  -3.574
  509    HB2  ASP  67          2HB       ASP  67  -1.917  -7.899  -5.927
  510    HB3  ASP  67          1HB       ASP  67  -3.513  -8.283  -5.270
  511    H    ARG  68           H        ARG  68  -0.033  -6.517  -4.603
  512    HA   ARG  68           HA       ARG  68   0.415  -4.002  -3.595
  513    HB2  ARG  68          2HB       ARG  68   2.494  -4.000  -5.074
  514    HB3  ARG  68          1HB       ARG  68   2.309  -5.355  -3.966
  515    HG2  ARG  68          2HG       ARG  68   1.435  -6.715  -5.831
  516    HG3  ARG  68          1HG       ARG  68   1.720  -5.360  -6.922
  517    HD2  ARG  68          2HD       ARG  68   3.862  -6.672  -5.257
  518    HD3  ARG  68          1HD       ARG  68   3.513  -7.101  -6.931
  519    HE   ARG  68           HE       ARG  68   3.946  -4.340  -6.799
  520   HH11  ARG  68          1HH1      ARG  68   5.738  -7.311  -6.335
  521   HH12  ARG  68          2HH1      ARG  68   7.233  -6.647  -6.914
  522   HH21  ARG  68          1HH2      ARG  68   5.909  -3.458  -7.553
  523   HH22  ARG  68          2HH2      ARG  68   7.336  -4.450  -7.596
  524    H    SER  69           H        SER  69  -0.386  -4.799  -6.978
  525    HA   SER  69           HA       SER  69  -0.084  -2.178  -7.973
  526    HB2  SER  69          2HB       SER  69  -1.975  -4.305  -9.003
  527    HB3  SER  69          1HB       SER  69  -1.306  -2.946  -9.906
  528    HG   SER  69           HG       SER  69   0.814  -3.955  -9.349
  529    H    ALA  70           H        ALA  70  -2.911  -3.928  -6.730
  530    HA   ALA  70           HA       ALA  70  -4.800  -1.858  -7.170
  531    HB1  ALA  70          1HB       ALA  70  -4.954  -3.963  -5.022
  532    HB2  ALA  70          2HB       ALA  70  -5.318  -4.279  -6.723
  533    HB3  ALA  70          3HB       ALA  70  -6.287  -3.119  -5.813
  534    H    PHE  71           H        PHE  71  -2.982  -2.889  -4.344
  535    HA   PHE  71           HA       PHE  71  -4.037  -1.066  -2.513
  536    HB2  PHE  71          2HB       PHE  71  -2.762  -3.057  -1.842
  537    HB3  PHE  71          1HB       PHE  71  -1.310  -2.379  -2.578
  538    HD1  PHE  71          1HD       PHE  71  -3.666  -2.057   0.210
  539    HD2  PHE  71          2HD       PHE  71  -0.014  -0.719  -1.473
  540    HE1  PHE  71          1HE       PHE  71  -3.108  -0.985   2.333
  541    HE2  PHE  71          2HE       PHE  71   0.557   0.357   0.656
  542    HZ   PHE  71           HZ       PHE  71  -0.989   0.232   2.557
  543    H    PHE  72           H        PHE  72  -1.154  -0.880  -4.586
  544    HA   PHE  72           HA       PHE  72  -0.345   1.652  -3.607
  545    HB2  PHE  72          2HB       PHE  72   1.181   0.091  -4.765
  546    HB3  PHE  72          1HB       PHE  72   0.329   0.409  -6.272
  547    HD1  PHE  72          1HD       PHE  72   1.909   2.332  -3.499
  548    HD2  PHE  72          2HD       PHE  72   1.295   1.942  -7.692
  549    HE1  PHE  72          1HE       PHE  72   3.361   4.274  -3.884
  550    HE2  PHE  72          2HE       PHE  72   2.749   3.888  -8.088
  551    HZ   PHE  72           HZ       PHE  72   3.785   5.058  -6.184
  552    H    SER  73           H        SER  73  -2.413   0.609  -6.191
  553    HA   SER  73           HA       SER  73  -2.742   3.011  -7.582
  554    HB2  SER  73          2HB       SER  73  -3.567   0.685  -8.227
  555    HB3  SER  73          1HB       SER  73  -4.915   0.956  -7.124
  556    HG   SER  73           HG       SER  73  -5.399   2.853  -8.398
  557    H    LEU  74           H        LEU  74  -4.272   1.767  -4.676
  558    HA   LEU  74           HA       LEU  74  -6.191   3.884  -4.482
  559    HB2  LEU  74          2HB       LEU  74  -6.388   1.515  -3.552
  560    HB3  LEU  74          1HB       LEU  74  -5.316   2.047  -2.270
  561    HG   LEU  74           HG       LEU  74  -7.881   3.485  -2.853
  562   HD11  LEU  74          1HD1      LEU  74  -8.985   2.118  -1.201
  563   HD12  LEU  74          2HD1      LEU  74  -7.509   1.189  -0.942
  564   HD13  LEU  74          3HD1      LEU  74  -8.351   1.088  -2.487
  565   HD21  LEU  74          1HD2      LEU  74  -6.174   4.557  -1.425
  566   HD22  LEU  74          2HD2      LEU  74  -6.298   3.186  -0.319
  567   HD23  LEU  74          3HD2      LEU  74  -7.692   4.228  -0.596
  568    H    VAL  75           H        VAL  75  -3.244   3.060  -2.642
  569    HA   VAL  75           HA       VAL  75  -3.530   5.202  -0.835
  570    HB   VAL  75           HB       VAL  75  -0.885   3.925  -1.503
  571   HG11  VAL  75          1HG1      VAL  75  -0.312   5.427   0.040
  572   HG12  VAL  75          2HG1      VAL  75  -0.878   4.163   1.135
  573   HG13  VAL  75          3HG1      VAL  75  -1.934   5.515   0.726
  574   HG21  VAL  75          1HG2      VAL  75  -2.105   1.998  -1.148
  575   HG22  VAL  75          2HG2      VAL  75  -3.210   2.787  -0.027
  576   HG23  VAL  75          3HG2      VAL  75  -1.568   2.391   0.492
  577    H    ALA  76           H        ALA  76  -1.854   4.895  -3.906
  578    HA   ALA  76           HA       ALA  76  -0.147   7.089  -3.752
  579    HB1  ALA  76          1HB       ALA  76  -0.013   6.989  -6.145
  580    HB2  ALA  76          2HB       ALA  76  -1.522   6.083  -6.233
  581    HB3  ALA  76          3HB       ALA  76  -0.093   5.346  -5.507
  582    H    SER  77           H        SER  77  -3.561   7.013  -4.032
  583    HA   SER  77           HA       SER  77  -3.654   9.798  -4.927
  584    HB2  SER  77          2HB       SER  77  -5.187   8.142  -5.983
  585    HB3  SER  77          1HB       SER  77  -5.940   7.879  -4.412
  586    HG   SER  77           HG       SER  77  -6.584  10.058  -4.411
  587    H    ASP  78           H        ASP  78  -4.265   7.765  -2.123
  588    HA   ASP  78           HA       ASP  78  -5.387  10.048  -0.675
  589    HB2  ASP  78          2HB       ASP  78  -5.418   7.083  -0.185
  590    HB3  ASP  78          1HB       ASP  78  -5.847   8.228   1.084
  591    H    GLU  79           H        GLU  79  -3.641  11.261  -0.077
  592    HA   GLU  79           HA       GLU  79  -1.175  10.383   0.965
  593    HB2  GLU  79          2HB       GLU  79  -0.835  12.584   1.604
  594    HB3  GLU  79          1HB       GLU  79  -1.999  12.764   0.304
  595    HG2  GLU  79          2HG       GLU  79  -3.787  13.085   1.853
  596    HG3  GLU  79          1HG       GLU  79  -2.740  12.671   3.210
  597    H    GLN  80           H        GLN  80  -4.346  10.672   2.500
  598    HA   GLN  80           HA       GLN  80  -3.539  10.663   5.179
  599    HB2  GLN  80          2HB       GLN  80  -5.942   9.114   4.228
  600    HB3  GLN  80          1HB       GLN  80  -5.721   9.951   5.754
  601    HG2  GLN  80          2HG       GLN  80  -7.109  11.414   4.732
  602    HG3  GLN  80          1HG       GLN  80  -5.567  12.055   4.170
  603   HE21  GLN  80          1HE2      GLN  80  -7.015   9.074   2.988
  604   HE22  GLN  80          2HE2      GLN  80  -7.356   9.661   1.391
  605    H    TYR  81           H        TYR  81  -3.680   8.219   2.770
  606    HA   TYR  81           HA       TYR  81  -3.325   6.013   4.590
  607    HB2  TYR  81          2HB       TYR  81  -3.651   6.236   1.613
  608    HB3  TYR  81          1HB       TYR  81  -3.261   4.712   2.409
  609    HD1  TYR  81          1HD       TYR  81  -5.659   4.868   0.818
  610    HD2  TYR  81          2HD       TYR  81  -5.090   5.989   4.861
  611    HE1  TYR  81          1HE       TYR  81  -8.017   4.353   1.276
  612    HE2  TYR  81          2HE       TYR  81  -7.442   5.544   5.314
  613    HH   TYR  81           HH       TYR  81  -9.409   3.780   3.260
  614    H    VAL  82           H        VAL  82  -1.523   7.796   2.146
  615    HA   VAL  82           HA       VAL  82   0.767   6.271   2.160
  616    HB   VAL  82           HB       VAL  82   1.697   7.984   0.998
  617   HG11  VAL  82          1HG1      VAL  82   0.094   8.944  -0.522
  618   HG12  VAL  82          2HG1      VAL  82  -1.177   8.392   0.573
  619   HG13  VAL  82          3HG1      VAL  82  -0.137   7.214  -0.233
  620   HG21  VAL  82          1HG2      VAL  82   0.145   9.995   2.463
  621   HG22  VAL  82          2HG2      VAL  82   1.054  10.347   0.993
  622   HG23  VAL  82          3HG2      VAL  82   1.902   9.769   2.428
  623    H    ARG  83           H        ARG  83  -0.047   9.143   4.028
  624    HA   ARG  83           HA       ARG  83   2.159   8.931   5.791
  625    HB2  ARG  83          2HB       ARG  83  -0.391  10.281   6.564
  626    HB3  ARG  83          1HB       ARG  83   1.237  10.683   7.044
  627    HG2  ARG  83          2HG       ARG  83   1.719  11.720   5.008
  628    HG3  ARG  83          1HG       ARG  83   0.344  10.973   4.204
  629    HD2  ARG  83          2HD       ARG  83   0.444  13.501   5.316
  630    HD3  ARG  83          1HD       ARG  83  -0.944  12.618   4.692
  631    HE   ARG  83           HE       ARG  83  -0.296  12.067   7.453
  632   HH11  ARG  83          1HH1      ARG  83  -2.120  14.080   5.237
  633   HH12  ARG  83          2HH1      ARG  83  -3.344  14.472   6.406
  634   HH21  ARG  83          1HH2      ARG  83  -1.898  12.598   8.993
  635   HH22  ARG  83          2HH2      ARG  83  -3.219  13.630   8.541
  636    H    PHE  84           H        PHE  84  -1.036   7.515   5.742
  637    HA   PHE  84           HA       PHE  84  -1.224   6.846   8.471
  638    HB2  PHE  84          2HB       PHE  84  -2.776   6.309   6.275
  639    HB3  PHE  84          1HB       PHE  84  -2.139   4.703   6.665
  640    HD1  PHE  84          1HD       PHE  84  -2.591   3.721   8.861
  641    HD2  PHE  84          2HD       PHE  84  -4.386   7.375   7.647
  642    HE1  PHE  84          1HE       PHE  84  -4.266   3.488  10.654
  643    HE2  PHE  84          2HE       PHE  84  -6.064   7.154   9.431
  644    HZ   PHE  84           HZ       PHE  84  -6.006   5.208  10.938
  645    H    ILE  85           H        ILE  85   0.262   5.146   5.771
  646    HA   ILE  85           HA       ILE  85   1.253   3.058   7.486
  647    HB   ILE  85           HB       ILE  85   1.595   3.653   4.572
  648   HG12  ILE  85          2HG1      ILE  85   0.692   1.263   6.195
  649   HG13  ILE  85          1HG1      ILE  85  -0.325   2.333   5.241
  650   HG21  ILE  85          1HG2      ILE  85   3.319   1.820   6.214
  651   HG22  ILE  85          2HG2      ILE  85   3.835   3.166   5.197
  652   HG23  ILE  85          3HG2      ILE  85   3.170   1.707   4.462
  653   HD11  ILE  85          1HD1      ILE  85   1.753   0.417   4.151
  654   HD12  ILE  85          2HD1      ILE  85   0.733   1.505   3.194
  655   HD13  ILE  85          3HD1      ILE  85   0.001   0.204   4.132
  656    H    ALA  86           H        ALA  86   2.667   5.862   5.828
  657    HA   ALA  86           HA       ALA  86   5.304   5.626   6.590
  658    HB1  ALA  86          1HB       ALA  86   3.724   8.187   6.498
  659    HB2  ALA  86          2HB       ALA  86   4.390   7.364   5.089
  660    HB3  ALA  86          3HB       ALA  86   5.468   8.017   6.324
  661    H    GLN  87           H        GLN  87   2.584   6.807   8.456
  662    HA   GLN  87           HA       GLN  87   4.143   7.796  10.608
  663    HB2  GLN  87          2HB       GLN  87   1.936   8.703  10.110
  664    HB3  GLN  87          1HB       GLN  87   1.201   7.146  10.452
  665    HG2  GLN  87          2HG       GLN  87   0.879   8.677  12.293
  666    HG3  GLN  87          1HG       GLN  87   1.887   7.319  12.781
  667   HE21  GLN  87          1HE2      GLN  87   3.109   9.969  10.853
  668   HE22  GLN  87          2HE2      GLN  87   4.119  10.643  12.086
  669    H    HIS  88           H        HIS  88   2.394   4.797   9.941
  670    HA   HIS  88           HA       HIS  88   2.992   3.831  12.613
  671    HB2  HIS  88          2HB       HIS  88   1.395   2.182  12.320
  672    HB3  HIS  88          1HB       HIS  88   0.762   3.479  11.326
  673    HD1  HIS  88          1HD       HIS  88   2.964   0.414  10.732
  674    HD2  HIS  88          2HD       HIS  88  -0.201   2.495   8.994
  675    HE1  HIS  88          1HE       HIS  88   2.333  -0.882   8.679
  676    HE2  HIS  88          2HE       HIS  88   0.259   0.247   7.832
  677    H    PHE  89           H        PHE  89   4.538   3.783   9.618
  678    HA   PHE  89           HA       PHE  89   6.559   1.998  10.640
  679    HB2  PHE  89          2HB       PHE  89   4.759   0.535   9.583
  680    HB3  PHE  89          1HB       PHE  89   5.230   1.242   8.043
  681    HD1  PHE  89          1HD       PHE  89   7.154   0.484   6.894
  682    HD2  PHE  89          2HD       PHE  89   6.403  -0.800  10.877
  683    HE1  PHE  89          1HE       PHE  89   8.918  -1.217   6.677
  684    HE2  PHE  89          2HE       PHE  89   8.169  -2.498  10.669
  685    HZ   PHE  89           HZ       PHE  89   9.429  -2.710   8.567
  686    HA   PRO  90           HA       PRO  90   8.807   5.252   8.364
  687    HB2  PRO  90          2HB       PRO  90  10.941   3.415   9.357
  688    HB3  PRO  90          1HB       PRO  90  10.864   5.180   9.402
  689    HG2  PRO  90          2HG       PRO  90  10.389   3.766  11.594
  690    HG3  PRO  90          1HG       PRO  90   9.420   5.203  11.219
  691    HD2  PRO  90          2HD       PRO  90   8.704   2.321  10.976
  692    HD3  PRO  90          1HD       PRO  90   7.687   3.707  11.417
  693    H    CYS  91           H        CYS  91  10.437   5.224   6.668
  694    HA   CYS  91           HA       CYS  91   9.798   3.284   4.652
  695    HB2  CYS  91          2HB       CYS  91  11.275   4.705   3.240
  696    HB3  CYS  91          1HB       CYS  91  10.057   5.657   4.104
  697    HG   CYS  91           HG       CYS  91  13.317   5.976   4.115
  698    H    ALA  92           H        ALA  92  10.980   1.758   3.811
  699    HA   ALA  92           HA       ALA  92  13.055   0.452   5.130
  700    HB1  ALA  92          1HB       ALA  92  13.402  -0.752   3.022
  701    HB2  ALA  92          2HB       ALA  92  12.435   0.453   2.170
  702    HB3  ALA  92          3HB       ALA  92  11.683  -0.587   3.381
  703    HA   PRO  93           HA       PRO  93  16.639   2.885   4.468
  704    HB2  PRO  93          2HB       PRO  93  18.587   1.035   4.112
  705    HB3  PRO  93          1HB       PRO  93  17.823   1.315   5.675
  706    HG2  PRO  93          2HG       PRO  93  17.190  -0.759   3.614
  707    HG3  PRO  93          1HG       PRO  93  17.442  -0.982   5.359
  708    HD2  PRO  93          2HD       PRO  93  14.972  -0.857   4.350
  709    HD3  PRO  93          1HD       PRO  93  15.355  -0.059   5.892
  710    H    GLU  94           H        GLU  94  17.950   3.746   2.905
  711    HA   GLU  94           HA       GLU  94  17.100   3.104   0.197
  712    HB2  GLU  94          2HB       GLU  94  16.917   5.437   1.033
  713    HB3  GLU  94          1HB       GLU  94  18.667   5.489   1.193
  714    HG2  GLU  94          2HG       GLU  94  18.820   5.027  -1.260
  715    HG3  GLU  94          1HG       GLU  94  17.071   5.223  -1.343
  716    H    GLU  95           H        GLU  95  18.437   1.162   0.171
  717    HA   GLU  95           HA       GLU  95  21.224   1.785  -0.484
  718    HB2  GLU  95          2HB       GLU  95  21.444  -0.749  -0.600
  719    HB3  GLU  95          1HB       GLU  95  21.179  -0.060   0.992
  720    HG2  GLU  95          2HG       GLU  95  18.748  -0.634   0.688
  721    HG3  GLU  95          1HG       GLU  95  19.241  -1.511  -0.760
  722    H    GLU  96           H        GLU  96  21.471   2.393  -2.524
  723    HA   GLU  96           HA       GLU  96  19.394   1.702  -4.428
  724    HB2  GLU  96          2HB       GLU  96  21.716   3.602  -4.715
  725    HB3  GLU  96          1HB       GLU  96  20.377   3.432  -5.841
  726    HG2  GLU  96          2HG       GLU  96  18.854   4.076  -3.941
  727    HG3  GLU  96          1HG       GLU  96  20.307   4.497  -3.037
  728    H    LYS  97           H        LYS  97  22.223   0.250  -3.587
  729    HA   LYS  97           HA       LYS  97  23.212  -0.402  -6.170
  730    HB2  LYS  97          2HB       LYS  97  23.566  -1.777  -3.509
  731    HB3  LYS  97          1HB       LYS  97  24.337  -2.332  -4.987
  732    HG2  LYS  97          2HG       LYS  97  24.710   0.380  -3.735
  733    HG3  LYS  97          1HG       LYS  97  25.829  -0.977  -3.601
  734    HD2  LYS  97          2HD       LYS  97  26.113  -0.950  -6.047
  735    HD3  LYS  97          1HD       LYS  97  25.034   0.442  -6.145
  736    HE2  LYS  97          2HE       LYS  97  27.348   1.165  -6.218
  737    HE3  LYS  97          1HE       LYS  97  26.578   1.722  -4.735
  738    HZ1  LYS  97          1HZ       LYS  97  28.766   0.870  -4.275
  739    HZ2  LYS  97          2HZ       LYS  97  28.390  -0.616  -4.991
  740    HZ3  LYS  97          3HZ       LYS  97  27.611  -0.142  -3.567
  741    HA   PRO  98           HA       PRO  98  20.247  -4.092  -6.106
  742    HB2  PRO  98          2HB       PRO  98  18.773  -4.742  -3.997
  743    HB3  PRO  98          1HB       PRO  98  20.494  -5.142  -4.031
  744    HG2  PRO  98          2HG       PRO  98  19.103  -2.893  -2.633
  745    HG3  PRO  98          1HG       PRO  98  20.408  -3.938  -2.046
  746    HD2  PRO  98          2HD       PRO  98  20.756  -1.400  -3.105
  747    HD3  PRO  98          1HD       PRO  98  22.014  -2.642  -3.004
  748    HA   PRO  99           HA       PRO  99  16.670  -1.678  -7.103
  749    HB2  PRO  99          2HB       PRO  99  15.058  -3.536  -8.152
  750    HB3  PRO  99          1HB       PRO  99  16.571  -3.072  -8.938
  751    HG2  PRO  99          2HG       PRO  99  15.949  -5.475  -7.276
  752    HG3  PRO  99          1HG       PRO  99  16.933  -5.352  -8.744
  753    HD2  PRO  99          2HD       PRO  99  17.948  -5.443  -6.178
  754    HD3  PRO  99          1HD       PRO  99  18.801  -4.764  -7.576
  755    H    GLU 100           H        GLU 100  16.707  -3.268  -4.359
  756    HA   GLU 100           HA       GLU 100  13.842  -3.581  -3.951
  757    HB2  GLU 100          2HB       GLU 100  14.509  -4.433  -1.720
  758    HB3  GLU 100          1HB       GLU 100  15.107  -5.391  -3.064
  759    HG2  GLU 100          2HG       GLU 100  17.291  -4.285  -2.810
  760    HG3  GLU 100          1HG       GLU 100  16.645  -3.396  -1.432
  761    H    ILE 101           H        ILE 101  14.207  -1.083  -4.365
  762    HA   ILE 101           HA       ILE 101  14.671   0.458  -1.987
  763    HB   ILE 101           HB       ILE 101  13.242   1.309  -4.516
  764   HG12  ILE 101          2HG1      ILE 101  15.463   0.548  -5.092
  765   HG13  ILE 101          1HG1      ILE 101  15.455   2.302  -5.126
  766   HG21  ILE 101          1HG2      ILE 101  13.883   3.586  -3.823
  767   HG22  ILE 101          2HG2      ILE 101  14.519   2.927  -2.315
  768   HG23  ILE 101          3HG2      ILE 101  12.796   2.809  -2.672
  769   HD11  ILE 101          1HD1      ILE 101  16.461   2.327  -2.907
  770   HD12  ILE 101          2HD1      ILE 101  17.456   1.564  -4.139
  771   HD13  ILE 101          3HD1      ILE 101  16.584   0.567  -2.972
  772    H    ASP 102           H        ASP 102  12.028  -1.046  -3.582
  773    HA   ASP 102           HA       ASP 102   9.996  -1.717  -2.942
  774    HB2  ASP 102          2HB       ASP 102  11.438  -2.094  -0.743
  775    HB3  ASP 102          1HB       ASP 102  10.382  -0.844  -0.129
  776    H    ALA 103           H        ALA 103  10.244   0.711  -4.044
  777    HA   ALA 103           HA       ALA 103   8.010   2.172  -2.794
  778    HB1  ALA 103          1HB       ALA 103   9.114   4.192  -4.059
  779    HB2  ALA 103          2HB       ALA 103  10.574   3.212  -3.915
  780    HB3  ALA 103          3HB       ALA 103   9.696   3.704  -2.470
  781    H    LEU 104           H        LEU 104   9.557   3.050  -5.793
  782    HA   LEU 104           HA       LEU 104   7.490   1.682  -7.354
  783    HB2  LEU 104          2HB       LEU 104   7.161   3.667  -8.754
  784    HB3  LEU 104          1HB       LEU 104   6.688   3.964  -7.092
  785    HG   LEU 104           HG       LEU 104   9.458   4.734  -7.705
  786   HD11  LEU 104          1HD1      LEU 104   8.817   6.763  -8.911
  787   HD12  LEU 104          2HD1      LEU 104   7.146   6.202  -8.971
  788   HD13  LEU 104          3HD1      LEU 104   8.405   5.317  -9.832
  789   HD21  LEU 104          1HD2      LEU 104   8.364   5.254  -5.588
  790   HD22  LEU 104          2HD2      LEU 104   7.126   6.169  -6.446
  791   HD23  LEU 104          3HD2      LEU 104   8.799   6.724  -6.457
  792    H    GLU 105           H        GLU 105  10.407   1.462  -6.720
  793    HA   GLU 105           HA       GLU 105  11.782   2.110  -9.167
  794    HB2  GLU 105          2HB       GLU 105  12.834   2.272  -6.907
  795    HB3  GLU 105          1HB       GLU 105  12.725   0.528  -6.767
  796    HG2  GLU 105          2HG       GLU 105  14.963   1.295  -7.396
  797    HG3  GLU 105          1HG       GLU 105  14.243   0.237  -8.611
  798    H    LEU 106           H        LEU 106  13.043   0.433 -10.321
  799    HA   LEU 106           HA       LEU 106  13.363  -1.553 -11.372
  800    HB2  LEU 106          2HB       LEU 106  13.208  -2.544  -9.087
  801    HB3  LEU 106          1HB       LEU 106  11.486  -2.755  -9.332
  802    HG   LEU 106           HG       LEU 106  11.975  -4.284 -11.224
  803   HD11  LEU 106          1HD1      LEU 106  14.257  -5.151 -11.473
  804   HD12  LEU 106          2HD1      LEU 106  14.830  -3.946 -10.322
  805   HD13  LEU 106          3HD1      LEU 106  14.152  -3.436 -11.867
  806   HD21  LEU 106          1HD2      LEU 106  13.254  -5.025  -8.596
  807   HD22  LEU 106          2HD2      LEU 106  12.734  -6.156  -9.844
  808   HD23  LEU 106          3HD2      LEU 106  11.543  -5.169  -8.997
  809    H    LYS 107           H        LYS 107  10.765   0.248 -11.472
  810    HA   LYS 107           HA       LYS 107   9.038  -1.518 -12.985
  811    HB2  LYS 107          2HB       LYS 107   8.838   1.434 -12.383
  812    HB3  LYS 107          1HB       LYS 107   7.650   0.536 -13.316
  813    HG2  LYS 107          2HG       LYS 107   7.345  -0.948 -11.319
  814    HG3  LYS 107          1HG       LYS 107   8.355   0.184 -10.416
  815    HD2  LYS 107          2HD       LYS 107   6.785   1.991 -10.928
  816    HD3  LYS 107          1HD       LYS 107   5.777   0.859 -11.833
  817    HE2  LYS 107          2HE       LYS 107   5.538  -0.477  -9.739
  818    HE3  LYS 107          1HE       LYS 107   6.384   0.809  -8.882
  819    HZ1  LYS 107          1HZ       LYS 107   3.824   1.099 -10.355
  820    HZ2  LYS 107          2HZ       LYS 107   4.634   2.343  -9.545
  821    HZ3  LYS 107          3HZ       LYS 107   3.996   1.040  -8.673
  822    H    THR 108           H        THR 108  10.232  -2.111 -14.742
  823    HA   THR 108           HA       THR 108  11.460  -0.167 -16.466
  824    HB   THR 108           HB       THR 108  11.578  -2.318 -17.982
  825    HG1  THR 108          1HG       THR 108  10.315  -3.750 -16.926
  826   HG21  THR 108          1HG2      THR 108  13.605  -3.025 -16.780
  827   HG22  THR 108          2HG2      THR 108  13.113  -2.055 -15.393
  828   HG23  THR 108          3HG2      THR 108  13.511  -1.270 -16.921
  829    H    GLN 109           H        GLN 109   9.467   1.087 -16.748
  830    HA   GLN 109           HA       GLN 109   7.299  -0.062 -18.252
  831    HB2  GLN 109          2HB       GLN 109   7.896   2.832 -17.611
  832    HB3  GLN 109          1HB       GLN 109   6.382   2.212 -18.251
  833    HG2  GLN 109          2HG       GLN 109   7.562   1.531 -15.567
  834    HG3  GLN 109          1HG       GLN 109   6.249   2.669 -15.860
  835   HE21  GLN 109          1HE2      GLN 109   4.229   1.895 -16.457
  836   HE22  GLN 109          2HE2      GLN 109   3.778   0.240 -16.227
  837    H    LYS 110           H        LYS 110   8.093  -0.767 -20.194
  838    HA   LYS 110           HA       LYS 110   9.133   1.322 -21.985
  839    HB2  LYS 110          2HB       LYS 110   9.953  -1.581 -21.834
  840    HB3  LYS 110          1HB       LYS 110  10.414  -0.499 -23.138
  841    HG2  LYS 110          2HG       LYS 110  11.100  -0.070 -20.239
  842    HG3  LYS 110          1HG       LYS 110  12.172  -0.805 -21.429
  843    HD2  LYS 110          2HD       LYS 110  11.032   1.984 -21.593
  844    HD3  LYS 110          1HD       LYS 110  12.663   1.579 -21.065
  845    HE2  LYS 110          2HE       LYS 110  11.489   1.054 -23.792
  846    HE3  LYS 110          1HE       LYS 110  12.656   2.308 -23.389
  847    HZ1  LYS 110          1HZ       LYS 110  13.777   0.453 -24.375
  848    HZ2  LYS 110          2HZ       LYS 110  13.103  -0.625 -23.264
  849    HZ3  LYS 110          3HZ       LYS 110  14.218   0.536 -22.743
  850    H    GLY 111           H        GLY 111   7.455  -1.789 -21.800
  851    HA2  GLY 111          2HA       GLY 111   5.558  -2.449 -22.979
  852    HA3  GLY 111          1HA       GLY 111   5.658  -0.970 -23.924
  853    H    PHE 112           H        PHE 112   8.652  -2.316 -23.822
  854    HA   PHE 112           HA       PHE 112   8.261  -3.658 -26.405
  855    HB2  PHE 112          2HB       PHE 112   9.501  -1.544 -26.623
  856    HB3  PHE 112          1HB       PHE 112  10.668  -2.100 -25.430
  857    HD1  PHE 112          1HD       PHE 112   9.243  -2.958 -28.750
  858    HD2  PHE 112          2HD       PHE 112  12.573  -3.236 -26.117
  859    HE1  PHE 112          1HE       PHE 112  10.579  -3.969 -30.549
  860    HE2  PHE 112          2HE       PHE 112  13.915  -4.247 -27.913
  861    HZ   PHE 112           HZ       PHE 112  12.917  -4.615 -30.134
  Start of MODEL   16
    1    H1   GLY   1          1HT       GLY   1   6.431  21.669 -11.603
    2    H2   GLY   1          2HT       GLY   1   5.704  20.186 -11.264
    3    H    GLY   1           H        GLY   1   5.999  20.327 -10.378
    4    H3   GLY   1          3HT       GLY   1   6.319  21.130 -10.006
    5    HA2  GLY   1          1HA       GLY   1   4.680  22.843 -10.447
    6    HA3  GLY   1          2HA       GLY   1   4.039  21.859 -11.753
    7    H    SER   2           H        SER   2   2.163  20.994 -11.168
    8    HA   SER   2           HA       SER   2   1.935  19.906  -8.440
    9    HB2  SER   2          2HB       SER   2  -0.205  21.360 -10.014
   10    HB3  SER   2          1HB       SER   2  -0.437  20.601  -8.441
   11    HG   SER   2           HG       SER   2  -0.045  22.761  -8.096
   12    H    ALA   3           H        ALA   3   2.668  17.955  -9.640
   13    HA   ALA   3           HA       ALA   3   0.647  16.676 -11.302
   14    HB1  ALA   3          1HB       ALA   3   2.975  16.452 -11.967
   15    HB2  ALA   3          2HB       ALA   3   2.306  14.877 -11.547
   16    HB3  ALA   3          3HB       ALA   3   3.367  15.713 -10.415
   17    H    MET   4           H        MET   4  -1.036  16.335  -9.822
   18    HA   MET   4           HA       MET   4  -0.432  14.544  -7.569
   19    HB2  MET   4          2HB       MET   4  -1.583  16.761  -7.131
   20    HB3  MET   4          1HB       MET   4  -2.968  16.127  -8.006
   21    HG2  MET   4          2HG       MET   4  -3.090  14.270  -6.369
   22    HG3  MET   4          1HG       MET   4  -1.785  15.032  -5.464
   23    HE1  MET   4          1HE       MET   4  -4.850  16.714  -7.342
   24    HE2  MET   4          2HE       MET   4  -6.004  16.819  -6.015
   25    HE3  MET   4          3HE       MET   4  -5.501  15.242  -6.623
   26    H    GLY   5           H        GLY   5  -0.437  13.392 -10.064
   27    HA2  GLY   5          2HA       GLY   5  -2.983  12.218 -10.672
   28    HA3  GLY   5          1HA       GLY   5  -1.423  11.712 -11.311
   29    H    HIS   6           H        HIS   6  -0.037  10.442  -9.859
   30    HA   HIS   6           HA       HIS   6  -1.585   8.996  -7.820
   31    HB2  HIS   6          2HB       HIS   6  -0.324   6.962  -8.298
   32    HB3  HIS   6          1HB       HIS   6  -1.147   7.523  -9.743
   33    HD1  HIS   6          1HD       HIS   6   0.334   8.359 -11.702
   34    HD2  HIS   6          2HD       HIS   6   2.459   6.903  -8.438
   35    HE1  HIS   6          1HE       HIS   6   2.685   8.021 -12.519
   36    HE2  HIS   6          2HE       HIS   6   3.870   6.906 -10.600
   37    H    MET   7           H        MET   7  -0.050  11.377  -7.592
   38    HA   MET   7           HA       MET   7   1.886  10.515  -5.562
   39    HB2  MET   7          2HB       MET   7   2.318  12.748  -7.567
   40    HB3  MET   7          1HB       MET   7   3.390  12.361  -6.231
   41    HG2  MET   7          2HG       MET   7   2.759  10.495  -8.504
   42    HG3  MET   7          1HG       MET   7   4.172  11.544  -8.430
   43    HE1  MET   7          1HE       MET   7   5.141  11.443  -5.486
   44    HE2  MET   7          2HE       MET   7   6.215  11.191  -6.861
   45    HE3  MET   7          3HE       MET   7   6.237  10.061  -5.508
   46    H    VAL   8           H        VAL   8   1.659  11.640  -3.658
   47    HA   VAL   8           HA       VAL   8   0.041  14.064  -3.644
   48    HB   VAL   8           HB       VAL   8  -0.777  12.500  -1.405
   49   HG11  VAL   8          1HG1      VAL   8  -3.020  12.998  -2.267
   50   HG12  VAL   8          2HG1      VAL   8  -2.294  13.609  -3.753
   51   HG13  VAL   8          3HG1      VAL   8  -1.975  14.418  -2.217
   52   HG21  VAL   8          1HG2      VAL   8  -1.342  11.202  -4.067
   53   HG22  VAL   8          2HG2      VAL   8  -2.090  10.767  -2.530
   54   HG23  VAL   8          3HG2      VAL   8  -0.358  10.530  -2.766
   55    H    LYS   9           H        LYS   9   0.729  11.989  -1.060
   56    HA   LYS   9           HA       LYS   9   2.850  13.773  -0.099
   57    HB2  LYS   9          2HB       LYS   9   0.869  12.074   1.437
   58    HB3  LYS   9          1HB       LYS   9   2.334  12.718   2.179
   59    HG2  LYS   9          2HG       LYS   9   0.141  14.335   0.913
   60    HG3  LYS   9          1HG       LYS   9   0.370  14.093   2.643
   61    HD2  LYS   9          2HD       LYS   9   2.544  15.211   2.512
   62    HD3  LYS   9          1HD       LYS   9   2.319  15.448   0.777
   63    HE2  LYS   9          2HE       LYS   9   0.326  16.798   1.226
   64    HE3  LYS   9          1HE       LYS   9   0.566  16.574   2.957
   65    HZ1  LYS   9          1HZ       LYS   9   1.431  18.699   2.246
   66    HZ2  LYS   9          2HZ       LYS   9   2.431  17.955   1.105
   67    HZ3  LYS   9          3HZ       LYS   9   2.704  17.709   2.756
   68    H    ILE  10           H        ILE  10   3.639  12.145  -1.965
   69    HA   ILE  10           HA       ILE  10   4.845   9.856  -0.612
   70    HB   ILE  10           HB       ILE  10   4.152  10.112  -3.541
   71   HG12  ILE  10          2HG1      ILE  10   2.939   8.337  -1.410
   72   HG13  ILE  10          1HG1      ILE  10   2.180   9.786  -2.061
   73   HG21  ILE  10          1HG2      ILE  10   5.283   7.771  -2.011
   74   HG22  ILE  10          2HG2      ILE  10   6.182   8.795  -3.129
   75   HG23  ILE  10          3HG2      ILE  10   4.859   7.792  -3.722
   76   HD11  ILE  10          1HD1      ILE  10   2.074   8.758  -4.259
   77   HD12  ILE  10          2HD1      ILE  10   1.275   7.751  -3.052
   78   HD13  ILE  10          3HD1      ILE  10   2.881   7.320  -3.638
   79    H    SER  11           H        SER  11   6.788  10.760  -0.045
   80    HA   SER  11           HA       SER  11   8.505  11.694  -2.225
   81    HB2  SER  11          2HB       SER  11   8.539  12.885  -0.012
   82    HB3  SER  11          1HB       SER  11   9.139  11.402   0.729
   83    HG   SER  11           HG       SER  11  10.451  13.273  -0.803
   84    H    HIS  12           H        HIS  12  10.930  10.602  -1.603
   85    HA   HIS  12           HA       HIS  12  10.838   7.998  -2.621
   86    HB2  HIS  12          2HB       HIS  12  12.917   9.095  -0.728
   87    HB3  HIS  12          1HB       HIS  12  13.135   7.757  -1.845
   88    HD1  HIS  12          1HD       HIS  12  14.437  10.859  -1.569
   89    HD2  HIS  12          2HD       HIS  12  12.235   9.102  -4.627
   90    HE1  HIS  12          1HE       HIS  12  14.986  12.174  -3.640
   91    HE2  HIS  12          2HE       HIS  12  13.533  11.182  -5.444
   92    H    GLU  13           H        GLU  13  11.150   9.217   0.637
   93    HA   GLU  13           HA       GLU  13  11.277   6.780   1.975
   94    HB2  GLU  13          2HB       GLU  13  10.645   8.117   3.982
   95    HB3  GLU  13          1HB       GLU  13  11.977   8.794   3.045
   96    HG2  GLU  13          2HG       GLU  13  10.414  10.380   2.002
   97    HG3  GLU  13          1HG       GLU  13   9.118   9.735   3.006
   98    H    ASP  14           H        ASP  14   8.451   8.723   0.982
   99    HA   ASP  14           HA       ASP  14   6.682   7.324   2.701
  100    HB2  ASP  14          2HB       ASP  14   6.135   9.015   0.280
  101    HB3  ASP  14          1HB       ASP  14   4.898   8.392   1.370
  102    H    THR  15           H        THR  15   7.372   7.021  -0.800
  103    HA   THR  15           HA       THR  15   5.507   4.955  -1.238
  104    HB   THR  15           HB       THR  15   7.738   4.508  -2.920
  105    HG1  THR  15          1HG       THR  15   7.157   7.109  -3.434
  106   HG21  THR  15          1HG2      THR  15   5.083   5.864  -3.345
  107   HG22  THR  15          2HG2      THR  15   5.472   4.165  -3.620
  108   HG23  THR  15          3HG2      THR  15   6.183   5.411  -4.646
  109    H    GLN  16           H        GLN  16   8.892   4.908  -0.186
  110    HA   GLN  16           HA       GLN  16   9.288   2.151  -0.112
  111    HB2  GLN  16          2HB       GLN  16  10.310   4.343   1.696
  112    HB3  GLN  16          1HB       GLN  16  10.810   2.665   1.865
  113    HG2  GLN  16          2HG       GLN  16  11.743   2.694  -0.366
  114    HG3  GLN  16          1HG       GLN  16  11.181   4.349  -0.593
  115   HE21  GLN  16          1HE2      GLN  16  12.236   6.019   0.429
  116   HE22  GLN  16          2HE2      GLN  16  13.783   5.835   1.176
  117    H    ARG  17           H        ARG  17   7.883   4.358   2.245
  118    HA   ARG  17           HA       ARG  17   7.459   2.524   4.312
  119    HB2  ARG  17          2HB       ARG  17   6.122   5.107   3.563
  120    HB3  ARG  17          1HB       ARG  17   5.611   4.188   4.968
  121    HG2  ARG  17          2HG       ARG  17   7.365   4.850   6.186
  122    HG3  ARG  17          1HG       ARG  17   8.487   4.682   4.836
  123    HD2  ARG  17          2HD       ARG  17   7.979   6.794   3.989
  124    HD3  ARG  17          1HD       ARG  17   6.502   6.920   4.948
  125    HE   ARG  17           HE       ARG  17   8.713   6.747   6.677
  126   HH11  ARG  17          1HH1      ARG  17   7.168   8.956   4.446
  127   HH12  ARG  17          2HH1      ARG  17   7.870  10.366   5.169
  128   HH21  ARG  17          1HH2      ARG  17   9.594   8.624   7.656
  129   HH22  ARG  17          2HH2      ARG  17   9.233  10.183   6.987
  130    H    ILE  18           H        ILE  18   5.175   3.692   1.804
  131    HA   ILE  18           HA       ILE  18   2.994   2.196   2.719
  132    HB   ILE  18           HB       ILE  18   3.532   3.054  -0.120
  133   HG12  ILE  18          2HG1      ILE  18   1.598   4.583   1.420
  134   HG13  ILE  18          1HG1      ILE  18   3.201   4.635   2.148
  135   HG21  ILE  18          1HG2      ILE  18   1.043   2.964  -0.278
  136   HG22  ILE  18          2HG2      ILE  18   1.020   2.201   1.316
  137   HG23  ILE  18          3HG2      ILE  18   1.810   1.394  -0.040
  138   HD11  ILE  18          1HD1      ILE  18   2.576   5.309  -0.714
  139   HD12  ILE  18          2HD1      ILE  18   4.143   5.439   0.092
  140   HD13  ILE  18          3HD1      ILE  18   2.806   6.476   0.589
  141    H    LYS  19           H        LYS  19   5.339   1.431   0.140
  142    HA   LYS  19           HA       LYS  19   4.216  -1.043  -0.557
  143    HB2  LYS  19          2HB       LYS  19   6.657   0.416  -1.090
  144    HB3  LYS  19          1HB       LYS  19   6.966  -1.312  -0.908
  145    HG2  LYS  19          2HG       LYS  19   5.325  -1.799  -2.641
  146    HG3  LYS  19          1HG       LYS  19   4.927  -0.083  -2.773
  147    HD2  LYS  19          2HD       LYS  19   7.260   0.364  -3.438
  148    HD3  LYS  19          1HD       LYS  19   7.578  -1.369  -3.396
  149    HE2  LYS  19          2HE       LYS  19   5.551   0.001  -5.143
  150    HE3  LYS  19          1HE       LYS  19   7.148  -0.522  -5.668
  151    HZ1  LYS  19          1HZ       LYS  19   6.510  -2.804  -5.064
  152    HZ2  LYS  19          2HZ       LYS  19   5.546  -2.152  -6.300
  153    HZ3  LYS  19          3HZ       LYS  19   4.937  -2.260  -4.728
  154    H    THR  20           H        THR  20   6.916  -0.268   1.614
  155    HA   THR  20           HA       THR  20   7.528  -2.936   2.091
  156    HB   THR  20           HB       THR  20   9.150  -1.114   2.505
  157    HG1  THR  20          1HG       THR  20   9.026  -3.310   3.692
  158   HG21  THR  20          1HG2      THR  20   7.487  -0.579   4.973
  159   HG22  THR  20          2HG2      THR  20   7.662   0.501   3.591
  160   HG23  THR  20          3HG2      THR  20   9.055   0.143   4.614
  161    H    ALA  21           H        ALA  21   5.408  -0.710   3.854
  162    HA   ALA  21           HA       ALA  21   5.193  -2.447   6.084
  163    HB1  ALA  21          1HB       ALA  21   4.804  -0.053   6.295
  164    HB2  ALA  21          2HB       ALA  21   3.389  -0.967   6.818
  165    HB3  ALA  21          3HB       ALA  21   3.397  -0.182   5.235
  166    H    PHE  22           H        PHE  22   2.810  -1.530   3.614
  167    HA   PHE  22           HA       PHE  22   0.727  -3.183   4.173
  168    HB2  PHE  22          2HB       PHE  22   0.283  -1.855   2.425
  169    HB3  PHE  22          1HB       PHE  22   1.921  -1.906   1.814
  170    HD1  PHE  22          1HD       PHE  22  -1.228  -3.837   1.906
  171    HD2  PHE  22          2HD       PHE  22   2.384  -3.025  -0.141
  172    HE1  PHE  22          1HE       PHE  22  -2.079  -5.103  -0.071
  173    HE2  PHE  22          2HE       PHE  22   1.598  -4.309  -2.077
  174    HZ   PHE  22           HZ       PHE  22  -0.642  -5.346  -2.053
  175    H    LEU  23           H        LEU  23   3.479  -4.193   2.094
  176    HA   LEU  23           HA       LEU  23   2.516  -6.812   1.715
  177    HB2  LEU  23          2HB       LEU  23   5.361  -5.828   1.611
  178    HB3  LEU  23          1HB       LEU  23   4.748  -7.303   0.882
  179    HG   LEU  23           HG       LEU  23   3.621  -4.635   0.112
  180   HD11  LEU  23          1HD1      LEU  23   6.037  -5.994  -1.085
  181   HD12  LEU  23          2HD1      LEU  23   6.048  -4.494  -0.153
  182   HD13  LEU  23          3HD1      LEU  23   5.234  -4.555  -1.718
  183   HD21  LEU  23          1HD2      LEU  23   3.779  -7.354  -1.178
  184   HD22  LEU  23          2HD2      LEU  23   3.228  -5.901  -2.010
  185   HD23  LEU  23          3HD2      LEU  23   2.337  -6.504  -0.608
  186    H    SER  24           H        SER  24   5.157  -5.677   3.878
  187    HA   SER  24           HA       SER  24   5.699  -8.285   4.818
  188    HB2  SER  24          2HB       SER  24   7.151  -7.207   6.457
  189    HB3  SER  24          1HB       SER  24   7.406  -6.664   4.809
  190    HG   SER  24           HG       SER  24   6.573  -4.723   5.288
  191    H    TYR  25           H        TYR  25   3.558  -5.795   5.822
  192    HA   TYR  25           HA       TYR  25   3.201  -6.554   8.512
  193    HB2  TYR  25          2HB       TYR  25   1.719  -4.829   6.553
  194    HB3  TYR  25          1HB       TYR  25   0.877  -5.333   8.029
  195    HD1  TYR  25          1HD       TYR  25   4.426  -4.322   7.403
  196    HD2  TYR  25          2HD       TYR  25   0.817  -3.555   9.511
  197    HE1  TYR  25          1HE       TYR  25   5.553  -2.543   8.651
  198    HE2  TYR  25          2HE       TYR  25   1.933  -1.769  10.778
  199    HH   TYR  25           HH       TYR  25   4.273  -1.188  11.453
  200    H    ALA  26           H        ALA  26   1.236  -7.203   5.605
  201    HA   ALA  26           HA       ALA  26  -0.590  -8.800   7.127
  202    HB1  ALA  26          1HB       ALA  26  -0.288  -8.884   4.150
  203    HB2  ALA  26          2HB       ALA  26  -1.048  -7.529   4.989
  204    HB3  ALA  26          3HB       ALA  26  -1.737  -9.147   5.127
  205    H    GLN  27           H        GLN  27   1.427  -9.774   4.347
  206    HA   GLN  27           HA       GLN  27   1.460 -12.441   5.567
  207    HB2  GLN  27          2HB       GLN  27   1.700 -12.030   2.605
  208    HB3  GLN  27          1HB       GLN  27   1.228 -13.471   3.499
  209    HG2  GLN  27          2HG       GLN  27  -0.864 -12.377   4.186
  210    HG3  GLN  27          1HG       GLN  27  -0.424 -10.972   3.220
  211   HE21  GLN  27          1HE2      GLN  27  -0.691 -11.018   1.029
  212   HE22  GLN  27          2HE2      GLN  27  -1.450 -12.347   0.196
  213    H    GLY  28           H        GLY  28   3.322  -9.908   4.184
  214    HA2  GLY  28          2HA       GLY  28   5.624  -9.783   3.837
  215    HA3  GLY  28          1HA       GLY  28   5.764 -11.476   4.286
  216    H    GLN  29           H        GLN  29   3.289 -11.561   2.249
  217    HA   GLN  29           HA       GLN  29   4.984 -12.442   0.070
  218    HB2  GLN  29          2HB       GLN  29   1.983 -12.553   0.140
  219    HB3  GLN  29          1HB       GLN  29   3.101 -13.607  -0.715
  220    HG2  GLN  29          2HG       GLN  29   3.917 -14.433   1.467
  221    HG3  GLN  29          1HG       GLN  29   2.671 -13.445   2.246
  222   HE21  GLN  29          1HE2      GLN  29   0.721 -13.964   0.129
  223   HE22  GLN  29          2HE2      GLN  29   0.180 -15.587   0.370
  224    H    ASP  30           H        ASP  30   3.264 -12.149  -2.054
  225    HA   ASP  30           HA       ASP  30   3.938  -9.519  -2.932
  226    HB2  ASP  30          2HB       ASP  30   3.986 -11.610  -4.319
  227    HB3  ASP  30          1HB       ASP  30   2.231 -11.609  -4.297
  228    H    LYS  31           H        LYS  31   1.314 -10.632  -1.143
  229    HA   LYS  31           HA       LYS  31  -0.308  -8.333  -1.919
  230    HB2  LYS  31          2HB       LYS  31  -1.400 -11.151  -1.734
  231    HB3  LYS  31          1HB       LYS  31  -2.380  -9.703  -1.861
  232    HG2  LYS  31          2HG       LYS  31  -0.867  -9.377  -4.032
  233    HG3  LYS  31          1HG       LYS  31  -0.826 -11.127  -3.921
  234    HD2  LYS  31          2HD       LYS  31  -3.305  -9.416  -3.993
  235    HD3  LYS  31          1HD       LYS  31  -2.685 -10.385  -5.335
  236    HE2  LYS  31          2HE       LYS  31  -3.930 -11.221  -2.770
  237    HE3  LYS  31          1HE       LYS  31  -4.427 -11.623  -4.401
  238    HZ1  LYS  31          1HZ       LYS  31  -3.402 -13.517  -3.322
  239    HZ2  LYS  31          2HZ       LYS  31  -1.984 -12.639  -3.055
  240    HZ3  LYS  31          3HZ       LYS  31  -2.462 -13.008  -4.632
  241    H    VAL  32           H        VAL  32  -2.414  -8.603  -0.328
  242    HA   VAL  32           HA       VAL  32  -1.312  -9.065   2.353
  243    HB   VAL  32           HB       VAL  32  -2.509  -6.585   1.237
  244   HG11  VAL  32          1HG1      VAL  32  -2.641  -7.445   4.096
  245   HG12  VAL  32          2HG1      VAL  32  -3.959  -6.910   3.061
  246   HG13  VAL  32          3HG1      VAL  32  -2.726  -5.764   3.583
  247   HG21  VAL  32          1HG2      VAL  32  -0.232  -7.201   3.081
  248   HG22  VAL  32          2HG2      VAL  32  -0.702  -5.596   2.529
  249   HG23  VAL  32          3HG2      VAL  32  -0.125  -6.791   1.369
  250    H    THR  33           H        THR  33  -2.591 -10.004   3.769
  251    HA   THR  33           HA       THR  33  -5.188 -10.907   3.074
  252    HB   THR  33           HB       THR  33  -5.315 -11.454   5.550
  253    HG1  THR  33          1HG       THR  33  -3.534 -11.057   6.811
  254   HG21  THR  33          1HG2      THR  33  -4.515 -13.100   3.944
  255   HG22  THR  33          2HG2      THR  33  -3.598 -13.211   5.447
  256   HG23  THR  33          3HG2      THR  33  -2.891 -12.420   4.038
  257    H    GLU  34           H        GLU  34  -7.095 -10.289   4.295
  258    HA   GLU  34           HA       GLU  34  -7.545  -7.637   3.624
  259    HB2  GLU  34          2HB       GLU  34  -9.188  -9.259   3.311
  260    HB3  GLU  34          1HB       GLU  34  -9.277  -9.627   5.038
  261    HG2  GLU  34          2HG       GLU  34 -10.312  -7.531   5.496
  262    HG3  GLU  34          1HG       GLU  34  -9.998  -6.954   3.857
  263    H    ALA  35           H        ALA  35  -6.482  -8.903   6.584
  264    HA   ALA  35           HA       ALA  35  -7.592  -7.132   8.452
  265    HB1  ALA  35          1HB       ALA  35  -4.915  -8.516   8.561
  266    HB2  ALA  35          2HB       ALA  35  -6.451  -9.216   9.070
  267    HB3  ALA  35          3HB       ALA  35  -5.790  -7.823   9.927
  268    H    MET  36           H        MET  36  -4.309  -7.053   6.977
  269    HA   MET  36           HA       MET  36  -3.657  -4.454   7.826
  270    HB2  MET  36          2HB       MET  36  -2.546  -6.413   6.016
  271    HB3  MET  36          1HB       MET  36  -2.483  -4.830   5.296
  272    HG2  MET  36          2HG       MET  36  -1.585  -4.916   8.065
  273    HG3  MET  36          1HG       MET  36  -0.612  -5.871   6.944
  274    HE1  MET  36          1HE       MET  36  -2.605  -2.471   6.508
  275    HE2  MET  36          2HE       MET  36  -1.283  -1.320   6.717
  276    HE3  MET  36          3HE       MET  36  -1.775  -2.355   8.058
  277    H    ILE  37           H        ILE  37  -5.655  -5.711   5.323
  278    HA   ILE  37           HA       ILE  37  -5.609  -3.425   3.631
  279    HB   ILE  37           HB       ILE  37  -7.140  -5.910   3.816
  280   HG12  ILE  37          2HG1      ILE  37  -5.683  -6.335   2.183
  281   HG13  ILE  37          1HG1      ILE  37  -6.496  -5.125   1.226
  282   HG21  ILE  37          1HG2      ILE  37  -8.940  -4.309   3.577
  283   HG22  ILE  37          2HG2      ILE  37  -8.694  -5.187   2.068
  284   HG23  ILE  37          3HG2      ILE  37  -8.098  -3.537   2.235
  285   HD11  ILE  37          1HD1      ILE  37  -4.083  -4.784   1.328
  286   HD12  ILE  37          2HD1      ILE  37  -4.224  -4.523   3.064
  287   HD13  ILE  37          3HD1      ILE  37  -5.009  -3.416   1.934
  288    H    ASP  38           H        ASP  38  -7.772  -4.589   6.201
  289    HA   ASP  38           HA       ASP  38  -9.683  -2.590   6.231
  290    HB2  ASP  38          2HB       ASP  38  -9.460  -4.830   7.455
  291    HB3  ASP  38          1HB       ASP  38  -8.557  -3.932   8.667
  292    H    GLN  39           H        GLN  39  -6.453  -2.704   7.665
  293    HA   GLN  39           HA       GLN  39  -6.532  -0.449   9.297
  294    HB2  GLN  39          2HB       GLN  39  -4.607  -1.964   9.235
  295    HB3  GLN  39          1HB       GLN  39  -4.279  -1.522   7.570
  296    HG2  GLN  39          2HG       GLN  39  -4.272   0.726   9.463
  297    HG3  GLN  39          1HG       GLN  39  -3.033  -0.485   9.740
  298   HE21  GLN  39          1HE2      GLN  39  -4.173   0.226   6.517
  299   HE22  GLN  39          2HE2      GLN  39  -2.727   1.007   5.992
  300    H    LEU  40           H        LEU  40  -5.754  -0.806   5.890
  301    HA   LEU  40           HA       LEU  40  -5.338   1.973   5.463
  302    HB2  LEU  40          2HB       LEU  40  -4.304   0.260   4.087
  303    HB3  LEU  40          1HB       LEU  40  -5.890  -0.248   3.511
  304    HG   LEU  40           HG       LEU  40  -5.852   2.417   2.872
  305   HD11  LEU  40          1HD1      LEU  40  -3.270   1.707   1.776
  306   HD12  LEU  40          2HD1      LEU  40  -3.255   1.771   3.538
  307   HD13  LEU  40          3HD1      LEU  40  -3.781   3.180   2.610
  308   HD21  LEU  40          1HD2      LEU  40  -6.622   0.645   1.410
  309   HD22  LEU  40          2HD2      LEU  40  -4.971   0.054   1.215
  310   HD23  LEU  40          3HD2      LEU  40  -5.421   1.632   0.569
  311    H    ILE  41           H        ILE  41  -8.008  -0.234   4.595
  312    HA   ILE  41           HA       ILE  41  -9.497   1.725   3.250
  313    HB   ILE  41           HB       ILE  41 -10.355  -0.862   4.525
  314   HG12  ILE  41          2HG1      ILE  41  -8.759  -0.693   2.497
  315   HG13  ILE  41          1HG1      ILE  41 -10.134  -1.787   2.371
  316   HG21  ILE  41          1HG2      ILE  41 -11.969   0.972   2.753
  317   HG22  ILE  41          2HG2      ILE  41 -12.284   0.624   4.453
  318   HG23  ILE  41          3HG2      ILE  41 -12.442  -0.654   3.247
  319   HD11  ILE  41          1HD1      ILE  41  -9.777  -0.526   0.325
  320   HD12  ILE  41          2HD1      ILE  41  -9.943   0.988   1.215
  321   HD13  ILE  41          3HD1      ILE  41 -11.325  -0.103   1.062
  322    H    CYS  42           H        CYS  42  -9.958   0.541   6.624
  323    HA   CYS  42           HA       CYS  42 -11.898   2.617   7.092
  324    HB2  CYS  42          2HB       CYS  42 -10.579   0.998   9.246
  325    HB3  CYS  42          1HB       CYS  42 -12.149   1.762   9.273
  326    HG   CYS  42           HG       CYS  42 -11.443  -1.310   8.559
  327    H    GLY  43           H        GLY  43  -8.619   2.560   6.822
  328    HA2  GLY  43          2HA       GLY  43  -7.701   4.488   8.600
  329    HA3  GLY  43          1HA       GLY  43  -7.112   4.259   6.959
  330    H    ALA  44           H        ALA  44  -9.124   5.078   5.348
  331    HA   ALA  44           HA       ALA  44  -9.335   7.935   5.987
  332    HB1  ALA  44          1HB       ALA  44  -9.906   8.265   3.669
  333    HB2  ALA  44          2HB       ALA  44 -10.111   6.526   3.429
  334    HB3  ALA  44          3HB       ALA  44  -8.501   7.192   3.736
  335    H    PHE  45           H        PHE  45 -11.370   5.385   4.677
  336    HA   PHE  45           HA       PHE  45 -13.816   6.744   5.386
  337    HB2  PHE  45          2HB       PHE  45 -13.918   3.909   4.669
  338    HB3  PHE  45          1HB       PHE  45 -14.849   5.273   4.060
  339    HD1  PHE  45          1HD       PHE  45 -12.214   3.011   3.333
  340    HD2  PHE  45          2HD       PHE  45 -13.701   6.881   2.412
  341    HE1  PHE  45          1HE       PHE  45 -10.889   3.012   1.271
  342    HE2  PHE  45          2HE       PHE  45 -12.360   6.900   0.344
  343    HZ   PHE  45           HZ       PHE  45 -10.940   4.960  -0.223
  344    HA   PRO  46           HA       PRO  46 -14.304   4.905   9.292
  345    HB2  PRO  46          2HB       PRO  46 -16.812   4.099   9.537
  346    HB3  PRO  46          1HB       PRO  46 -16.431   5.799   9.247
  347    HG2  PRO  46          2HG       PRO  46 -17.050   3.672   7.218
  348    HG3  PRO  46          1HG       PRO  46 -17.937   5.204   7.472
  349    HD2  PRO  46          2HD       PRO  46 -16.058   5.046   5.609
  350    HD3  PRO  46          1HD       PRO  46 -16.127   6.483   6.658
  351    H    GLY  47           H        GLY  47 -15.415   2.895  10.494
  352    HA2  GLY  47          2HA       GLY  47 -14.147   0.528   9.568
  353    HA3  GLY  47          1HA       GLY  47 -15.265   0.650  10.923
  354    H    LEU  48           H        LEU  48 -15.027   0.462   7.461
  355    HA   LEU  48           HA       LEU  48 -17.709   0.285   6.771
  356    HB2  LEU  48          2HB       LEU  48 -15.269  -0.933   5.495
  357    HB3  LEU  48          1HB       LEU  48 -16.848  -0.960   4.746
  358    HG   LEU  48           HG       LEU  48 -15.157   1.464   5.347
  359   HD11  LEU  48          1HD1      LEU  48 -14.505   0.132   3.392
  360   HD12  LEU  48          2HD1      LEU  48 -15.124   1.721   2.934
  361   HD13  LEU  48          3HD1      LEU  48 -16.141   0.290   2.751
  362   HD21  LEU  48          1HD2      LEU  48 -17.481   2.018   5.772
  363   HD22  LEU  48          2HD2      LEU  48 -17.955   1.316   4.226
  364   HD23  LEU  48          3HD2      LEU  48 -16.947   2.762   4.267
  365    H    SER  49           H        SER  49 -19.217  -1.224   6.961
  366    HA   SER  49           HA       SER  49 -18.862  -3.701   8.223
  367    HB2  SER  49          2HB       SER  49 -21.062  -2.525   7.917
  368    HB3  SER  49          1HB       SER  49 -21.008  -2.960   6.209
  369    HG   SER  49           HG       SER  49 -21.312  -4.624   8.467
  370    H    TRP  50           H        TRP  50 -18.825  -5.851   7.250
  371    HA   TRP  50           HA       TRP  50 -16.649  -5.951   5.552
  372    HB2  TRP  50          2HB       TRP  50 -17.356  -7.788   7.103
  373    HB3  TRP  50          1HB       TRP  50 -18.577  -8.235   5.911
  374    HD1  TRP  50           HD       TRP  50 -14.748  -7.671   5.878
  375    HE1  TRP  50          1HE       TRP  50 -13.730  -9.423   4.292
  376    HE3  TRP  50          3HE       TRP  50 -19.049  -9.972   4.396
  377    HZ2  TRP  50          2HZ       TRP  50 -14.666 -11.507   2.659
  378    HZ3  TRP  50          3HZ       TRP  50 -18.902 -11.842   2.808
  379    HH2  TRP  50           HH       TRP  50 -16.744 -12.599   1.955
  380    H    GLU  51           H        GLU  51 -20.061  -6.361   4.704
  381    HA   GLU  51           HA       GLU  51 -19.695  -7.094   2.030
  382    HB2  GLU  51          2HB       GLU  51 -21.916  -5.547   3.359
  383    HB3  GLU  51          1HB       GLU  51 -21.971  -6.047   1.675
  384    HG2  GLU  51          2HG       GLU  51 -21.742  -7.882   4.042
  385    HG3  GLU  51          1HG       GLU  51 -23.196  -7.575   3.120
  386    H    GLN  52           H        GLN  52 -19.876  -3.891   3.512
  387    HA   GLN  52           HA       GLN  52 -19.787  -2.467   1.044
  388    HB2  GLN  52          2HB       GLN  52 -20.764  -1.519   3.095
  389    HB3  GLN  52          1HB       GLN  52 -19.182  -1.532   3.857
  390    HG2  GLN  52          2HG       GLN  52 -19.807   0.693   3.080
  391    HG3  GLN  52          1HG       GLN  52 -18.366   0.096   2.260
  392   HE21  GLN  52          1HE2      GLN  52 -18.449  -0.364   0.085
  393   HE22  GLN  52          2HE2      GLN  52 -19.774   0.111  -0.922
  394    H    LEU  53           H        LEU  53 -17.377  -3.608   3.333
  395    HA   LEU  53           HA       LEU  53 -15.265  -2.062   2.160
  396    HB2  LEU  53          2HB       LEU  53 -15.053  -2.625   4.472
  397    HB3  LEU  53          1HB       LEU  53 -15.246  -4.332   4.135
  398    HG   LEU  53           HG       LEU  53 -12.943  -3.050   2.787
  399   HD11  LEU  53          1HD1      LEU  53 -12.979  -3.482   5.781
  400   HD12  LEU  53          2HD1      LEU  53 -12.879  -1.921   4.966
  401   HD13  LEU  53          3HD1      LEU  53 -11.562  -3.085   4.809
  402   HD21  LEU  53          1HD2      LEU  53 -13.345  -5.439   2.624
  403   HD22  LEU  53          2HD2      LEU  53 -13.301  -5.590   4.381
  404   HD23  LEU  53          3HD2      LEU  53 -11.843  -5.128   3.501
  405    H    GLN  54           H        GLN  54 -16.418  -5.393   1.928
  406    HA   GLN  54           HA       GLN  54 -14.241  -6.362   0.468
  407    HB2  GLN  54          2HB       GLN  54 -15.516  -8.276   0.017
  408    HB3  GLN  54          1HB       GLN  54 -16.069  -7.705   1.570
  409    HG2  GLN  54          2HG       GLN  54 -18.115  -7.039   0.766
  410    HG3  GLN  54          1HG       GLN  54 -17.531  -6.890  -0.890
  411   HE21  GLN  54          1HE2      GLN  54 -18.716  -9.065   1.546
  412   HE22  GLN  54          2HE2      GLN  54 -18.958 -10.412   0.494
  413    H    GLU  55           H        GLU  55 -17.284  -4.855  -0.597
  414    HA   GLU  55           HA       GLU  55 -16.749  -5.159  -3.365
  415    HB2  GLU  55          2HB       GLU  55 -18.551  -3.529  -3.723
  416    HB3  GLU  55          1HB       GLU  55 -19.020  -4.801  -2.605
  417    HG2  GLU  55          2HG       GLU  55 -18.632  -3.284  -0.735
  418    HG3  GLU  55          1HG       GLU  55 -18.169  -2.027  -1.844
  419    H    LYS  56           H        LYS  56 -15.896  -2.733  -0.994
  420    HA   LYS  56           HA       LYS  56 -14.927  -0.662  -2.532
  421    HB2  LYS  56          2HB       LYS  56 -14.725  -1.265   0.109
  422    HB3  LYS  56          1HB       LYS  56 -13.096  -1.679  -0.411
  423    HG2  LYS  56          2HG       LYS  56 -13.150   0.588   0.404
  424    HG3  LYS  56          1HG       LYS  56 -12.833   0.589  -1.331
  425    HD2  LYS  56          2HD       LYS  56 -15.193   1.103  -1.754
  426    HD3  LYS  56          1HD       LYS  56 -15.503   1.102  -0.019
  427    HE2  LYS  56          2HE       LYS  56 -13.986   2.978   0.270
  428    HE3  LYS  56          1HE       LYS  56 -13.607   2.959  -1.453
  429    HZ1  LYS  56          1HZ       LYS  56 -15.217   4.652  -1.020
  430    HZ2  LYS  56          2HZ       LYS  56 -16.237   3.568  -0.223
  431    HZ3  LYS  56          3HZ       LYS  56 -15.979   3.415  -1.885
  432    H    LYS  57           H        LYS  57 -13.481  -3.772  -1.834
  433    HA   LYS  57           HA       LYS  57 -11.116  -3.089  -3.432
  434    HB2  LYS  57          2HB       LYS  57 -10.780  -5.502  -2.001
  435    HB3  LYS  57          1HB       LYS  57 -10.019  -3.944  -1.686
  436    HG2  LYS  57          2HG       LYS  57 -12.048  -3.314  -0.380
  437    HG3  LYS  57          1HG       LYS  57 -12.632  -4.953  -0.603
  438    HD2  LYS  57          2HD       LYS  57 -10.066  -4.205   0.772
  439    HD3  LYS  57          1HD       LYS  57 -11.579  -4.623   1.575
  440    HE2  LYS  57          2HE       LYS  57  -9.891  -6.420  -0.162
  441    HE3  LYS  57          1HE       LYS  57 -10.111  -6.515   1.575
  442    HZ1  LYS  57          1HZ       LYS  57 -12.395  -6.793  -0.280
  443    HZ2  LYS  57          2HZ       LYS  57 -12.300  -7.248   1.356
  444    HZ3  LYS  57          3HZ       LYS  57 -11.450  -8.120   0.181
  445    H    LYS  58           H        LYS  58 -13.972  -4.764  -3.786
  446    HA   LYS  58           HA       LYS  58 -13.266  -7.194  -4.897
  447    HB2  LYS  58          2HB       LYS  58 -15.595  -5.376  -5.347
  448    HB3  LYS  58          1HB       LYS  58 -15.391  -6.785  -6.379
  449    HG2  LYS  58          2HG       LYS  58 -15.381  -8.230  -4.405
  450    HG3  LYS  58          1HG       LYS  58 -15.599  -6.817  -3.375
  451    HD2  LYS  58          2HD       LYS  58 -17.730  -7.878  -3.681
  452    HD3  LYS  58          1HD       LYS  58 -17.731  -6.352  -4.565
  453    HE2  LYS  58          2HE       LYS  58 -17.303  -7.534  -6.645
  454    HE3  LYS  58          1HE       LYS  58 -17.230  -9.067  -5.777
  455    HZ1  LYS  58          1HZ       LYS  58 -19.609  -7.299  -5.964
  456    HZ2  LYS  58          2HZ       LYS  58 -19.540  -8.778  -5.142
  457    HZ3  LYS  58          3HZ       LYS  58 -19.379  -8.738  -6.825
  458    H    GLY  59           H        GLY  59 -12.560  -7.922  -6.787
  459    HA2  GLY  59          2HA       GLY  59 -12.151  -7.431  -9.195
  460    HA3  GLY  59          1HA       GLY  59 -11.570  -5.860  -8.652
  461    H    ARG  60           H        ARG  60  -9.712  -5.878  -7.149
  462    HA   ARG  60           HA       ARG  60  -7.858  -8.047  -7.876
  463    HB2  ARG  60          2HB       ARG  60  -7.374  -5.173  -7.116
  464    HB3  ARG  60          1HB       ARG  60  -6.087  -6.366  -7.109
  465    HG2  ARG  60          2HG       ARG  60  -6.010  -5.125  -9.151
  466    HG3  ARG  60          1HG       ARG  60  -6.499  -6.781  -9.505
  467    HD2  ARG  60          2HD       ARG  60  -7.824  -5.194 -10.790
  468    HD3  ARG  60          1HD       ARG  60  -8.833  -6.066  -9.633
  469    HE   ARG  60           HE       ARG  60  -8.138  -3.788  -8.310
  470   HH11  ARG  60          1HH1      ARG  60  -9.650  -4.455 -11.391
  471   HH12  ARG  60          2HH1      ARG  60 -10.578  -2.990 -11.398
  472   HH21  ARG  60          1HH2      ARG  60  -9.359  -1.849  -8.317
  473   HH22  ARG  60          2HH2      ARG  60 -10.411  -1.510  -9.653
  474    H    ALA  61           H        ALA  61  -9.877  -7.407  -5.559
  475    HA   ALA  61           HA       ALA  61  -8.467  -8.950  -3.593
  476    HB1  ALA  61          1HB       ALA  61  -8.983  -7.267  -1.764
  477    HB2  ALA  61          2HB       ALA  61  -9.180  -6.074  -3.050
  478    HB3  ALA  61          3HB       ALA  61  -7.633  -6.883  -2.821
  479    H    ALA  62           H        ALA  62 -10.508  -9.441  -5.209
  480    HA   ALA  62           HA       ALA  62 -13.097  -9.080  -4.813
  481    HB1  ALA  62          1HB       ALA  62 -13.451 -11.400  -5.403
  482    HB2  ALA  62          2HB       ALA  62 -11.799 -11.788  -4.917
  483    HB3  ALA  62          3HB       ALA  62 -12.087 -10.737  -6.304
  484    H    ALA  63           H        ALA  63 -11.458 -11.621  -2.945
  485    HA   ALA  63           HA       ALA  63 -13.353 -11.095  -0.764
  486    HB1  ALA  63          1HB       ALA  63 -12.849 -13.356   0.040
  487    HB2  ALA  63          2HB       ALA  63 -11.750 -13.592  -1.318
  488    HB3  ALA  63          3HB       ALA  63 -13.475 -13.379  -1.608
  489    H    ASN  64           H        ASN  64 -10.194 -12.710  -0.689
  490    HA   ASN  64           HA       ASN  64  -9.300 -10.599   1.134
  491    HB2  ASN  64          2HB       ASN  64  -9.142 -13.569   1.572
  492    HB3  ASN  64          1HB       ASN  64  -8.123 -12.432   2.449
  493   HD21  ASN  64          1HD2      ASN  64 -10.326 -10.428   2.320
  494   HD22  ASN  64          2HD2      ASN  64 -11.418 -10.893   3.587
  495    H    GLY  65           H        GLY  65  -8.012  -9.606  -0.215
  496    HA2  GLY  65          2HA       GLY  65  -5.355 -10.150  -0.071
  497    HA3  GLY  65          1HA       GLY  65  -5.837 -11.042  -1.495
  498    H    TYR  66           H        TYR  66  -5.807  -7.728  -0.097
  499    HA   TYR  66           HA       TYR  66  -5.823  -6.481  -2.670
  500    HB2  TYR  66          2HB       TYR  66  -5.285  -5.548  -0.004
  501    HB3  TYR  66          1HB       TYR  66  -4.038  -4.960  -1.109
  502    HD1  TYR  66          1HD       TYR  66  -5.240  -2.908   0.018
  503    HD2  TYR  66          2HD       TYR  66  -6.927  -5.213  -3.101
  504    HE1  TYR  66          1HE       TYR  66  -6.653  -0.994  -0.596
  505    HE2  TYR  66          2HE       TYR  66  -8.349  -3.326  -3.743
  506    HH   TYR  66           HH       TYR  66  -9.233  -1.308  -2.889
  507    H    ASP  67           H        ASP  67  -4.404  -6.121  -4.103
  508    HA   ASP  67           HA       ASP  67  -1.887  -7.528  -3.882
  509    HB2  ASP  67          2HB       ASP  67  -3.521  -7.865  -5.754
  510    HB3  ASP  67          1HB       ASP  67  -3.196  -6.199  -6.232
  511    H    ARG  68           H        ARG  68  -0.133  -6.404  -5.029
  512    HA   ARG  68           HA       ARG  68   0.424  -4.061  -3.511
  513    HB2  ARG  68          2HB       ARG  68   2.614  -4.109  -4.757
  514    HB3  ARG  68          1HB       ARG  68   2.227  -5.573  -3.868
  515    HG2  ARG  68          2HG       ARG  68   1.278  -6.407  -6.119
  516    HG3  ARG  68          1HG       ARG  68   2.244  -5.104  -6.814
  517    HD2  ARG  68          2HD       ARG  68   3.280  -7.312  -5.041
  518    HD3  ARG  68          1HD       ARG  68   3.444  -7.246  -6.794
  519    HE   ARG  68           HE       ARG  68   4.955  -5.754  -4.833
  520   HH11  ARG  68          1HH1      ARG  68   4.007  -6.038  -8.189
  521   HH12  ARG  68          2HH1      ARG  68   5.384  -5.163  -8.782
  522   HH21  ARG  68          1HH2      ARG  68   6.781  -4.613  -5.611
  523   HH22  ARG  68          2HH2      ARG  68   6.944  -4.344  -7.324
  524    H    SER  69           H        SER  69  -0.400  -4.732  -6.854
  525    HA   SER  69           HA       SER  69  -0.135  -2.027  -7.721
  526    HB2  SER  69          2HB       SER  69  -1.737  -4.314  -8.888
  527    HB3  SER  69          1HB       SER  69  -1.445  -2.772  -9.690
  528    HG   SER  69           HG       SER  69   0.229  -4.939  -9.348
  529    H    ALA  70           H        ALA  70  -2.837  -4.003  -6.548
  530    HA   ALA  70           HA       ALA  70  -4.910  -2.161  -7.035
  531    HB1  ALA  70          1HB       ALA  70  -4.906  -4.107  -4.742
  532    HB2  ALA  70          2HB       ALA  70  -5.087  -4.637  -6.420
  533    HB3  ALA  70          3HB       ALA  70  -6.274  -3.542  -5.708
  534    H    PHE  71           H        PHE  71  -3.194  -2.937  -4.059
  535    HA   PHE  71           HA       PHE  71  -4.561  -1.030  -2.510
  536    HB2  PHE  71          2HB       PHE  71  -3.757  -2.810  -1.299
  537    HB3  PHE  71          1HB       PHE  71  -2.210  -2.847  -2.101
  538    HD1  PHE  71          1HD       PHE  71  -3.942  -2.033   0.815
  539    HD2  PHE  71          2HD       PHE  71  -0.659  -0.758  -1.562
  540    HE1  PHE  71          1HE       PHE  71  -2.988  -0.894   2.759
  541    HE2  PHE  71          2HE       PHE  71   0.293   0.394   0.382
  542    HZ   PHE  71           HZ       PHE  71  -0.871   0.333   2.541
  543    H    PHE  72           H        PHE  72  -1.472  -0.947  -4.251
  544    HA   PHE  72           HA       PHE  72  -0.638   1.549  -3.242
  545    HB2  PHE  72          2HB       PHE  72   0.905   0.063  -4.408
  546    HB3  PHE  72          1HB       PHE  72   0.011   0.292  -5.907
  547    HD1  PHE  72          1HD       PHE  72   1.777   2.263  -3.287
  548    HD2  PHE  72          2HD       PHE  72   0.743   1.896  -7.398
  549    HE1  PHE  72          1HE       PHE  72   3.186   4.210  -3.809
  550    HE2  PHE  72          2HE       PHE  72   2.148   3.844  -7.931
  551    HZ   PHE  72           HZ       PHE  72   3.373   5.004  -6.135
  552    H    SER  73           H        SER  73  -2.730   0.662  -5.893
  553    HA   SER  73           HA       SER  73  -2.866   3.177  -7.148
  554    HB2  SER  73          2HB       SER  73  -4.939   0.973  -7.062
  555    HB3  SER  73          1HB       SER  73  -4.964   2.346  -8.169
  556    HG   SER  73           HG       SER  73  -2.995   0.295  -8.005
  557    H    LEU  74           H        LEU  74  -4.620   1.799  -4.428
  558    HA   LEU  74           HA       LEU  74  -6.462   3.972  -4.194
  559    HB2  LEU  74          2HB       LEU  74  -6.905   1.728  -3.266
  560    HB3  LEU  74          1HB       LEU  74  -5.590   1.949  -2.131
  561    HG   LEU  74           HG       LEU  74  -6.795   3.653  -0.953
  562   HD11  LEU  74          1HD1      LEU  74  -8.864   3.424  -3.135
  563   HD12  LEU  74          2HD1      LEU  74  -7.824   4.811  -2.813
  564   HD13  LEU  74          3HD1      LEU  74  -9.057   4.344  -1.642
  565   HD21  LEU  74          1HD2      LEU  74  -8.836   2.384  -0.317
  566   HD22  LEU  74          2HD2      LEU  74  -7.363   1.415  -0.333
  567   HD23  LEU  74          3HD2      LEU  74  -8.512   1.293  -1.666
  568    H    VAL  75           H        VAL  75  -3.438   3.131  -2.514
  569    HA   VAL  75           HA       VAL  75  -3.507   5.299  -0.694
  570    HB   VAL  75           HB       VAL  75  -0.985   3.946  -1.655
  571   HG11  VAL  75          1HG1      VAL  75  -0.468   4.231   0.831
  572   HG12  VAL  75          2HG1      VAL  75  -1.745   5.449   0.786
  573   HG13  VAL  75          3HG1      VAL  75  -0.331   5.612  -0.254
  574   HG21  VAL  75          1HG2      VAL  75  -3.082   2.931   0.219
  575   HG22  VAL  75          2HG2      VAL  75  -1.394   2.436   0.363
  576   HG23  VAL  75          3HG2      VAL  75  -2.294   2.092  -1.122
  577    H    ALA  76           H        ALA  76  -2.133   4.935  -3.913
  578    HA   ALA  76           HA       ALA  76  -0.513   7.254  -3.857
  579    HB1  ALA  76          1HB       ALA  76  -0.156   5.398  -5.419
  580    HB2  ALA  76          2HB       ALA  76  -0.297   6.948  -6.250
  581    HB3  ALA  76          3HB       ALA  76  -1.653   5.822  -6.249
  582    H    SER  77           H        SER  77  -3.840   7.010  -3.872
  583    HA   SER  77           HA       SER  77  -4.078   9.674  -5.101
  584    HB2  SER  77          2HB       SER  77  -5.322   7.830  -6.264
  585    HB3  SER  77          1HB       SER  77  -6.279   7.620  -4.800
  586    HG   SER  77           HG       SER  77  -6.236  10.218  -5.541
  587    H    ASP  78           H        ASP  78  -3.977   8.095  -2.200
  588    HA   ASP  78           HA       ASP  78  -5.628  10.159  -0.909
  589    HB2  ASP  78          2HB       ASP  78  -5.549   7.198  -0.427
  590    HB3  ASP  78          1HB       ASP  78  -5.982   8.299   0.883
  591    H    GLU  79           H        GLU  79  -4.135  11.502  -0.045
  592    HA   GLU  79           HA       GLU  79  -1.584  10.637   0.815
  593    HB2  GLU  79          2HB       GLU  79  -1.087  12.793   1.130
  594    HB3  GLU  79          1HB       GLU  79  -2.562  13.063   0.225
  595    HG2  GLU  79          2HG       GLU  79  -2.457  13.008   3.233
  596    HG3  GLU  79          1HG       GLU  79  -2.211  14.471   2.279
  597    H    GLN  80           H        GLN  80  -4.654  10.736   2.470
  598    HA   GLN  80           HA       GLN  80  -3.724  10.623   5.119
  599    HB2  GLN  80          2HB       GLN  80  -6.037   8.933   4.210
  600    HB3  GLN  80          1HB       GLN  80  -5.827   9.771   5.736
  601    HG2  GLN  80          2HG       GLN  80  -7.394  11.096   4.775
  602    HG3  GLN  80          1HG       GLN  80  -5.937  11.898   4.196
  603   HE21  GLN  80          1HE2      GLN  80  -7.110   8.825   2.978
  604   HE22  GLN  80          2HE2      GLN  80  -7.554   9.404   1.407
  605    H    TYR  81           H        TYR  81  -3.626   8.365   2.546
  606    HA   TYR  81           HA       TYR  81  -3.450   6.029   4.227
  607    HB2  TYR  81          2HB       TYR  81  -3.717   6.483   1.274
  608    HB3  TYR  81          1HB       TYR  81  -3.251   4.905   1.905
  609    HD1  TYR  81          1HD       TYR  81  -5.668   5.005   0.342
  610    HD2  TYR  81          2HD       TYR  81  -5.145   5.909   4.458
  611    HE1  TYR  81          1HE       TYR  81  -8.017   4.360   0.784
  612    HE2  TYR  81          2HE       TYR  81  -7.455   5.315   4.887
  613    HH   TYR  81           HH       TYR  81  -9.345   3.597   2.755
  614    H    VAL  82           H        VAL  82  -1.437   7.875   1.997
  615    HA   VAL  82           HA       VAL  82   0.756   6.196   2.057
  616    HB   VAL  82           HB       VAL  82   1.959   8.233   1.405
  617   HG11  VAL  82          1HG1      VAL  82   0.980   6.892  -0.323
  618   HG12  VAL  82          2HG1      VAL  82   0.785   8.596  -0.736
  619   HG13  VAL  82          3HG1      VAL  82  -0.573   7.686  -0.071
  620   HG21  VAL  82          1HG2      VAL  82   1.004   9.989   2.521
  621   HG22  VAL  82          2HG2      VAL  82  -0.607   9.557   1.952
  622   HG23  VAL  82          3HG2      VAL  82   0.573  10.236   0.828
  623    H    ARG  83           H        ARG  83   0.044   9.096   3.938
  624    HA   ARG  83           HA       ARG  83   2.141   8.698   5.769
  625    HB2  ARG  83          2HB       ARG  83   1.019  10.376   7.206
  626    HB3  ARG  83          1HB       ARG  83   1.376  10.919   5.583
  627    HG2  ARG  83          2HG       ARG  83  -1.013  10.338   5.015
  628    HG3  ARG  83          1HG       ARG  83  -1.286  10.158   6.751
  629    HD2  ARG  83          2HD       ARG  83  -0.930  12.516   5.069
  630    HD3  ARG  83          1HD       ARG  83  -1.848  12.327   6.559
  631    HE   ARG  83           HE       ARG  83   0.585  12.297   7.563
  632   HH11  ARG  83          1HH1      ARG  83  -0.731  14.398   5.088
  633   HH12  ARG  83          2HH1      ARG  83   0.364  15.697   5.432
  634   HH21  ARG  83          1HH2      ARG  83   2.017  14.002   8.020
  635   HH22  ARG  83          2HH2      ARG  83   1.928  15.470   7.098
  636    H    PHE  84           H        PHE  84  -1.108   7.430   5.642
  637    HA   PHE  84           HA       PHE  84  -1.375   6.722   8.349
  638    HB2  PHE  84          2HB       PHE  84  -2.874   6.162   6.138
  639    HB3  PHE  84          1HB       PHE  84  -2.133   4.586   6.441
  640    HD1  PHE  84          1HD       PHE  84  -3.092   3.144   7.941
  641    HD2  PHE  84          2HD       PHE  84  -4.000   7.293   8.191
  642    HE1  PHE  84          1HE       PHE  84  -4.761   2.672   9.684
  643    HE2  PHE  84          2HE       PHE  84  -5.668   6.823   9.939
  644    HZ   PHE  84           HZ       PHE  84  -6.049   4.512  10.685
  645    H    ILE  85           H        ILE  85   0.234   5.030   5.691
  646    HA   ILE  85           HA       ILE  85   1.269   2.999   7.449
  647    HB   ILE  85           HB       ILE  85   1.664   3.580   4.540
  648   HG12  ILE  85          2HG1      ILE  85   0.717   1.204   6.160
  649   HG13  ILE  85          1HG1      ILE  85  -0.274   2.262   5.163
  650   HG21  ILE  85          1HG2      ILE  85   3.333   1.752   6.249
  651   HG22  ILE  85          2HG2      ILE  85   3.884   3.100   5.257
  652   HG23  ILE  85          3HG2      ILE  85   3.251   1.642   4.493
  653   HD11  ILE  85          1HD1      ILE  85   1.865   0.392   4.134
  654   HD12  ILE  85          2HD1      ILE  85   0.804   1.420   3.159
  655   HD13  ILE  85          3HD1      ILE  85   0.125   0.099   4.110
  656    H    ALA  86           H        ALA  86   2.703   5.748   5.694
  657    HA   ALA  86           HA       ALA  86   5.301   5.644   6.518
  658    HB1  ALA  86          1HB       ALA  86   5.442   7.985   6.132
  659    HB2  ALA  86          2HB       ALA  86   3.731   8.206   6.470
  660    HB3  ALA  86          3HB       ALA  86   4.233   7.356   5.010
  661    H    GLN  87           H        GLN  87   2.549   6.787   8.393
  662    HA   GLN  87           HA       GLN  87   4.093   7.734  10.579
  663    HB2  GLN  87          2HB       GLN  87   1.839   8.567  10.179
  664    HB3  GLN  87          1HB       GLN  87   1.177   6.955  10.397
  665    HG2  GLN  87          2HG       GLN  87   1.982   7.000  12.742
  666    HG3  GLN  87          1HG       GLN  87   2.483   8.671  12.493
  667   HE21  GLN  87          1HE2      GLN  87   1.069   9.414  14.077
  668   HE22  GLN  87          2HE2      GLN  87  -0.639   9.482  13.827
  669    H    HIS  88           H        HIS  88   2.316   4.761   9.869
  670    HA   HIS  88           HA       HIS  88   2.768   3.531  12.390
  671    HB2  HIS  88          2HB       HIS  88   2.011   2.371   9.706
  672    HB3  HIS  88          1HB       HIS  88   2.138   1.404  11.170
  673    HD1  HIS  88          1HD       HIS  88   0.772   3.751  12.953
  674    HD2  HIS  88          2HD       HIS  88  -0.752   1.943   9.527
  675    HE1  HIS  88          1HE       HIS  88  -1.709   4.085  13.059
  676    HE2  HIS  88          2HE       HIS  88  -2.614   2.747  11.134
  677    H    PHE  89           H        PHE  89   4.543   3.539   9.357
  678    HA   PHE  89           HA       PHE  89   6.751   2.153  10.673
  679    HB2  PHE  89          2HB       PHE  89   5.296   0.472   9.500
  680    HB3  PHE  89          1HB       PHE  89   5.673   1.288   7.990
  681    HD1  PHE  89          1HD       PHE  89   7.295   0.328   6.703
  682    HD2  PHE  89          2HD       PHE  89   7.515  -0.087  10.932
  683    HE1  PHE  89          1HE       PHE  89   9.271  -1.116   6.452
  684    HE2  PHE  89          2HE       PHE  89   9.510  -1.504  10.694
  685    HZ   PHE  89           HZ       PHE  89  10.392  -2.022   8.452
  686    HA   PRO  90           HA       PRO  90   8.851   5.501   8.450
  687    HB2  PRO  90          2HB       PRO  90  11.344   4.628   9.283
  688    HB3  PRO  90          1HB       PRO  90  10.321   5.764  10.165
  689    HG2  PRO  90          2HG       PRO  90  10.684   2.831  10.566
  690    HG3  PRO  90          1HG       PRO  90  10.501   4.115  11.774
  691    HD2  PRO  90          2HD       PRO  90   8.479   2.479  11.150
  692    HD3  PRO  90          1HD       PRO  90   8.195   4.194  11.524
  693    H    CYS  91           H        CYS  91  10.497   5.581   6.779
  694    HA   CYS  91           HA       CYS  91  10.005   3.499   4.887
  695    HB2  CYS  91          2HB       CYS  91  11.401   4.911   3.382
  696    HB3  CYS  91          1HB       CYS  91  10.144   5.848   4.205
  697    HG   CYS  91           HG       CYS  91  13.386   5.720   5.298
  698    H    ALA  92           H        ALA  92  10.930   1.660   4.993
  699    HA   ALA  92           HA       ALA  92  13.847   1.576   5.327
  700    HB1  ALA  92          1HB       ALA  92  11.978  -0.460   6.522
  701    HB2  ALA  92          2HB       ALA  92  12.786   0.829   7.420
  702    HB3  ALA  92          3HB       ALA  92  13.744  -0.431   6.629
  703    HA   PRO  93           HA       PRO  93  13.657  -1.022   1.733
  704    HB2  PRO  93          2HB       PRO  93  16.197  -1.735   1.608
  705    HB3  PRO  93          1HB       PRO  93  15.771  -0.025   1.484
  706    HG2  PRO  93          2HG       PRO  93  16.715  -1.557   3.886
  707    HG3  PRO  93          1HG       PRO  93  17.318  -0.008   3.260
  708    HD2  PRO  93          2HD       PRO  93  15.489  -0.219   5.298
  709    HD3  PRO  93          1HD       PRO  93  15.573   1.172   4.190
  710    H    GLU  94           H        GLU  94  13.355  -3.170   1.256
  711    HA   GLU  94           HA       GLU  94  13.769  -5.096   3.414
  712    HB2  GLU  94          2HB       GLU  94  11.584  -5.121   2.275
  713    HB3  GLU  94          1HB       GLU  94  12.388  -5.464   0.748
  714    HG2  GLU  94          2HG       GLU  94  13.149  -7.591   1.568
  715    HG3  GLU  94          1HG       GLU  94  12.509  -7.242   3.172
  716    H    GLU  95           H        GLU  95  15.960  -5.338   3.398
  717    HA   GLU  95           HA       GLU  95  17.350  -5.894   0.929
  718    HB2  GLU  95          2HB       GLU  95  18.380  -5.873   3.767
  719    HB3  GLU  95          1HB       GLU  95  19.365  -5.882   2.309
  720    HG2  GLU  95          2HG       GLU  95  18.271  -3.693   1.725
  721    HG3  GLU  95          1HG       GLU  95  17.580  -3.724   3.346
  722    H    GLU  96           H        GLU  96  15.681  -7.817   0.897
  723    HA   GLU  96           HA       GLU  96  16.612 -10.171   2.289
  724    HB2  GLU  96          2HB       GLU  96  14.225  -9.920   1.706
  725    HB3  GLU  96          1HB       GLU  96  14.646  -9.910  -0.001
  726    HG2  GLU  96          2HG       GLU  96  15.571 -12.192   0.264
  727    HG3  GLU  96          1HG       GLU  96  14.996 -12.190   1.930
  728    H    LYS  97           H        LYS  97  16.169  -9.573  -1.178
  729    HA   LYS  97           HA       LYS  97  18.921 -10.403  -1.641
  730    HB2  LYS  97          2HB       LYS  97  16.507 -11.670  -2.906
  731    HB3  LYS  97          1HB       LYS  97  18.060 -11.671  -3.717
  732    HG2  LYS  97          2HG       LYS  97  17.537 -12.816  -0.985
  733    HG3  LYS  97          1HG       LYS  97  17.599 -13.746  -2.480
  734    HD2  LYS  97          2HD       LYS  97  19.903 -12.048  -1.550
  735    HD3  LYS  97          1HD       LYS  97  19.698 -13.716  -1.030
  736    HE2  LYS  97          2HE       LYS  97  21.189 -13.785  -2.855
  737    HE3  LYS  97          1HE       LYS  97  19.642 -14.343  -3.477
  738    HZ1  LYS  97          1HZ       LYS  97  20.887 -12.750  -4.921
  739    HZ2  LYS  97          2HZ       LYS  97  20.587 -11.549  -3.770
  740    HZ3  LYS  97          3HZ       LYS  97  19.298 -12.295  -4.572
  741    HA   PRO  98           HA       PRO  98  17.705  -7.346  -4.955
  742    HB2  PRO  98          2HB       PRO  98  15.179  -7.067  -5.818
  743    HB3  PRO  98          1HB       PRO  98  16.154  -8.474  -6.254
  744    HG2  PRO  98          2HG       PRO  98  13.838  -8.309  -4.467
  745    HG3  PRO  98          1HG       PRO  98  14.582  -9.735  -5.207
  746    HD2  PRO  98          2HD       PRO  98  14.976  -8.626  -2.527
  747    HD3  PRO  98          1HD       PRO  98  15.455 -10.209  -3.164
  748    HA   PRO  99           HA       PRO  99  16.032  -4.247  -1.925
  749    HB2  PRO  99          2HB       PRO  99  18.625  -3.148  -1.579
  750    HB3  PRO  99          1HB       PRO  99  17.697  -4.072  -0.399
  751    HG2  PRO  99          2HG       PRO  99  20.060  -4.917  -1.589
  752    HG3  PRO  99          1HG       PRO  99  18.876  -5.974  -0.802
  753    HD2  PRO  99          2HD       PRO  99  19.283  -5.414  -3.707
  754    HD3  PRO  99          1HD       PRO  99  18.820  -6.928  -2.902
  755    H    GLU 100           H        GLU 100  15.160  -3.501  -3.928
  756    HA   GLU 100           HA       GLU 100  16.764  -2.133  -5.851
  757    HB2  GLU 100          2HB       GLU 100  14.646  -3.415  -6.332
  758    HB3  GLU 100          1HB       GLU 100  13.761  -2.095  -5.587
  759    HG2  GLU 100          2HG       GLU 100  14.748  -0.567  -7.243
  760    HG3  GLU 100          1HG       GLU 100  15.446  -1.966  -8.059
  761    H    ILE 101           H        ILE 101  13.903  -0.917  -4.174
  762    HA   ILE 101           HA       ILE 101  15.235   1.472  -3.269
  763    HB   ILE 101           HB       ILE 101  13.513   2.974  -4.398
  764   HG12  ILE 101          2HG1      ILE 101  13.268   0.580  -6.234
  765   HG13  ILE 101          1HG1      ILE 101  12.004   1.234  -5.208
  766   HG21  ILE 101          1HG2      ILE 101  14.845   3.248  -6.427
  767   HG22  ILE 101          2HG2      ILE 101  15.608   1.683  -6.135
  768   HG23  ILE 101          3HG2      ILE 101  15.863   3.014  -5.006
  769   HD11  ILE 101          1HD1      ILE 101  11.701   1.870  -7.496
  770   HD12  ILE 101          2HD1      ILE 101  13.274   2.669  -7.498
  771   HD13  ILE 101          3HD1      ILE 101  11.975   3.264  -6.464
  772    H    ASP 102           H        ASP 102  12.401  -0.487  -3.654
  773    HA   ASP 102           HA       ASP 102  10.833  -1.166  -2.190
  774    HB2  ASP 102          2HB       ASP 102  12.387   0.553  -0.283
  775    HB3  ASP 102          1HB       ASP 102  10.880  -0.203   0.190
  776    H    ALA 103           H        ALA 103  11.164   1.764  -3.455
  777    HA   ALA 103           HA       ALA 103   8.628   2.813  -2.441
  778    HB1  ALA 103          1HB       ALA 103   9.200   4.762  -3.988
  779    HB2  ALA 103          2HB       ALA 103  10.781   3.993  -4.181
  780    HB3  ALA 103          3HB       ALA 103  10.247   4.523  -2.584
  781    H    LEU 104           H        LEU 104  10.203   2.104  -5.530
  782    HA   LEU 104           HA       LEU 104   7.561   1.483  -6.671
  783    HB2  LEU 104          2HB       LEU 104   9.834   2.505  -8.348
  784    HB3  LEU 104          1HB       LEU 104   8.124   2.495  -8.714
  785    HG   LEU 104           HG       LEU 104   9.514   4.336  -6.764
  786   HD11  LEU 104          1HD1      LEU 104   9.984   4.871  -9.082
  787   HD12  LEU 104          2HD1      LEU 104   8.916   6.082  -8.367
  788   HD13  LEU 104          3HD1      LEU 104   8.260   4.856  -9.454
  789   HD21  LEU 104          1HD2      LEU 104   7.299   5.507  -6.727
  790   HD22  LEU 104          2HD2      LEU 104   7.337   3.949  -5.906
  791   HD23  LEU 104          3HD2      LEU 104   6.605   4.082  -7.508
  792    H    GLU 105           H        GLU 105   9.415  -0.285  -5.360
  793    HA   GLU 105           HA       GLU 105  11.202  -1.492  -7.183
  794    HB2  GLU 105          2HB       GLU 105  11.403  -3.292  -5.473
  795    HB3  GLU 105          1HB       GLU 105  11.685  -1.676  -4.860
  796    HG2  GLU 105          2HG       GLU 105  10.439  -2.736  -3.205
  797    HG3  GLU 105          1HG       GLU 105   9.279  -1.725  -4.056
  798    H    LEU 106           H        LEU 106  11.182  -3.530  -8.125
  799    HA   LEU 106           HA       LEU 106  10.305  -5.207  -9.387
  800    HB2  LEU 106          2HB       LEU 106   9.735  -5.742  -6.832
  801    HB3  LEU 106          1HB       LEU 106   8.098  -5.599  -7.426
  802    HG   LEU 106           HG       LEU 106   8.803  -7.921  -7.373
  803   HD11  LEU 106          1HD1      LEU 106   8.268  -8.564  -9.649
  804   HD12  LEU 106          2HD1      LEU 106   8.578  -6.919 -10.203
  805   HD13  LEU 106          3HD1      LEU 106   7.231  -7.244  -9.112
  806   HD21  LEU 106          1HD2      LEU 106  10.597  -8.753  -8.774
  807   HD22  LEU 106          2HD2      LEU 106  11.207  -7.551  -7.638
  808   HD23  LEU 106          3HD2      LEU 106  10.948  -7.117  -9.327
  809    H    LYS 107           H        LYS 107   9.643  -3.127 -10.632
  810    HA   LYS 107           HA       LYS 107   6.835  -2.582 -10.759
  811    HB2  LYS 107          2HB       LYS 107   8.637  -0.913 -11.277
  812    HB3  LYS 107          1HB       LYS 107   8.981  -1.815 -12.744
  813    HG2  LYS 107          2HG       LYS 107   7.602   0.123 -13.211
  814    HG3  LYS 107          1HG       LYS 107   6.723  -1.369 -13.552
  815    HD2  LYS 107          2HD       LYS 107   5.479  -1.176 -11.511
  816    HD3  LYS 107          1HD       LYS 107   6.472   0.183 -10.978
  817    HE2  LYS 107          2HE       LYS 107   4.273   0.890 -11.837
  818    HE3  LYS 107          1HE       LYS 107   5.613   1.560 -12.764
  819    HZ1  LYS 107          1HZ       LYS 107   5.252  -0.100 -14.458
  820    HZ2  LYS 107          2HZ       LYS 107   3.820   0.752 -14.181
  821    HZ3  LYS 107          3HZ       LYS 107   4.009  -0.805 -13.556
  822    H    THR 108           H        THR 108   9.147  -4.480 -12.612
  823    HA   THR 108           HA       THR 108   7.076  -6.156 -13.639
  824    HB   THR 108           HB       THR 108   6.788  -4.299 -15.196
  825    HG1  THR 108          1HG       THR 108   6.362  -6.067 -16.329
  826   HG21  THR 108          1HG2      THR 108   9.026  -3.332 -15.095
  827   HG22  THR 108          2HG2      THR 108   8.566  -3.668 -16.764
  828   HG23  THR 108          3HG2      THR 108   9.685  -4.743 -15.923
  829    H    GLN 109           H        GLN 109  10.391  -5.315 -13.248
  830    HA   GLN 109           HA       GLN 109  11.414  -7.540 -14.772
  831    HB2  GLN 109          2HB       GLN 109  12.775  -5.571 -12.931
  832    HB3  GLN 109          1HB       GLN 109  13.616  -6.797 -13.869
  833    HG2  GLN 109          2HG       GLN 109  12.899  -5.797 -15.927
  834    HG3  GLN 109          1HG       GLN 109  11.879  -4.649 -15.062
  835   HE21  GLN 109          1HE2      GLN 109  13.828  -4.154 -12.983
  836   HE22  GLN 109          2HE2      GLN 109  15.075  -3.194 -13.698
  837    H    LYS 110           H        LYS 110  13.011  -9.044 -13.673
  838    HA   LYS 110           HA       LYS 110  11.500 -10.338 -11.539
  839    HB2  LYS 110          2HB       LYS 110  13.738 -11.321 -13.317
  840    HB3  LYS 110          1HB       LYS 110  13.016 -12.287 -12.043
  841    HG2  LYS 110          2HG       LYS 110  12.031 -12.977 -14.079
  842    HG3  LYS 110          1HG       LYS 110  10.815 -12.036 -13.221
  843    HD2  LYS 110          2HD       LYS 110  10.802 -11.446 -15.565
  844    HD3  LYS 110          1HD       LYS 110  11.382 -10.080 -14.616
  845    HE2  LYS 110          2HE       LYS 110  12.725 -10.335 -16.615
  846    HE3  LYS 110          1HE       LYS 110  13.697 -10.690 -15.190
  847    HZ1  LYS 110          1HZ       LYS 110  14.078 -12.284 -16.968
  848    HZ2  LYS 110          2HZ       LYS 110  12.444 -12.712 -16.966
  849    HZ3  LYS 110          3HZ       LYS 110  13.405 -13.043 -15.616
  850    H    GLY 111           H        GLY 111  12.795  -8.137 -10.565
  851    HA2  GLY 111          2HA       GLY 111  14.143  -7.600  -8.749
  852    HA3  GLY 111          1HA       GLY 111  14.706  -9.268  -8.712
  853    H    PHE 112           H        PHE 112  14.948  -8.355 -11.796
  854    HA   PHE 112           HA       PHE 112  17.631  -7.211 -11.550
  855    HB2  PHE 112          2HB       PHE 112  16.817  -9.478 -13.384
  856    HB3  PHE 112          1HB       PHE 112  18.386  -8.681 -13.390
  857    HD1  PHE 112          1HD       PHE 112  16.631 -11.455 -12.242
  858    HD2  PHE 112          2HD       PHE 112  19.562  -8.628 -11.005
  859    HE1  PHE 112          1HE       PHE 112  17.428 -13.034 -10.533
  860    HE2  PHE 112          2HE       PHE 112  20.363 -10.203  -9.295
  861    HZ   PHE 112           HZ       PHE 112  19.298 -12.408  -9.058
  Start of MODEL   17
    1    H1   GLY   1          1HT       GLY   1 -11.218  -0.758  -9.969
    2    H2   GLY   1          2HT       GLY   1 -11.991  -0.983 -11.455
    3    H    GLY   1           H        GLY   1 -11.257  -0.949 -10.933
    4    H3   GLY   1          3HT       GLY   1 -12.886  -1.034 -10.022
    5    HA2  GLY   1          1HA       GLY   1 -13.266   1.056 -11.107
    6    HA3  GLY   1          2HA       GLY   1 -12.382   1.304  -9.606
    7    H    SER   2           H        SER   2 -11.809   3.363 -10.683
    8    HA   SER   2           HA       SER   2 -10.046   3.234 -12.962
    9    HB2  SER   2          2HB       SER   2 -10.649   5.615 -11.194
   10    HB3  SER   2          1HB       SER   2 -10.039   5.638 -12.848
   11    HG   SER   2           HG       SER   2 -12.222   4.267 -13.016
   12    H    ALA   3           H        ALA   3  -7.942   2.804 -12.805
   13    HA   ALA   3           HA       ALA   3  -6.642   2.743 -10.233
   14    HB1  ALA   3          1HB       ALA   3  -6.232   0.991 -11.899
   15    HB2  ALA   3          2HB       ALA   3  -4.742   1.812 -11.436
   16    HB3  ALA   3          3HB       ALA   3  -5.514   2.190 -12.975
   17    H    MET   4           H        MET   4  -6.740   4.970  -9.704
   18    HA   MET   4           HA       MET   4  -5.158   6.802 -11.333
   19    HB2  MET   4          2HB       MET   4  -6.877   7.296  -8.893
   20    HB3  MET   4          1HB       MET   4  -6.032   8.544  -9.796
   21    HG2  MET   4          2HG       MET   4  -7.360   8.065 -11.761
   22    HG3  MET   4          1HG       MET   4  -8.165   6.742 -10.919
   23    HE1  MET   4          1HE       MET   4  -8.654  11.194  -9.794
   24    HE2  MET   4          2HE       MET   4  -7.645  10.621 -11.121
   25    HE3  MET   4          3HE       MET   4  -7.186  10.280  -9.454
   26    H    GLY   5           H        GLY   5  -3.760   8.368 -10.052
   27    HA2  GLY   5          2HA       GLY   5  -2.638   7.757  -7.579
   28    HA3  GLY   5          1HA       GLY   5  -1.695   6.906  -8.798
   29    H    HIS   6           H        HIS   6  -1.291   9.353  -6.960
   30    HA   HIS   6           HA       HIS   6   0.197  10.855  -8.944
   31    HB2  HIS   6          2HB       HIS   6  -0.735  13.029  -8.281
   32    HB3  HIS   6          1HB       HIS   6  -1.970  11.994  -8.981
   33    HD1  HIS   6          1HD       HIS   6  -3.853  11.161  -7.405
   34    HD2  HIS   6          2HD       HIS   6  -1.135  13.741  -5.614
   35    HE1  HIS   6          1HE       HIS   6  -4.914  11.863  -5.237
   36    HE2  HIS   6          2HE       HIS   6  -3.355  13.601  -4.299
   37    H    MET   7           H        MET   7   1.930  11.986  -8.072
   38    HA   MET   7           HA       MET   7   2.806  10.978  -5.525
   39    HB2  MET   7          2HB       MET   7   4.154  13.020  -7.301
   40    HB3  MET   7          1HB       MET   7   4.902  12.083  -6.014
   41    HG2  MET   7          2HG       MET   7   3.812  11.030  -8.613
   42    HG3  MET   7          1HG       MET   7   5.507  11.165  -8.154
   43    HE1  MET   7          1HE       MET   7   5.909   8.435  -5.428
   44    HE2  MET   7          2HE       MET   7   5.647  10.165  -5.210
   45    HE3  MET   7          3HE       MET   7   6.732   9.591  -6.475
   46    H    VAL   8           H        VAL   8   2.251  11.862  -3.665
   47    HA   VAL   8           HA       VAL   8   1.738  14.733  -3.546
   48    HB   VAL   8           HB       VAL   8  -0.424  13.803  -3.724
   49   HG11  VAL   8          1HG1      VAL   8  -1.276  12.058  -2.162
   50   HG12  VAL   8          2HG1      VAL   8   0.386  11.795  -1.636
   51   HG13  VAL   8          3HG1      VAL   8  -0.064  11.501  -3.313
   52   HG21  VAL   8          1HG2      VAL   8   0.154  14.440  -0.842
   53   HG22  VAL   8          2HG2      VAL   8  -1.464  14.312  -1.530
   54   HG23  VAL   8          3HG2      VAL   8  -0.355  15.555  -2.109
   55    H    LYS   9           H        LYS   9   1.050  12.927  -0.795
   56    HA   LYS   9           HA       LYS   9   3.464  13.769   0.534
   57    HB2  LYS   9          2HB       LYS   9   1.145  12.072   1.514
   58    HB3  LYS   9          1HB       LYS   9   2.508  12.576   2.508
   59    HG2  LYS   9          2HG       LYS   9   0.494  14.377   1.199
   60    HG3  LYS   9          1HG       LYS   9   0.575  13.973   2.909
   61    HD2  LYS   9          2HD       LYS   9   1.724  15.910   3.051
   62    HD3  LYS   9          1HD       LYS   9   3.076  14.913   2.517
   63    HE2  LYS   9          2HE       LYS   9   2.656  15.574   0.201
   64    HE3  LYS   9          1HE       LYS   9   1.283  16.548   0.721
   65    HZ1  LYS   9          1HZ       LYS   9   3.214  17.926   0.389
   66    HZ2  LYS   9          2HZ       LYS   9   4.122  16.992   1.461
   67    HZ3  LYS   9          3HZ       LYS   9   2.820  17.904   2.033
   68    H    ILE  10           H        ILE  10   3.946  12.144  -1.670
   69    HA   ILE  10           HA       ILE  10   4.987   9.725  -0.411
   70    HB   ILE  10           HB       ILE  10   4.190   9.953  -3.315
   71   HG12  ILE  10          2HG1      ILE  10   2.673   8.439  -1.199
   72   HG13  ILE  10          1HG1      ILE  10   2.235  10.083  -1.652
   73   HG21  ILE  10          1HG2      ILE  10   5.868   8.282  -2.927
   74   HG22  ILE  10          2HG2      ILE  10   4.326   7.464  -3.185
   75   HG23  ILE  10          3HG2      ILE  10   4.973   7.639  -1.552
   76   HD11  ILE  10          1HD1      ILE  10   0.851   8.498  -2.819
   77   HD12  ILE  10          2HD1      ILE  10   2.273   7.672  -3.453
   78   HD13  ILE  10          3HD1      ILE  10   1.906   9.318  -3.969
   79    H    SER  11           H        SER  11   7.035  10.522  -0.041
   80    HA   SER  11           HA       SER  11   8.592  11.373  -2.376
   81    HB2  SER  11          2HB       SER  11   8.752  12.642  -0.191
   82    HB3  SER  11          1HB       SER  11   9.457  11.194   0.528
   83    HG   SER  11           HG       SER  11  10.874  12.962  -0.415
   84    H    HIS  12           H        HIS  12  11.063  10.281  -1.871
   85    HA   HIS  12           HA       HIS  12  10.837   7.672  -2.829
   86    HB2  HIS  12          2HB       HIS  12  13.092   8.810  -1.172
   87    HB3  HIS  12          1HB       HIS  12  13.177   7.352  -2.158
   88    HD1  HIS  12          1HD       HIS  12  14.429  10.561  -2.331
   89    HD2  HIS  12          2HD       HIS  12  12.213   8.277  -5.007
   90    HE1  HIS  12          1HE       HIS  12  14.876  11.547  -4.600
   91    HE2  HIS  12          2HE       HIS  12  13.435  10.228  -6.185
   92    H    GLU  13           H        GLU  13  11.371   8.857   0.435
   93    HA   GLU  13           HA       GLU  13  11.472   6.317   1.650
   94    HB2  GLU  13          2HB       GLU  13  11.245   7.584   3.767
   95    HB3  GLU  13          1HB       GLU  13  12.493   8.219   2.696
   96    HG2  GLU  13          2HG       GLU  13  11.031  10.014   2.000
   97    HG3  GLU  13          1HG       GLU  13   9.726   9.366   2.993
   98    H    ASP  14           H        ASP  14   8.779   8.554   0.992
   99    HA   ASP  14           HA       ASP  14   6.982   7.134   2.705
  100    HB2  ASP  14          2HB       ASP  14   6.348   9.023   0.452
  101    HB3  ASP  14          1HB       ASP  14   5.239   8.499   1.716
  102    H    THR  15           H        THR  15   7.758   7.070  -0.733
  103    HA   THR  15           HA       THR  15   5.627   5.375  -1.487
  104    HB   THR  15           HB       THR  15   8.222   5.117  -2.921
  105    HG1  THR  15          1HG       THR  15   7.655   7.470  -2.324
  106   HG21  THR  15          1HG2      THR  15   6.227   3.932  -3.684
  107   HG22  THR  15          2HG2      THR  15   6.727   5.144  -4.866
  108   HG23  THR  15          3HG2      THR  15   5.356   5.463  -3.801
  109    H    GLN  16           H        GLN  16   8.923   4.770  -0.338
  110    HA   GLN  16           HA       GLN  16   8.874   1.967  -0.592
  111    HB2  GLN  16          2HB       GLN  16  10.353   3.732   1.379
  112    HB3  GLN  16          1HB       GLN  16  10.635   2.006   1.169
  113    HG2  GLN  16          2HG       GLN  16  11.335   2.383  -1.133
  114    HG3  GLN  16          1HG       GLN  16  11.053   4.114  -0.936
  115   HE21  GLN  16          1HE2      GLN  16  12.470   5.325   0.291
  116   HE22  GLN  16          2HE2      GLN  16  14.003   4.724   0.823
  117    H    ARG  17           H        ARG  17   7.872   4.202   1.925
  118    HA   ARG  17           HA       ARG  17   7.329   2.455   3.980
  119    HB2  ARG  17          2HB       ARG  17   6.330   5.133   3.182
  120    HB3  ARG  17          1HB       ARG  17   5.422   4.269   4.412
  121    HG2  ARG  17          2HG       ARG  17   7.039   4.491   5.965
  122    HG3  ARG  17          1HG       ARG  17   8.340   4.386   4.782
  123    HD2  ARG  17          2HD       ARG  17   8.230   6.623   4.253
  124    HD3  ARG  17          1HD       ARG  17   6.556   6.775   4.797
  125    HE   ARG  17           HE       ARG  17   8.033   6.177   7.045
  126   HH11  ARG  17          1HH1      ARG  17   7.883   8.768   4.692
  127   HH12  ARG  17          2HH1      ARG  17   8.511   9.960   5.782
  128   HH21  ARG  17          1HH2      ARG  17   8.801   7.783   8.503
  129   HH22  ARG  17          2HH2      ARG  17   9.032   9.404   7.934
  130    H    ILE  18           H        ILE  18   5.035   3.640   1.496
  131    HA   ILE  18           HA       ILE  18   2.835   2.208   2.419
  132    HB   ILE  18           HB       ILE  18   3.455   2.900  -0.449
  133   HG12  ILE  18          2HG1      ILE  18   1.485   4.524   0.945
  134   HG13  ILE  18          1HG1      ILE  18   3.063   4.602   1.725
  135   HG21  ILE  18          1HG2      ILE  18   1.734   1.268  -0.378
  136   HG22  ILE  18          2HG2      ILE  18   0.945   2.828  -0.630
  137   HG23  ILE  18          3HG2      ILE  18   0.931   2.075   0.972
  138   HD11  ILE  18          1HD1      ILE  18   2.532   5.145  -1.182
  139   HD12  ILE  18          2HD1      ILE  18   4.082   5.278  -0.346
  140   HD13  ILE  18          3HD1      ILE  18   2.758   6.366   0.072
  141    H    LYS  19           H        LYS  19   5.285   1.262   0.011
  142    HA   LYS  19           HA       LYS  19   4.211  -1.269  -0.570
  143    HB2  LYS  19          2HB       LYS  19   6.758   0.108  -0.960
  144    HB3  LYS  19          1HB       LYS  19   6.928  -1.634  -0.752
  145    HG2  LYS  19          2HG       LYS  19   5.272  -1.951  -2.574
  146    HG3  LYS  19          1HG       LYS  19   5.251  -0.200  -2.811
  147    HD2  LYS  19          2HD       LYS  19   7.632  -0.234  -3.322
  148    HD3  LYS  19          1HD       LYS  19   7.689  -1.970  -3.031
  149    HE2  LYS  19          2HE       LYS  19   6.048  -2.258  -4.881
  150    HE3  LYS  19          1HE       LYS  19   6.188  -0.529  -5.204
  151    HZ1  LYS  19          1HZ       LYS  19   8.407  -2.500  -5.330
  152    HZ2  LYS  19          2HZ       LYS  19   8.552  -0.843  -5.636
  153    HZ3  LYS  19          3HZ       LYS  19   7.621  -1.815  -6.661
  154    H    THR  20           H        THR  20   6.871  -0.412   1.615
  155    HA   THR  20           HA       THR  20   7.407  -3.057   2.288
  156    HB   THR  20           HB       THR  20   9.085  -1.279   2.529
  157    HG1  THR  20          1HG       THR  20   8.423  -3.045   4.585
  158   HG21  THR  20          1HG2      THR  20   7.662   0.496   3.406
  159   HG22  THR  20          2HG2      THR  20   9.019   0.207   4.496
  160   HG23  THR  20          3HG2      THR  20   7.417  -0.411   4.896
  161    H    ALA  21           H        ALA  21   5.319  -0.665   3.833
  162    HA   ALA  21           HA       ALA  21   5.016  -2.241   6.180
  163    HB1  ALA  21          1HB       ALA  21   4.630   0.153   6.251
  164    HB2  ALA  21          2HB       ALA  21   3.164  -0.711   6.716
  165    HB3  ALA  21          3HB       ALA  21   3.301  -0.011   5.100
  166    H    PHE  22           H        PHE  22   2.766  -1.470   3.549
  167    HA   PHE  22           HA       PHE  22   0.675  -3.129   4.075
  168    HB2  PHE  22          2HB       PHE  22   0.387  -1.782   2.284
  169    HB3  PHE  22          1HB       PHE  22   2.019  -1.996   1.695
  170    HD1  PHE  22          1HD       PHE  22  -1.248  -3.716   1.880
  171    HD2  PHE  22          2HD       PHE  22   2.381  -3.193  -0.219
  172    HE1  PHE  22          1HE       PHE  22  -2.186  -5.010  -0.028
  173    HE2  PHE  22          2HE       PHE  22   1.503  -4.514  -2.088
  174    HZ   PHE  22           HZ       PHE  22  -0.781  -5.416  -1.997
  175    H    LEU  23           H        LEU  23   3.468  -4.169   2.061
  176    HA   LEU  23           HA       LEU  23   2.559  -6.817   1.749
  177    HB2  LEU  23          2HB       LEU  23   5.415  -5.846   1.697
  178    HB3  LEU  23          1HB       LEU  23   4.766  -7.265   0.893
  179    HG   LEU  23           HG       LEU  23   3.725  -4.534   0.232
  180   HD11  LEU  23          1HD1      LEU  23   6.143  -5.893  -0.972
  181   HD12  LEU  23          2HD1      LEU  23   6.151  -4.414  -0.007
  182   HD13  LEU  23          3HD1      LEU  23   5.370  -4.433  -1.590
  183   HD21  LEU  23          1HD2      LEU  23   2.414  -6.323  -0.601
  184   HD22  LEU  23          2HD2      LEU  23   3.843  -7.190  -1.175
  185   HD23  LEU  23          3HD2      LEU  23   3.350  -5.688  -1.957
  186    H    SER  24           H        SER  24   5.171  -5.558   3.857
  187    HA   SER  24           HA       SER  24   5.836  -8.050   4.970
  188    HB2  SER  24          2HB       SER  24   7.468  -6.427   4.984
  189    HB3  SER  24          1HB       SER  24   6.445  -5.238   5.784
  190    HG   SER  24           HG       SER  24   8.050  -7.163   6.844
  191    H    TYR  25           H        TYR  25   3.461  -5.697   5.812
  192    HA   TYR  25           HA       TYR  25   3.184  -6.418   8.537
  193    HB2  TYR  25          2HB       TYR  25   1.573  -4.747   6.618
  194    HB3  TYR  25          1HB       TYR  25   0.829  -5.285   8.139
  195    HD1  TYR  25          1HD       TYR  25   4.371  -4.317   7.525
  196    HD2  TYR  25          2HD       TYR  25   0.710  -3.343   9.454
  197    HE1  TYR  25          1HE       TYR  25   5.506  -2.522   8.737
  198    HE2  TYR  25          2HE       TYR  25   1.837  -1.536  10.684
  199    HH   TYR  25           HH       TYR  25   4.091  -0.921  11.396
  200    H    ALA  26           H        ALA  26   1.275  -7.232   5.625
  201    HA   ALA  26           HA       ALA  26  -0.472  -8.875   7.184
  202    HB1  ALA  26          1HB       ALA  26  -1.504  -9.466   5.135
  203    HB2  ALA  26          2HB       ALA  26  -0.092  -8.959   4.207
  204    HB3  ALA  26          3HB       ALA  26  -1.076  -7.759   5.046
  205    H    GLN  27           H        GLN  27   1.609  -9.927   4.450
  206    HA   GLN  27           HA       GLN  27   2.062 -12.388   6.001
  207    HB2  GLN  27          2HB       GLN  27   2.371 -12.515   3.065
  208    HB3  GLN  27          1HB       GLN  27   1.804 -13.747   4.190
  209    HG2  GLN  27          2HG       GLN  27  -0.114 -13.309   3.024
  210    HG3  GLN  27          1HG       GLN  27  -0.304 -12.152   4.349
  211   HE21  GLN  27          1HE2      GLN  27  -1.318 -12.076   1.582
  212   HE22  GLN  27          2HE2      GLN  27  -0.715 -10.588   0.929
  213    H    GLY  28           H        GLY  28   3.458  -9.840   4.141
  214    HA2  GLY  28          2HA       GLY  28   5.802  -9.504   3.849
  215    HA3  GLY  28          1HA       GLY  28   6.056 -11.218   4.129
  216    H    GLN  29           H        GLN  29   3.562 -11.589   2.236
  217    HA   GLN  29           HA       GLN  29   5.118 -12.041  -0.124
  218    HB2  GLN  29          2HB       GLN  29   2.116 -12.096   0.098
  219    HB3  GLN  29          1HB       GLN  29   3.120 -12.927  -1.080
  220    HG2  GLN  29          2HG       GLN  29   4.088 -14.260   0.759
  221    HG3  GLN  29          1HG       GLN  29   2.949 -13.484   1.858
  222   HE21  GLN  29          1HE2      GLN  29   0.695 -13.871   1.536
  223   HE22  GLN  29          2HE2      GLN  29   0.159 -15.315   0.757
  224    H    ASP  30           H        ASP  30   3.398 -11.461  -2.204
  225    HA   ASP  30           HA       ASP  30   3.971  -8.674  -2.672
  226    HB2  ASP  30          2HB       ASP  30   2.581 -10.739  -4.388
  227    HB3  ASP  30          1HB       ASP  30   2.975  -9.108  -4.915
  228    H    LYS  31           H        LYS  31   1.477 -10.209  -1.148
  229    HA   LYS  31           HA       LYS  31  -0.444  -8.157  -1.967
  230    HB2  LYS  31          2HB       LYS  31  -1.010 -11.056  -1.309
  231    HB3  LYS  31          1HB       LYS  31  -2.251  -9.823  -1.470
  232    HG2  LYS  31          2HG       LYS  31  -1.020  -9.515  -3.825
  233    HG3  LYS  31          1HG       LYS  31  -0.692 -11.215  -3.545
  234    HD2  LYS  31          2HD       LYS  31  -3.406  -9.894  -3.523
  235    HD3  LYS  31          1HD       LYS  31  -2.777 -10.952  -4.793
  236    HE2  LYS  31          2HE       LYS  31  -3.504 -11.598  -1.975
  237    HE3  LYS  31          1HE       LYS  31  -4.278 -12.194  -3.433
  238    HZ1  LYS  31          1HZ       LYS  31  -1.522 -12.859  -2.543
  239    HZ2  LYS  31          2HZ       LYS  31  -2.252 -13.409  -3.963
  240    HZ3  LYS  31          3HZ       LYS  31  -2.864 -13.886  -2.464
  241    H    VAL  32           H        VAL  32  -2.358  -8.393  -0.215
  242    HA   VAL  32           HA       VAL  32  -1.163  -8.784   2.425
  243    HB   VAL  32           HB       VAL  32  -2.509  -6.340   1.411
  244   HG11  VAL  32          1HG1      VAL  32  -4.033  -6.917   3.159
  245   HG12  VAL  32          2HG1      VAL  32  -2.960  -5.652   3.758
  246   HG13  VAL  32          3HG1      VAL  32  -2.708  -7.327   4.240
  247   HG21  VAL  32          1HG2      VAL  32  -0.866  -5.345   2.941
  248   HG22  VAL  32          2HG2      VAL  32  -0.163  -6.344   1.670
  249   HG23  VAL  32          3HG2      VAL  32  -0.296  -6.971   3.315
  250    H    THR  33           H        THR  33  -2.379  -9.908   3.804
  251    HA   THR  33           HA       THR  33  -4.893 -10.941   2.983
  252    HB   THR  33           HB       THR  33  -5.026 -11.795   5.339
  253    HG1  THR  33          1HG       THR  33  -3.130 -11.495   6.630
  254   HG21  THR  33          1HG2      THR  33  -3.128 -13.341   5.136
  255   HG22  THR  33          2HG2      THR  33  -2.428 -12.308   3.892
  256   HG23  THR  33          3HG2      THR  33  -3.960 -13.127   3.596
  257    H    GLU  34           H        GLU  34  -6.850 -10.566   4.301
  258    HA   GLU  34           HA       GLU  34  -7.455  -7.934   3.685
  259    HB2  GLU  34          2HB       GLU  34  -9.714  -8.482   4.776
  260    HB3  GLU  34          1HB       GLU  34  -9.177  -9.292   3.301
  261    HG2  GLU  34          2HG       GLU  34 -10.095 -10.973   4.643
  262    HG3  GLU  34          1HG       GLU  34  -8.352 -11.142   4.805
  263    H    ALA  35           H        ALA  35  -6.323  -9.049   6.698
  264    HA   ALA  35           HA       ALA  35  -7.701  -7.322   8.456
  265    HB1  ALA  35          1HB       ALA  35  -4.962  -8.526   8.811
  266    HB2  ALA  35          2HB       ALA  35  -6.484  -9.322   9.213
  267    HB3  ALA  35          3HB       ALA  35  -5.992  -7.868  10.081
  268    H    MET  36           H        MET  36  -4.405  -7.079   7.058
  269    HA   MET  36           HA       MET  36  -3.963  -4.438   7.964
  270    HB2  MET  36          2HB       MET  36  -2.694  -6.222   5.929
  271    HB3  MET  36          1HB       MET  36  -2.280  -4.523   5.948
  272    HG2  MET  36          2HG       MET  36  -2.042  -6.378   8.296
  273    HG3  MET  36          1HG       MET  36  -0.711  -5.897   7.239
  274    HE1  MET  36          1HE       MET  36  -2.117  -2.823   6.810
  275    HE2  MET  36          2HE       MET  36  -0.396  -3.198   6.723
  276    HE3  MET  36          3HE       MET  36  -0.969  -1.941   7.820
  277    H    ILE  37           H        ILE  37  -5.663  -5.855   5.361
  278    HA   ILE  37           HA       ILE  37  -5.719  -3.552   3.663
  279    HB   ILE  37           HB       ILE  37  -6.876  -6.205   3.720
  280   HG12  ILE  37          2HG1      ILE  37  -5.491  -6.296   1.979
  281   HG13  ILE  37          1HG1      ILE  37  -6.487  -5.121   1.159
  282   HG21  ILE  37          1HG2      ILE  37  -8.645  -5.780   2.145
  283   HG22  ILE  37          2HG2      ILE  37  -8.330  -4.045   2.222
  284   HG23  ILE  37          3HG2      ILE  37  -8.943  -4.897   3.641
  285   HD11  ILE  37          1HD1      ILE  37  -5.197  -3.310   1.977
  286   HD12  ILE  37          2HD1      ILE  37  -4.130  -4.496   1.235
  287   HD13  ILE  37          3HD1      ILE  37  -4.244  -4.399   2.989
  288    H    ASP  38           H        ASP  38  -7.668  -4.751   6.308
  289    HA   ASP  38           HA       ASP  38  -9.769  -2.866   6.119
  290    HB2  ASP  38          2HB       ASP  38  -8.804  -4.935   7.925
  291    HB3  ASP  38          1HB       ASP  38  -9.582  -3.594   8.770
  292    H    GLN  39           H        GLN  39  -6.603  -2.894   7.625
  293    HA   GLN  39           HA       GLN  39  -6.828  -0.682   9.308
  294    HB2  GLN  39          2HB       GLN  39  -4.862  -1.901   9.586
  295    HB3  GLN  39          1HB       GLN  39  -4.565  -2.014   7.861
  296    HG2  GLN  39          2HG       GLN  39  -4.387   0.655   9.176
  297    HG3  GLN  39          1HG       GLN  39  -3.088  -0.510   9.406
  298   HE21  GLN  39          1HE2      GLN  39  -3.232   2.095   7.946
  299   HE22  GLN  39          2HE2      GLN  39  -2.643   1.746   6.363
  300    H    LEU  40           H        LEU  40  -5.798  -0.890   5.938
  301    HA   LEU  40           HA       LEU  40  -5.421   1.902   5.663
  302    HB2  LEU  40          2HB       LEU  40  -4.230   0.378   4.257
  303    HB3  LEU  40          1HB       LEU  40  -5.732  -0.283   3.604
  304    HG   LEU  40           HG       LEU  40  -5.791   2.485   3.088
  305   HD11  LEU  40          1HD1      LEU  40  -3.276   1.520   1.902
  306   HD12  LEU  40          2HD1      LEU  40  -3.233   1.916   3.619
  307   HD13  LEU  40          3HD1      LEU  40  -3.733   3.138   2.444
  308   HD21  LEU  40          1HD2      LEU  40  -6.754   0.818   1.635
  309   HD22  LEU  40          2HD2      LEU  40  -5.166   0.111   1.335
  310   HD23  LEU  40          3HD2      LEU  40  -5.537   1.728   0.735
  311    H    ILE  41           H        ILE  41  -8.042  -0.275   4.597
  312    HA   ILE  41           HA       ILE  41  -9.490   1.765   3.294
  313    HB   ILE  41           HB       ILE  41 -10.357  -0.907   4.369
  314   HG12  ILE  41          2HG1      ILE  41  -8.778  -0.572   2.343
  315   HG13  ILE  41          1HG1      ILE  41 -10.144  -1.661   2.156
  316   HG21  ILE  41          1HG2      ILE  41 -12.446  -0.600   3.098
  317   HG22  ILE  41          2HG2      ILE  41 -11.989   1.072   2.783
  318   HG23  ILE  41          3HG2      ILE  41 -12.299   0.538   4.435
  319   HD11  ILE  41          1HD1      ILE  41 -11.371   0.117   1.002
  320   HD12  ILE  41          2HD1      ILE  41  -9.846  -0.265   0.200
  321   HD13  ILE  41          3HD1      ILE  41  -9.978   1.186   1.194
  322    H    CYS  42           H        CYS  42  -9.660   0.558   6.627
  323    HA   CYS  42           HA       CYS  42 -11.946   2.108   7.335
  324    HB2  CYS  42          2HB       CYS  42 -11.258   0.108   8.612
  325    HB3  CYS  42          1HB       CYS  42  -9.785   0.930   9.105
  326    HG   CYS  42           HG       CYS  42 -11.442   3.017  10.362
  327    H    GLY  43           H        GLY  43  -8.618   2.719   6.938
  328    HA2  GLY  43          2HA       GLY  43  -8.088   4.900   8.535
  329    HA3  GLY  43          1HA       GLY  43  -7.430   4.667   6.926
  330    H    ALA  44           H        ALA  44  -9.442   5.103   5.207
  331    HA   ALA  44           HA       ALA  44 -10.030   7.923   5.719
  332    HB1  ALA  44          1HB       ALA  44 -10.435   8.147   3.362
  333    HB2  ALA  44          2HB       ALA  44 -10.394   6.399   3.143
  334    HB3  ALA  44          3HB       ALA  44  -8.922   7.264   3.587
  335    H    PHE  45           H        PHE  45 -11.690   4.890   4.950
  336    HA   PHE  45           HA       PHE  45 -14.176   6.159   5.840
  337    HB2  PHE  45          2HB       PHE  45 -15.081   4.310   4.071
  338    HB3  PHE  45          1HB       PHE  45 -15.022   6.059   3.835
  339    HD1  PHE  45          1HD       PHE  45 -12.641   3.212   3.649
  340    HD2  PHE  45          2HD       PHE  45 -14.181   6.690   1.758
  341    HE1  PHE  45          1HE       PHE  45 -11.123   2.839   1.750
  342    HE2  PHE  45          2HE       PHE  45 -12.655   6.336  -0.141
  343    HZ   PHE  45           HZ       PHE  45 -11.110   4.409  -0.139
  344    HA   PRO  46           HA       PRO  46 -14.282   2.287   8.003
  345    HB2  PRO  46          2HB       PRO  46 -14.984   3.290  10.361
  346    HB3  PRO  46          1HB       PRO  46 -13.338   3.436   9.753
  347    HG2  PRO  46          2HG       PRO  46 -15.498   5.484   9.861
  348    HG3  PRO  46          1HG       PRO  46 -13.751   5.689  10.061
  349    HD2  PRO  46          2HD       PRO  46 -15.241   6.147   7.683
  350    HD3  PRO  46          1HD       PRO  46 -13.473   6.082   7.837
  351    H    GLY  47           H        GLY  47 -16.519   4.134   6.615
  352    HA2  GLY  47          2HA       GLY  47 -18.830   3.314   8.193
  353    HA3  GLY  47          1HA       GLY  47 -18.849   4.363   6.783
  354    H    LEU  48           H        LEU  48 -17.032   1.521   6.406
  355    HA   LEU  48           HA       LEU  48 -19.085   0.454   4.615
  356    HB2  LEU  48          2HB       LEU  48 -16.168  -0.275   4.869
  357    HB3  LEU  48          1HB       LEU  48 -17.271  -0.863   3.642
  358    HG   LEU  48           HG       LEU  48 -16.409   2.013   3.956
  359   HD11  LEU  48          1HD1      LEU  48 -15.139   1.584   1.887
  360   HD12  LEU  48          2HD1      LEU  48 -15.552  -0.128   2.015
  361   HD13  LEU  48          3HD1      LEU  48 -14.557   0.637   3.255
  362   HD21  LEU  48          1HD2      LEU  48 -18.638   1.775   2.974
  363   HD22  LEU  48          2HD2      LEU  48 -17.992   0.649   1.781
  364   HD23  LEU  48          3HD2      LEU  48 -17.465   2.330   1.781
  365    H    SER  49           H        SER  49 -20.182  -1.349   5.129
  366    HA   SER  49           HA       SER  49 -19.461  -3.019   7.350
  367    HB2  SER  49          2HB       SER  49 -21.326  -4.459   6.499
  368    HB3  SER  49          1HB       SER  49 -21.813  -2.778   6.736
  369    HG   SER  49           HG       SER  49 -22.553  -3.259   4.747
  370    H    TRP  50           H        TRP  50 -19.313  -5.557   6.784
  371    HA   TRP  50           HA       TRP  50 -16.964  -5.889   5.291
  372    HB2  TRP  50          2HB       TRP  50 -17.716  -7.548   6.989
  373    HB3  TRP  50          1HB       TRP  50 -18.993  -8.051   5.883
  374    HD1  TRP  50           HD       TRP  50 -15.134  -7.790   5.782
  375    HE1  TRP  50          1HE       TRP  50 -14.275  -9.748   4.358
  376    HE3  TRP  50          3HE       TRP  50 -19.615  -9.845   4.485
  377    HZ2  TRP  50          2HZ       TRP  50 -15.377 -11.881   2.909
  378    HZ3  TRP  50          3HZ       TRP  50 -19.625 -11.852   3.069
  379    HH2  TRP  50           HH       TRP  50 -17.541 -12.861   2.296
  380    H    GLU  51           H        GLU  51 -20.338  -6.268   4.420
  381    HA   GLU  51           HA       GLU  51 -19.972  -7.375   1.861
  382    HB2  GLU  51          2HB       GLU  51 -22.211  -5.584   2.827
  383    HB3  GLU  51          1HB       GLU  51 -22.268  -6.642   1.424
  384    HG2  GLU  51          2HG       GLU  51 -22.076  -8.586   2.844
  385    HG3  GLU  51          1HG       GLU  51 -21.903  -7.573   4.257
  386    H    GLN  52           H        GLN  52 -20.321  -4.023   2.948
  387    HA   GLN  52           HA       GLN  52 -20.133  -2.886   0.356
  388    HB2  GLN  52          2HB       GLN  52 -19.999  -1.824   3.150
  389    HB3  GLN  52          1HB       GLN  52 -19.528  -0.786   1.809
  390    HG2  GLN  52          2HG       GLN  52 -22.150  -2.225   1.788
  391    HG3  GLN  52          1HG       GLN  52 -21.954  -0.703   2.656
  392   HE21  GLN  52          1HE2      GLN  52 -20.109  -1.273  -0.220
  393   HE22  GLN  52          2HE2      GLN  52 -21.000  -0.204  -1.245
  394    H    LEU  53           H        LEU  53 -17.763  -3.697   2.809
  395    HA   LEU  53           HA       LEU  53 -15.690  -2.173   1.548
  396    HB2  LEU  53          2HB       LEU  53 -15.840  -2.682   4.019
  397    HB3  LEU  53          1HB       LEU  53 -15.373  -4.322   3.638
  398    HG   LEU  53           HG       LEU  53 -13.627  -2.036   2.808
  399   HD11  LEU  53          1HD1      LEU  53 -12.404  -2.244   4.910
  400   HD12  LEU  53          2HD1      LEU  53 -13.600  -3.399   5.500
  401   HD13  LEU  53          3HD1      LEU  53 -14.065  -1.724   5.199
  402   HD21  LEU  53          1HD2      LEU  53 -13.182  -4.274   1.925
  403   HD22  LEU  53          2HD2      LEU  53 -13.034  -4.888   3.572
  404   HD23  LEU  53          3HD2      LEU  53 -11.876  -3.703   2.965
  405    H    GLN  54           H        GLN  54 -16.630  -5.581   1.712
  406    HA   GLN  54           HA       GLN  54 -14.426  -6.675   0.412
  407    HB2  GLN  54          2HB       GLN  54 -15.686  -8.623   0.065
  408    HB3  GLN  54          1HB       GLN  54 -16.298  -7.926   1.542
  409    HG2  GLN  54          2HG       GLN  54 -18.307  -7.312   0.597
  410    HG3  GLN  54          1HG       GLN  54 -17.659  -7.343  -1.040
  411   HE21  GLN  54          1HE2      GLN  54 -18.907  -9.261   1.583
  412   HE22  GLN  54          2HE2      GLN  54 -19.167 -10.698   0.663
  413    H    GLU  55           H        GLU  55 -17.409  -5.257  -0.902
  414    HA   GLU  55           HA       GLU  55 -16.700  -5.800  -3.616
  415    HB2  GLU  55          2HB       GLU  55 -18.601  -4.404  -4.226
  416    HB3  GLU  55          1HB       GLU  55 -19.039  -5.558  -2.980
  417    HG2  GLU  55          2HG       GLU  55 -18.954  -3.835  -1.304
  418    HG3  GLU  55          1HG       GLU  55 -18.383  -2.680  -2.471
  419    H    LYS  56           H        LYS  56 -16.144  -3.167  -1.395
  420    HA   LYS  56           HA       LYS  56 -15.459  -1.046  -2.987
  421    HB2  LYS  56          2HB       LYS  56 -15.141  -1.528  -0.350
  422    HB3  LYS  56          1HB       LYS  56 -13.478  -1.753  -0.879
  423    HG2  LYS  56          2HG       LYS  56 -13.649   0.494  -0.203
  424    HG3  LYS  56          1HG       LYS  56 -13.641   0.519  -1.968
  425    HD2  LYS  56          2HD       LYS  56 -16.061   0.758  -1.996
  426    HD3  LYS  56          1HD       LYS  56 -16.112   0.654  -0.237
  427    HE2  LYS  56          2HE       LYS  56 -16.280   2.954  -0.801
  428    HE3  LYS  56          1HE       LYS  56 -14.653   2.698  -0.177
  429    HZ1  LYS  56          1HZ       LYS  56 -13.836   2.620  -2.451
  430    HZ2  LYS  56          2HZ       LYS  56 -14.630   4.078  -2.150
  431    HZ3  LYS  56          3HZ       LYS  56 -15.400   2.868  -3.044
  432    H    LYS  57           H        LYS  57 -13.416  -3.797  -2.101
  433    HA   LYS  57           HA       LYS  57 -11.500  -2.954  -4.169
  434    HB2  LYS  57          2HB       LYS  57 -10.412  -4.944  -2.451
  435    HB3  LYS  57          1HB       LYS  57  -9.902  -3.278  -2.649
  436    HG2  LYS  57          2HG       LYS  57 -10.366  -3.292  -0.429
  437    HG3  LYS  57          1HG       LYS  57 -11.945  -2.832  -1.054
  438    HD2  LYS  57          2HD       LYS  57 -12.680  -4.544   0.198
  439    HD3  LYS  57          1HD       LYS  57 -12.121  -5.531  -1.151
  440    HE2  LYS  57          2HE       LYS  57  -9.984  -5.873  -0.038
  441    HE3  LYS  57          1HE       LYS  57 -10.503  -4.840   1.286
  442    HZ1  LYS  57          1HZ       LYS  57 -12.352  -6.427   1.665
  443    HZ2  LYS  57          2HZ       LYS  57 -10.822  -7.063   1.972
  444    HZ3  LYS  57          3HZ       LYS  57 -11.638  -7.478   0.542
  445    H    LYS  58           H        LYS  58 -13.999  -4.837  -4.182
  446    HA   LYS  58           HA       LYS  58 -13.289  -7.464  -4.648
  447    HB2  LYS  58          2HB       LYS  58 -15.554  -5.765  -5.271
  448    HB3  LYS  58          1HB       LYS  58 -15.284  -6.965  -6.520
  449    HG2  LYS  58          2HG       LYS  58 -15.553  -7.586  -3.590
  450    HG3  LYS  58          1HG       LYS  58 -16.867  -7.686  -4.761
  451    HD2  LYS  58          2HD       LYS  58 -14.298  -9.209  -5.111
  452    HD3  LYS  58          1HD       LYS  58 -15.639  -9.849  -4.163
  453    HE2  LYS  58          2HE       LYS  58 -15.907 -10.777  -6.302
  454    HE3  LYS  58          1HE       LYS  58 -17.077  -9.468  -6.225
  455    HZ1  LYS  58          1HZ       LYS  58 -14.399  -9.186  -7.476
  456    HZ2  LYS  58          2HZ       LYS  58 -15.707  -8.115  -7.590
  457    HZ3  LYS  58          3HZ       LYS  58 -15.786  -9.627  -8.334
  458    H    GLY  59           H        GLY  59 -12.870  -4.718  -6.768
  459    HA2  GLY  59          2HA       GLY  59 -12.617  -6.111  -9.203
  460    HA3  GLY  59          1HA       GLY  59 -11.975  -4.514  -8.872
  461    H    ARG  60           H        ARG  60 -10.263  -5.502  -6.650
  462    HA   ARG  60           HA       ARG  60  -8.379  -7.182  -8.077
  463    HB2  ARG  60          2HB       ARG  60  -8.129  -4.723  -8.807
  464    HB3  ARG  60          1HB       ARG  60  -7.435  -4.469  -7.213
  465    HG2  ARG  60          2HG       ARG  60  -5.715  -4.817  -8.899
  466    HG3  ARG  60          1HG       ARG  60  -5.700  -6.100  -7.683
  467    HD2  ARG  60          2HD       ARG  60  -6.805  -7.611  -9.151
  468    HD3  ARG  60          1HD       ARG  60  -7.123  -6.326 -10.322
  469    HE   ARG  60           HE       ARG  60  -4.357  -7.100  -9.676
  470   HH11  ARG  60          1HH1      ARG  60  -6.955  -6.760 -11.997
  471   HH12  ARG  60          2HH1      ARG  60  -5.941  -7.093 -13.366
  472   HH21  ARG  60          1HH2      ARG  60  -3.025  -7.536 -11.466
  473   HH22  ARG  60          2HH2      ARG  60  -3.706  -7.545 -13.062
  474    H    ALA  61           H        ALA  61  -9.735  -7.624  -5.651
  475    HA   ALA  61           HA       ALA  61  -7.351  -8.021  -4.014
  476    HB1  ALA  61          1HB       ALA  61  -9.910  -7.030  -2.769
  477    HB2  ALA  61          2HB       ALA  61  -8.515  -6.008  -3.116
  478    HB3  ALA  61          3HB       ALA  61  -8.370  -7.333  -1.962
  479    H    ALA  62           H        ALA  62  -9.632  -9.414  -5.674
  480    HA   ALA  62           HA       ALA  62 -10.789 -11.375  -5.668
  481    HB1  ALA  62          1HB       ALA  62  -8.459 -12.151  -5.652
  482    HB2  ALA  62          2HB       ALA  62  -9.542 -13.284  -4.840
  483    HB3  ALA  62          3HB       ALA  62  -8.504 -12.219  -3.889
  484    H    ALA  63           H        ALA  63 -11.925  -9.633  -3.949
  485    HA   ALA  63           HA       ALA  63 -13.291  -9.352  -2.169
  486    HB1  ALA  63          1HB       ALA  63 -14.181 -11.258  -0.960
  487    HB2  ALA  63          2HB       ALA  63 -12.950 -12.308  -1.662
  488    HB3  ALA  63          3HB       ALA  63 -14.182 -11.583  -2.694
  489    H    ASN  64           H        ASN  64 -10.790 -11.714  -1.204
  490    HA   ASN  64           HA       ASN  64  -9.944  -9.806   0.858
  491    HB2  ASN  64          2HB       ASN  64 -10.478 -12.743   1.174
  492    HB3  ASN  64          1HB       ASN  64  -9.337 -11.920   2.228
  493   HD21  ASN  64          1HD2      ASN  64 -10.806  -9.427   2.199
  494   HD22  ASN  64          2HD2      ASN  64 -12.186  -9.668   3.214
  495    H    GLY  65           H        GLY  65  -8.041  -9.109   0.331
  496    HA2  GLY  65          2HA       GLY  65  -5.637  -9.957   0.358
  497    HA3  GLY  65          1HA       GLY  65  -6.159 -10.979  -0.965
  498    H    TYR  66           H        TYR  66  -5.900  -7.541  -0.016
  499    HA   TYR  66           HA       TYR  66  -5.807  -6.543  -2.686
  500    HB2  TYR  66          2HB       TYR  66  -5.258  -5.449  -0.076
  501    HB3  TYR  66          1HB       TYR  66  -4.006  -4.955  -1.220
  502    HD1  TYR  66          1HD       TYR  66  -5.314  -2.899  -0.047
  503    HD2  TYR  66          2HD       TYR  66  -6.748  -5.190  -3.308
  504    HE1  TYR  66          1HE       TYR  66  -6.674  -0.980  -0.755
  505    HE2  TYR  66          2HE       TYR  66  -8.125  -3.293  -4.043
  506    HH   TYR  66           HH       TYR  66  -9.130  -1.262  -3.106
  507    H    ASP  67           H        ASP  67  -3.958  -5.781  -3.831
  508    HA   ASP  67           HA       ASP  67  -1.514  -7.203  -3.168
  509    HB2  ASP  67          2HB       ASP  67  -1.296  -8.126  -5.289
  510    HB3  ASP  67          1HB       ASP  67  -3.030  -8.276  -4.964
  511    H    ARG  68           H        ARG  68   0.316  -6.260  -4.503
  512    HA   ARG  68           HA       ARG  68   0.583  -3.703  -3.517
  513    HB2  ARG  68          2HB       ARG  68   2.669  -3.541  -4.855
  514    HB3  ARG  68          1HB       ARG  68   2.534  -5.016  -3.914
  515    HG2  ARG  68          2HG       ARG  68   1.865  -6.230  -5.937
  516    HG3  ARG  68          1HG       ARG  68   2.054  -4.745  -6.874
  517    HD2  ARG  68          2HD       ARG  68   4.417  -4.644  -6.211
  518    HD3  ARG  68          1HD       ARG  68   4.221  -6.146  -5.307
  519    HE   ARG  68           HE       ARG  68   3.408  -6.638  -7.920
  520   HH11  ARG  68          1HH1      ARG  68   6.343  -5.773  -6.217
  521   HH12  ARG  68          2HH1      ARG  68   7.391  -6.532  -7.368
  522   HH21  ARG  68          1HH2      ARG  68   4.790  -7.641  -9.444
  523   HH22  ARG  68          2HH2      ARG  68   6.506  -7.588  -9.212
  524    H    SER  69           H        SER  69  -0.401  -4.631  -6.796
  525    HA   SER  69           HA       SER  69  -0.146  -1.979  -7.816
  526    HB2  SER  69          2HB       SER  69  -1.826  -4.247  -8.902
  527    HB3  SER  69          1HB       SER  69  -1.275  -2.818  -9.780
  528    HG   SER  69           HG       SER  69   0.924  -3.620  -9.140
  529    H    ALA  70           H        ALA  70  -2.868  -3.887  -6.575
  530    HA   ALA  70           HA       ALA  70  -4.894  -1.979  -7.130
  531    HB1  ALA  70          1HB       ALA  70  -4.943  -3.989  -4.888
  532    HB2  ALA  70          2HB       ALA  70  -5.206  -4.432  -6.579
  533    HB3  ALA  70          3HB       ALA  70  -6.310  -3.314  -5.778
  534    H    PHE  71           H        PHE  71  -3.183  -2.837  -4.179
  535    HA   PHE  71           HA       PHE  71  -4.541  -0.951  -2.587
  536    HB2  PHE  71          2HB       PHE  71  -3.783  -2.781  -1.420
  537    HB3  PHE  71          1HB       PHE  71  -2.216  -2.806  -2.184
  538    HD1  PHE  71          1HD       PHE  71  -4.064  -1.966   0.680
  539    HD2  PHE  71          2HD       PHE  71  -0.620  -0.824  -1.531
  540    HE1  PHE  71          1HE       PHE  71  -3.155  -0.879   2.676
  541    HE2  PHE  71          2HE       PHE  71   0.292   0.272   0.466
  542    HZ   PHE  71           HZ       PHE  71  -0.977   0.248   2.570
  543    H    PHE  72           H        PHE  72  -1.419  -0.866  -4.280
  544    HA   PHE  72           HA       PHE  72  -0.544   1.565  -3.151
  545    HB2  PHE  72          2HB       PHE  72   0.945   0.039  -4.407
  546    HB3  PHE  72          1HB       PHE  72   0.113   0.487  -5.890
  547    HD1  PHE  72          1HD       PHE  72   1.895   2.072  -3.022
  548    HD2  PHE  72          2HD       PHE  72   1.015   2.158  -7.185
  549    HE1  PHE  72          1HE       PHE  72   3.434   3.970  -3.304
  550    HE2  PHE  72          2HE       PHE  72   2.553   4.056  -7.475
  551    HZ   PHE  72           HZ       PHE  72   3.765   4.963  -5.532
  552    H    SER  73           H        SER  73  -2.565   0.816  -5.889
  553    HA   SER  73           HA       SER  73  -2.684   3.363  -7.050
  554    HB2  SER  73          2HB       SER  73  -3.475   1.299  -8.161
  555    HB3  SER  73          1HB       SER  73  -4.825   1.223  -7.033
  556    HG   SER  73           HG       SER  73  -4.500   3.615  -8.411
  557    H    LEU  74           H        LEU  74  -4.589   1.887  -4.466
  558    HA   LEU  74           HA       LEU  74  -6.405   4.058  -4.172
  559    HB2  LEU  74          2HB       LEU  74  -6.894   1.807  -3.338
  560    HB3  LEU  74          1HB       LEU  74  -5.571   1.938  -2.197
  561    HG   LEU  74           HG       LEU  74  -6.737   3.590  -0.918
  562   HD11  LEU  74          1HD1      LEU  74  -8.809   3.553  -3.108
  563   HD12  LEU  74          2HD1      LEU  74  -7.723   4.886  -2.713
  564   HD13  LEU  74          3HD1      LEU  74  -8.968   4.395  -1.565
  565   HD21  LEU  74          1HD2      LEU  74  -7.370   1.338  -0.431
  566   HD22  LEU  74          2HD2      LEU  74  -8.506   1.321  -1.777
  567   HD23  LEU  74          3HD2      LEU  74  -8.822   2.340  -0.370
  568    H    VAL  75           H        VAL  75  -3.402   3.180  -2.494
  569    HA   VAL  75           HA       VAL  75  -3.527   5.295  -0.602
  570    HB   VAL  75           HB       VAL  75  -0.995   3.939  -1.530
  571   HG11  VAL  75          1HG1      VAL  75  -0.352   5.555  -0.069
  572   HG12  VAL  75          2HG1      VAL  75  -0.572   4.165   0.996
  573   HG13  VAL  75          3HG1      VAL  75  -1.811   5.417   0.904
  574   HG21  VAL  75          1HG2      VAL  75  -1.463   2.371   0.408
  575   HG22  VAL  75          2HG2      VAL  75  -2.383   2.108  -1.077
  576   HG23  VAL  75          3HG2      VAL  75  -3.139   2.916   0.298
  577    H    ALA  76           H        ALA  76  -2.030   4.991  -3.788
  578    HA   ALA  76           HA       ALA  76  -0.522   7.390  -3.646
  579    HB1  ALA  76          1HB       ALA  76  -0.193   7.121  -6.039
  580    HB2  ALA  76          2HB       ALA  76  -1.467   5.900  -6.090
  581    HB3  ALA  76          3HB       ALA  76   0.023   5.584  -5.201
  582    H    SER  77           H        SER  77  -3.768   7.051  -3.625
  583    HA   SER  77           HA       SER  77  -4.185   9.607  -5.016
  584    HB2  SER  77          2HB       SER  77  -5.508   7.698  -5.894
  585    HB3  SER  77          1HB       SER  77  -6.226   7.482  -4.301
  586    HG   SER  77           HG       SER  77  -7.130   9.568  -4.496
  587    H    ASP  78           H        ASP  78  -3.835   8.203  -2.002
  588    HA   ASP  78           HA       ASP  78  -5.396  10.330  -0.700
  589    HB2  ASP  78          2HB       ASP  78  -5.346   7.387  -0.078
  590    HB3  ASP  78          1HB       ASP  78  -5.875   8.592   1.098
  591    H    GLU  79           H        GLU  79  -3.871  11.623   0.157
  592    HA   GLU  79           HA       GLU  79  -1.364  10.722   1.081
  593    HB2  GLU  79          2HB       GLU  79  -0.882  12.888   1.540
  594    HB3  GLU  79          1HB       GLU  79  -2.238  13.142   0.463
  595    HG2  GLU  79          2HG       GLU  79  -2.493  13.084   3.456
  596    HG3  GLU  79          1HG       GLU  79  -2.180  14.555   2.532
  597    H    GLN  80           H        GLN  80  -4.495  10.924   2.635
  598    HA   GLN  80           HA       GLN  80  -3.826  10.604   5.314
  599    HB2  GLN  80          2HB       GLN  80  -5.916   8.870   4.029
  600    HB3  GLN  80          1HB       GLN  80  -5.912   9.550   5.639
  601    HG2  GLN  80          2HG       GLN  80  -6.876  11.455   4.985
  602    HG3  GLN  80          1HG       GLN  80  -5.963  11.526   3.477
  603   HE21  GLN  80          1HE2      GLN  80  -6.676   9.005   2.455
  604   HE22  GLN  80          2HE2      GLN  80  -8.347   9.022   2.043
  605    H    TYR  81           H        TYR  81  -3.639   8.414   2.635
  606    HA   TYR  81           HA       TYR  81  -3.506   6.056   4.285
  607    HB2  TYR  81          2HB       TYR  81  -3.806   6.574   1.344
  608    HB3  TYR  81          1HB       TYR  81  -3.342   4.980   1.921
  609    HD1  TYR  81          1HD       TYR  81  -5.767   5.167   0.371
  610    HD2  TYR  81          2HD       TYR  81  -5.240   5.878   4.527
  611    HE1  TYR  81          1HE       TYR  81  -8.105   4.483   0.771
  612    HE2  TYR  81          2HE       TYR  81  -7.562   5.250   4.925
  613    HH   TYR  81           HH       TYR  81  -9.437   3.617   2.676
  614    H    VAL  82           H        VAL  82  -1.478   7.896   2.049
  615    HA   VAL  82           HA       VAL  82   0.701   6.183   2.083
  616    HB   VAL  82           HB       VAL  82   1.922   8.130   1.360
  617   HG11  VAL  82          1HG1      VAL  82   0.771   6.935  -0.342
  618   HG12  VAL  82          2HG1      VAL  82   0.646   8.663  -0.685
  619   HG13  VAL  82          3HG1      VAL  82  -0.718   7.802   0.034
  620   HG21  VAL  82          1HG2      VAL  82   1.269   9.967   2.498
  621   HG22  VAL  82          2HG2      VAL  82  -0.437   9.646   2.191
  622   HG23  VAL  82          3HG2      VAL  82   0.595  10.246   0.889
  623    H    ARG  83           H        ARG  83   0.028   9.090   3.945
  624    HA   ARG  83           HA       ARG  83   2.183   8.790   5.739
  625    HB2  ARG  83          2HB       ARG  83  -0.355  10.226   6.414
  626    HB3  ARG  83          1HB       ARG  83   1.245  10.523   7.045
  627    HG2  ARG  83          2HG       ARG  83   1.967  11.477   4.967
  628    HG3  ARG  83          1HG       ARG  83   0.442  11.034   4.194
  629    HD2  ARG  83          2HD       ARG  83  -0.553  12.813   4.890
  630    HD3  ARG  83          1HD       ARG  83  -0.067  12.531   6.564
  631    HE   ARG  83           HE       ARG  83   2.143  13.553   5.211
  632   HH11  ARG  83          1HH1      ARG  83  -1.062  14.605   6.150
  633   HH12  ARG  83          2HH1      ARG  83  -0.607  16.273   6.303
  634   HH21  ARG  83          1HH2      ARG  83   2.749  15.750   5.416
  635   HH22  ARG  83          2HH2      ARG  83   1.560  16.923   5.882
  636    H    PHE  84           H        PHE  84  -1.058   7.478   5.658
  637    HA   PHE  84           HA       PHE  84  -1.308   6.763   8.360
  638    HB2  PHE  84          2HB       PHE  84  -2.775   6.231   6.096
  639    HB3  PHE  84          1HB       PHE  84  -2.129   4.638   6.496
  640    HD1  PHE  84          1HD       PHE  84  -2.664   3.590   8.627
  641    HD2  PHE  84          2HD       PHE  84  -4.452   7.259   7.444
  642    HE1  PHE  84          1HE       PHE  84  -4.416   3.276  10.328
  643    HE2  PHE  84          2HE       PHE  84  -6.206   6.960   9.142
  644    HZ   PHE  84           HZ       PHE  84  -6.191   4.964  10.588
  645    H    ILE  85           H        ILE  85   0.249   5.092   5.685
  646    HA   ILE  85           HA       ILE  85   1.233   2.983   7.370
  647    HB   ILE  85           HB       ILE  85   1.456   3.631   4.483
  648   HG12  ILE  85          2HG1      ILE  85   0.881   1.147   6.113
  649   HG13  ILE  85          1HG1      ILE  85  -0.288   2.140   5.255
  650   HG21  ILE  85          1HG2      ILE  85   3.759   3.346   4.920
  651   HG22  ILE  85          2HG2      ILE  85   3.190   1.813   4.255
  652   HG23  ILE  85          3HG2      ILE  85   3.459   1.980   5.988
  653   HD11  ILE  85          1HD1      ILE  85   0.687   1.450   3.128
  654   HD12  ILE  85          2HD1      ILE  85   0.152   0.065   4.083
  655   HD13  ILE  85          3HD1      ILE  85   1.868   0.453   3.986
  656    H    ALA  86           H        ALA  86   2.701   5.786   5.736
  657    HA   ALA  86           HA       ALA  86   5.317   5.540   6.559
  658    HB1  ALA  86          1HB       ALA  86   3.803   8.142   6.457
  659    HB2  ALA  86          2HB       ALA  86   4.377   7.284   5.029
  660    HB3  ALA  86          3HB       ALA  86   5.532   7.898   6.214
  661    H    GLN  87           H        GLN  87   2.571   6.743   8.360
  662    HA   GLN  87           HA       GLN  87   4.004   7.775  10.566
  663    HB2  GLN  87          2HB       GLN  87   1.658   8.369   9.889
  664    HB3  GLN  87          1HB       GLN  87   1.150   6.803  10.495
  665    HG2  GLN  87          2HG       GLN  87   1.848   7.413  12.731
  666    HG3  GLN  87          1HG       GLN  87   2.434   8.969  12.138
  667   HE21  GLN  87          1HE2      GLN  87   0.937  10.521  11.447
  668   HE22  GLN  87          2HE2      GLN  87  -0.725  10.451  11.916
  669    H    HIS  88           H        HIS  88   2.392   4.726   9.855
  670    HA   HIS  88           HA       HIS  88   2.911   3.555  12.412
  671    HB2  HIS  88          2HB       HIS  88   2.035   2.368   9.779
  672    HB3  HIS  88          1HB       HIS  88   2.274   1.399  11.226
  673    HD1  HIS  88          1HD       HIS  88   0.955   3.471  13.216
  674    HD2  HIS  88          2HD       HIS  88  -0.717   2.117   9.654
  675    HE1  HIS  88          1HE       HIS  88  -1.519   3.770  13.480
  676    HE2  HIS  88          2HE       HIS  88  -2.514   2.717  11.426
  677    H    PHE  89           H        PHE  89   4.602   3.611   9.331
  678    HA   PHE  89           HA       PHE  89   6.825   2.144  10.555
  679    HB2  PHE  89          2HB       PHE  89   5.243   0.614   9.259
  680    HB3  PHE  89          1HB       PHE  89   5.791   1.447   7.812
  681    HD1  PHE  89          1HD       PHE  89   7.524   0.512   6.630
  682    HD2  PHE  89          2HD       PHE  89   7.197  -0.291  10.794
  683    HE1  PHE  89          1HE       PHE  89   9.380  -1.091   6.461
  684    HE2  PHE  89          2HE       PHE  89   9.076  -1.871  10.640
  685    HZ   PHE  89           HZ       PHE  89  10.172  -2.271   8.471
  686    HA   PRO  90           HA       PRO  90   8.893   5.601   8.398
  687    HB2  PRO  90          2HB       PRO  90  11.168   4.391   9.838
  688    HB3  PRO  90          1HB       PRO  90  10.604   6.065   9.834
  689    HG2  PRO  90          2HG       PRO  90  10.256   4.471  11.957
  690    HG3  PRO  90          1HG       PRO  90   9.055   5.688  11.496
  691    HD2  PRO  90          2HD       PRO  90   9.008   2.730  11.090
  692    HD3  PRO  90          1HD       PRO  90   7.682   3.839  11.495
  693    H    CYS  91           H        CYS  91  10.669   5.615   6.830
  694    HA   CYS  91           HA       CYS  91  11.287   2.917   5.831
  695    HB2  CYS  91          2HB       CYS  91  10.011   5.071   4.417
  696    HB3  CYS  91          1HB       CYS  91  11.510   4.554   3.622
  697    HG   CYS  91           HG       CYS  91   9.618   2.041   4.752
  698    H    ALA  92           H        ALA  92  13.005   2.799   4.374
  699    HA   ALA  92           HA       ALA  92  15.390   3.753   5.698
  700    HB1  ALA  92          1HB       ALA  92  15.161   1.410   4.981
  701    HB2  ALA  92          2HB       ALA  92  16.564   2.189   4.247
  702    HB3  ALA  92          3HB       ALA  92  15.097   1.942   3.300
  703    HA   PRO  93           HA       PRO  93  16.435   6.966   2.839
  704    HB2  PRO  93          2HB       PRO  93  19.133   6.937   2.987
  705    HB3  PRO  93          1HB       PRO  93  18.122   7.522   4.307
  706    HG2  PRO  93          2HG       PRO  93  19.468   4.871   3.982
  707    HG3  PRO  93          1HG       PRO  93  19.329   5.887   5.430
  708    HD2  PRO  93          2HD       PRO  93  17.743   3.722   4.966
  709    HD3  PRO  93          1HD       PRO  93  17.218   5.129   5.910
  710    H    GLU  94           H        GLU  94  17.966   7.380   0.918
  711    HA   GLU  94           HA       GLU  94  17.446   5.413  -1.028
  712    HB2  GLU  94          2HB       GLU  94  19.231   7.838  -1.133
  713    HB3  GLU  94          1HB       GLU  94  18.778   6.873  -2.529
  714    HG2  GLU  94          2HG       GLU  94  16.435   7.438  -2.166
  715    HG3  GLU  94          1HG       GLU  94  16.882   8.394  -0.756
  716    H    GLU  95           H        GLU  95  20.584   6.698  -0.220
  717    HA   GLU  95           HA       GLU  95  22.631   5.794   0.118
  718    HB2  GLU  95          2HB       GLU  95  21.051   3.269   0.564
  719    HB3  GLU  95          1HB       GLU  95  22.785   3.398   0.824
  720    HG2  GLU  95          2HG       GLU  95  20.594   4.847   2.260
  721    HG3  GLU  95          1HG       GLU  95  21.661   3.608   2.914
  722    H    GLU  96           H        GLU  96  24.270   4.395  -0.818
  723    HA   GLU  96           HA       GLU  96  23.643   3.794  -3.632
  724    HB2  GLU  96          2HB       GLU  96  26.274   4.567  -2.358
  725    HB3  GLU  96          1HB       GLU  96  26.031   4.235  -4.066
  726    HG2  GLU  96          2HG       GLU  96  24.651   6.441  -2.559
  727    HG3  GLU  96          1HG       GLU  96  26.137   6.643  -3.486
  728    H    LYS  97           H        LYS  97  24.123   2.262  -0.786
  729    HA   LYS  97           HA       LYS  97  25.911   0.198  -1.790
  730    HB2  LYS  97          2HB       LYS  97  24.705   0.503   0.962
  731    HB3  LYS  97          1HB       LYS  97  25.904  -0.688   0.496
  732    HG2  LYS  97          2HG       LYS  97  27.472   1.142  -0.024
  733    HG3  LYS  97          1HG       LYS  97  26.273   2.298   0.554
  734    HD2  LYS  97          2HD       LYS  97  27.485   0.076   2.197
  735    HD3  LYS  97          1HD       LYS  97  27.979   1.767   2.256
  736    HE2  LYS  97          2HE       LYS  97  25.725   2.392   2.986
  737    HE3  LYS  97          1HE       LYS  97  25.239   0.699   2.939
  738    HZ1  LYS  97          1HZ       LYS  97  27.368   1.819   4.680
  739    HZ2  LYS  97          2HZ       LYS  97  26.851   0.211   4.657
  740    HZ3  LYS  97          3HZ       LYS  97  25.801   1.429   5.182
  741    HA   PRO  98           HA       PRO  98  22.014  -2.447  -1.237
  742    HB2  PRO  98          2HB       PRO  98  19.727  -1.035  -0.328
  743    HB3  PRO  98          1HB       PRO  98  20.736  -2.130   0.617
  744    HG2  PRO  98          2HG       PRO  98  20.476   0.607   1.046
  745    HG3  PRO  98          1HG       PRO  98  21.778  -0.414   1.676
  746    HD2  PRO  98          2HD       PRO  98  21.754   1.364  -0.728
  747    HD3  PRO  98          1HD       PRO  98  23.053   1.068   0.444
  748    HA   PRO  99           HA       PRO  99  19.444  -1.605  -4.910
  749    HB2  PRO  99          2HB       PRO  99  16.834  -1.555  -3.846
  750    HB3  PRO  99          1HB       PRO  99  17.641  -2.940  -4.580
  751    HG2  PRO  99          2HG       PRO  99  17.330  -2.231  -1.708
  752    HG3  PRO  99          1HG       PRO  99  17.361  -3.830  -2.477
  753    HD2  PRO  99          2HD       PRO  99  19.466  -2.926  -1.108
  754    HD3  PRO  99          1HD       PRO  99  19.686  -3.853  -2.606
  755    H    GLU 100           H        GLU 100  18.247   0.142  -5.886
  756    HA   GLU 100           HA       GLU 100  19.090   2.624  -5.093
  757    HB2  GLU 100          2HB       GLU 100  18.179   2.051  -7.340
  758    HB3  GLU 100          1HB       GLU 100  16.564   2.088  -6.650
  759    HG2  GLU 100          2HG       GLU 100  16.658   4.375  -6.247
  760    HG3  GLU 100          1HG       GLU 100  18.395   4.448  -6.546
  761    H    ILE 101           H        ILE 101  15.748   1.413  -4.666
  762    HA   ILE 101           HA       ILE 101  15.768   2.507  -1.996
  763    HB   ILE 101           HB       ILE 101  13.296   3.343  -2.548
  764   HG12  ILE 101          2HG1      ILE 101  14.800   3.854  -5.128
  765   HG13  ILE 101          1HG1      ILE 101  13.392   2.827  -4.944
  766   HG21  ILE 101          1HG2      ILE 101  15.801   4.953  -2.989
  767   HG22  ILE 101          2HG2      ILE 101  14.981   4.675  -1.453
  768   HG23  ILE 101          3HG2      ILE 101  14.197   5.628  -2.714
  769   HD11  ILE 101          1HD1      ILE 101  12.067   4.745  -4.308
  770   HD12  ILE 101          2HD1      ILE 101  12.760   4.887  -5.917
  771   HD13  ILE 101          3HD1      ILE 101  13.463   5.787  -4.573
  772    H    ASP 102           H        ASP 102  13.177   1.463  -4.126
  773    HA   ASP 102           HA       ASP 102  12.729  -1.126  -3.696
  774    HB2  ASP 102          2HB       ASP 102  12.887  -0.816  -1.242
  775    HB3  ASP 102          1HB       ASP 102  11.566   0.332  -1.303
  776    H    ALA 103           H        ALA 103  11.072   1.868  -2.956
  777    HA   ALA 103           HA       ALA 103   8.537   1.344  -3.889
  778    HB1  ALA 103          1HB       ALA 103   8.365   3.806  -4.193
  779    HB2  ALA 103          2HB       ALA 103  10.105   3.919  -3.911
  780    HB3  ALA 103          3HB       ALA 103   9.041   3.329  -2.634
  781    H    LEU 104           H        LEU 104  10.862   3.324  -5.679
  782    HA   LEU 104           HA       LEU 104   9.697   2.336  -8.193
  783    HB2  LEU 104          2HB       LEU 104  10.496   5.190  -7.607
  784    HB3  LEU 104          1HB       LEU 104   9.699   4.592  -9.048
  785    HG   LEU 104           HG       LEU 104   8.197   4.032  -6.608
  786   HD11  LEU 104          1HD1      LEU 104   9.096   6.100  -5.820
  787   HD12  LEU 104          2HD1      LEU 104   7.436   6.388  -6.343
  788   HD13  LEU 104          3HD1      LEU 104   8.783   6.887  -7.369
  789   HD21  LEU 104          1HD2      LEU 104   7.297   3.740  -8.855
  790   HD22  LEU 104          2HD2      LEU 104   7.526   5.459  -9.178
  791   HD23  LEU 104          3HD2      LEU 104   6.369   4.937  -7.951
  792    H    GLU 105           H        GLU 105  11.858   1.089  -7.443
  793    HA   GLU 105           HA       GLU 105  14.245   2.588  -8.183
  794    HB2  GLU 105          2HB       GLU 105  15.409   0.498  -7.286
  795    HB3  GLU 105          1HB       GLU 105  14.561   1.514  -6.135
  796    HG2  GLU 105          2HG       GLU 105  14.047  -0.677  -5.523
  797    HG3  GLU 105          1HG       GLU 105  12.615  -0.093  -6.366
  798    H    LEU 106           H        LEU 106  15.894   0.476  -8.926
  799    HA   LEU 106           HA       LEU 106  16.677  -0.570 -10.763
  800    HB2  LEU 106          2HB       LEU 106  14.378  -1.836 -10.274
  801    HB3  LEU 106          1HB       LEU 106  13.956  -1.132 -11.818
  802    HG   LEU 106           HG       LEU 106  14.755  -3.432 -12.059
  803   HD11  LEU 106          1HD1      LEU 106  16.671  -1.418 -13.216
  804   HD12  LEU 106          2HD1      LEU 106  15.119  -1.894 -13.907
  805   HD13  LEU 106          3HD1      LEU 106  16.430  -3.068 -13.791
  806   HD21  LEU 106          1HD2      LEU 106  17.401  -2.425 -11.039
  807   HD22  LEU 106          2HD2      LEU 106  17.010  -4.064 -11.556
  808   HD23  LEU 106          3HD2      LEU 106  16.270  -3.398 -10.103
  809    H    LYS 107           H        LYS 107  17.111   1.764 -11.174
  810    HA   LYS 107           HA       LYS 107  16.030   2.487 -13.810
  811    HB2  LYS 107          2HB       LYS 107  16.653   4.269 -11.459
  812    HB3  LYS 107          1HB       LYS 107  16.591   4.892 -13.100
  813    HG2  LYS 107          2HG       LYS 107  14.310   3.471 -11.745
  814    HG3  LYS 107          1HG       LYS 107  14.506   5.223 -11.795
  815    HD2  LYS 107          2HD       LYS 107  14.575   5.020 -14.313
  816    HD3  LYS 107          1HD       LYS 107  14.069   3.342 -14.106
  817    HE2  LYS 107          2HE       LYS 107  12.047   4.076 -12.969
  818    HE3  LYS 107          1HE       LYS 107  12.560   5.755 -13.108
  819    HZ1  LYS 107          1HZ       LYS 107  10.961   5.209 -14.817
  820    HZ2  LYS 107          2HZ       LYS 107  11.926   3.938 -15.368
  821    HZ3  LYS 107          3HZ       LYS 107  12.461   5.532 -15.522
  822    H    THR 108           H        THR 108  17.519   3.456 -15.233
  823    HA   THR 108           HA       THR 108  20.311   3.620 -14.395
  824    HB   THR 108           HB       THR 108  19.566   2.195 -16.957
  825    HG1  THR 108          1HG       THR 108  19.629   1.264 -14.341
  826   HG21  THR 108          1HG2      THR 108  22.111   2.260 -15.325
  827   HG22  THR 108          2HG2      THR 108  21.834   3.139 -16.828
  828   HG23  THR 108          3HG2      THR 108  21.874   1.375 -16.833
  829    H    GLN 109           H        GLN 109  18.769   5.744 -14.641
  830    HA   GLN 109           HA       GLN 109  18.720   6.751 -17.346
  831    HB2  GLN 109          2HB       GLN 109  16.813   7.229 -15.977
  832    HB3  GLN 109          1HB       GLN 109  17.825   7.872 -14.693
  833    HG2  GLN 109          2HG       GLN 109  18.461   9.732 -16.122
  834    HG3  GLN 109          1HG       GLN 109  17.442   9.098 -17.413
  835   HE21  GLN 109          1HE2      GLN 109  17.326  11.652 -15.958
  836   HE22  GLN 109          2HE2      GLN 109  15.733  11.734 -15.290
  837    H    LYS 110           H        LYS 110  20.779   7.089 -17.988
  838    HA   LYS 110           HA       LYS 110  22.632   8.304 -18.408
  839    HB2  LYS 110          2HB       LYS 110  21.477  10.227 -16.388
  840    HB3  LYS 110          1HB       LYS 110  22.878  10.557 -17.396
  841    HG2  LYS 110          2HG       LYS 110  21.479  10.299 -19.399
  842    HG3  LYS 110          1HG       LYS 110  20.076  10.024 -18.366
  843    HD2  LYS 110          2HD       LYS 110  20.108  12.328 -19.114
  844    HD3  LYS 110          1HD       LYS 110  20.400  12.261 -17.376
  845    HE2  LYS 110          2HE       LYS 110  21.884  13.863 -18.459
  846    HE3  LYS 110          1HE       LYS 110  22.795  12.528 -17.759
  847    HZ1  LYS 110          1HZ       LYS 110  22.100  12.864 -20.626
  848    HZ2  LYS 110          2HZ       LYS 110  22.915  11.535 -19.976
  849    HZ3  LYS 110          3HZ       LYS 110  23.632  13.063 -19.938
  850    H    GLY 111           H        GLY 111  22.230   8.905 -14.901
  851    HA2  GLY 111          2HA       GLY 111  23.643   8.281 -13.161
  852    HA3  GLY 111          1HA       GLY 111  24.577   7.324 -14.304
  853    H    PHE 112           H        PHE 112  23.779  10.740 -13.755
  854    HA   PHE 112           HA       PHE 112  26.593  11.447 -13.856
  855    HB2  PHE 112          2HB       PHE 112  26.011  11.498 -16.210
  856    HB3  PHE 112          1HB       PHE 112  24.577  12.460 -15.874
  857    HD1  PHE 112          1HD       PHE 112  28.266  12.592 -15.338
  858    HD2  PHE 112          2HD       PHE 112  24.697  14.717 -16.252
  859    HE1  PHE 112          1HE       PHE 112  29.576  14.646 -15.666
  860    HE2  PHE 112          2HE       PHE 112  26.000  16.775 -16.582
  861    HZ   PHE 112           HZ       PHE 112  28.445  16.741 -16.288
  Start of MODEL   18
    1    H1   GLY   1          1HT       GLY   1   0.056   6.685 -20.516
    2    H2   GLY   1          2HT       GLY   1   0.993   6.437 -21.899
    3    H    GLY   1           H        GLY   1   0.637   6.194 -21.037
    4    H3   GLY   1          3HT       GLY   1  -0.221   7.614 -21.899
    5    HA2  GLY   1          1HA       GLY   1   1.965   8.624 -21.690
    6    HA3  GLY   1          2HA       GLY   1   0.965   8.914 -20.273
    7    H    SER   2           H        SER   2   2.072   8.746 -18.462
    8    HA   SER   2           HA       SER   2   3.778   6.433 -18.032
    9    HB2  SER   2          2HB       SER   2   5.583   7.912 -17.072
   10    HB3  SER   2          1HB       SER   2   5.402   8.023 -18.821
   11    HG   SER   2           HG       SER   2   5.046  10.064 -18.562
   12    H    ALA   3           H        ALA   3   1.266   6.918 -17.069
   13    HA   ALA   3           HA       ALA   3   1.147   8.255 -14.593
   14    HB1  ALA   3          1HB       ALA   3  -0.837   7.731 -15.919
   15    HB2  ALA   3          2HB       ALA   3  -0.973   7.094 -14.282
   16    HB3  ALA   3          3HB       ALA   3  -0.586   6.012 -15.619
   17    H    MET   4           H        MET   4   2.026   7.731 -12.737
   18    HA   MET   4           HA       MET   4   2.362   4.899 -12.021
   19    HB2  MET   4          2HB       MET   4   4.433   7.064 -11.566
   20    HB3  MET   4          1HB       MET   4   4.567   5.383 -11.070
   21    HG2  MET   4          2HG       MET   4   4.664   4.656 -13.350
   22    HG3  MET   4          1HG       MET   4   4.337   6.287 -13.928
   23    HE1  MET   4          1HE       MET   4   6.384   6.374 -15.528
   24    HE2  MET   4          2HE       MET   4   6.715   4.689 -15.126
   25    HE3  MET   4          3HE       MET   4   8.013   5.880 -15.069
   26    H    GLY   5           H        GLY   5   0.220   5.944 -11.103
   27    HA2  GLY   5          2HA       GLY   5  -0.872   6.359  -9.097
   28    HA3  GLY   5          1HA       GLY   5   0.692   6.543  -8.314
   29    H    HIS   6           H        HIS   6   0.239   8.456  -7.250
   30    HA   HIS   6           HA       HIS   6   0.119  10.810  -8.986
   31    HB2  HIS   6          2HB       HIS   6  -1.689  10.286  -6.623
   32    HB3  HIS   6          1HB       HIS   6  -1.438  11.890  -7.299
   33    HD1  HIS   6          1HD       HIS   6  -3.342   8.778  -7.780
   34    HD2  HIS   6          2HD       HIS   6  -2.475  12.210  -9.956
   35    HE1  HIS   6          1HE       HIS   6  -5.013   8.826  -9.656
   36    HE2  HIS   6          2HE       HIS   6  -4.602  11.022 -10.821
   37    H    MET   7           H        MET   7   1.332  12.499  -8.306
   38    HA   MET   7           HA       MET   7   3.129  12.068  -6.093
   39    HB2  MET   7          2HB       MET   7   3.946  13.140  -8.151
   40    HB3  MET   7          1HB       MET   7   2.800  14.455  -7.928
   41    HG2  MET   7          2HG       MET   7   3.921  15.089  -5.856
   42    HG3  MET   7          1HG       MET   7   5.067  13.768  -6.071
   43    HE1  MET   7          1HE       MET   7   3.737  17.156  -7.462
   44    HE2  MET   7          2HE       MET   7   3.625  16.156  -8.909
   45    HE3  MET   7          3HE       MET   7   4.807  17.460  -8.830
   46    H    VAL   8           H        VAL   8   2.240  12.269  -4.142
   47    HA   VAL   8           HA       VAL   8   0.800  14.733  -3.531
   48    HB   VAL   8           HB       VAL   8  -0.894  13.010  -3.933
   49   HG11  VAL   8          1HG1      VAL   8  -1.144  11.086  -2.427
   50   HG12  VAL   8          2HG1      VAL   8   0.432  11.452  -1.729
   51   HG13  VAL   8          3HG1      VAL   8   0.305  11.003  -3.429
   52   HG21  VAL   8          1HG2      VAL   8  -1.471  14.715  -2.362
   53   HG22  VAL   8          2HG2      VAL   8  -0.663  13.862  -1.050
   54   HG23  VAL   8          3HG2      VAL   8  -2.115  13.181  -1.782
   55    H    LYS   9           H        LYS   9   0.588  12.895  -0.882
   56    HA   LYS   9           HA       LYS   9   3.016  13.918   0.264
   57    HB2  LYS   9          2HB       LYS   9   0.946  12.052   1.477
   58    HB3  LYS   9          1HB       LYS   9   2.246  12.873   2.340
   59    HG2  LYS   9          2HG       LYS   9   0.011  14.240   0.873
   60    HG3  LYS   9          1HG       LYS   9   0.081  13.965   2.607
   61    HD2  LYS   9          2HD       LYS   9   2.094  15.338   2.752
   62    HD3  LYS   9          1HD       LYS   9   2.045  15.596   1.007
   63    HE2  LYS   9          2HE       LYS   9  -0.110  16.712   1.224
   64    HE3  LYS   9          1HE       LYS   9  -0.096  16.422   2.963
   65    HZ1  LYS   9          1HZ       LYS   9   0.606  18.675   2.411
   66    HZ2  LYS   9          2HZ       LYS   9   1.880  18.070   1.480
   67    HZ3  LYS   9          3HZ       LYS   9   1.860  17.816   3.151
   68    H    ILE  10           H        ILE  10   3.679  12.365  -1.864
   69    HA   ILE  10           HA       ILE  10   4.856  10.013  -0.586
   70    HB   ILE  10           HB       ILE  10   3.964  10.244  -3.463
   71   HG12  ILE  10          2HG1      ILE  10   2.956   8.491  -1.213
   72   HG13  ILE  10          1HG1      ILE  10   2.106   9.873  -1.896
   73   HG21  ILE  10          1HG2      ILE  10   4.716   7.959  -3.727
   74   HG22  ILE  10          2HG2      ILE  10   5.231   7.901  -2.044
   75   HG23  ILE  10          3HG2      ILE  10   6.060   8.962  -3.183
   76   HD11  ILE  10          1HD1      ILE  10   2.857   7.407  -3.442
   77   HD12  ILE  10          2HD1      ILE  10   1.848   8.746  -3.992
   78   HD13  ILE  10          3HD1      ILE  10   1.287   7.688  -2.697
   79    H    SER  11           H        SER  11   6.828  10.883  -0.143
   80    HA   SER  11           HA       SER  11   8.425  11.810  -2.415
   81    HB2  SER  11          2HB       SER  11   8.544  12.960  -0.153
   82    HB3  SER  11          1HB       SER  11   9.276  11.482   0.478
   83    HG   SER  11           HG       SER  11  10.289  13.261  -1.477
   84    H    HIS  12           H        HIS  12  10.877  10.692  -1.943
   85    HA   HIS  12           HA       HIS  12  10.718   8.106  -2.970
   86    HB2  HIS  12          2HB       HIS  12  12.900   9.184  -1.179
   87    HB3  HIS  12          1HB       HIS  12  13.052   7.832  -2.293
   88    HD1  HIS  12          1HD       HIS  12  13.955  11.229  -2.054
   89    HD2  HIS  12          2HD       HIS  12  12.423   8.866  -5.116
   90    HE1  HIS  12          1HE       HIS  12  14.525  12.431  -4.187
   91    HE2  HIS  12          2HE       HIS  12  13.724  10.908  -6.029
   92    H    GLU  13           H        GLU  13  11.130   9.246   0.310
   93    HA   GLU  13           HA       GLU  13  11.337   6.777   1.588
   94    HB2  GLU  13          2HB       GLU  13  10.803   8.049   3.645
   95    HB3  GLU  13          1HB       GLU  13  12.035   8.825   2.638
   96    HG2  GLU  13          2HG       GLU  13  10.332  10.348   1.741
   97    HG3  GLU  13          1HG       GLU  13   9.127   9.602   2.789
   98    H    ASP  14           H        ASP  14   8.468   8.702   0.730
   99    HA   ASP  14           HA       ASP  14   6.760   7.284   2.499
  100    HB2  ASP  14          2HB       ASP  14   6.129   9.033   0.144
  101    HB3  ASP  14          1HB       ASP  14   4.932   8.422   1.287
  102    H    THR  15           H        THR  15   7.312   7.060  -1.019
  103    HA   THR  15           HA       THR  15   5.412   5.038  -1.471
  104    HB   THR  15           HB       THR  15   7.598   4.571  -3.191
  105    HG1  THR  15          1HG       THR  15   7.042   7.292  -3.404
  106   HG21  THR  15          1HG2      THR  15   6.078   5.633  -4.869
  107   HG22  THR  15          2HG2      THR  15   4.990   6.028  -3.536
  108   HG23  THR  15          3HG2      THR  15   5.347   4.344  -3.916
  109    H    GLN  16           H        GLN  16   8.826   4.913  -0.536
  110    HA   GLN  16           HA       GLN  16   9.119   2.123  -0.485
  111    HB2  GLN  16          2HB       GLN  16  10.408   4.237   1.251
  112    HB3  GLN  16          1HB       GLN  16  10.892   2.547   1.239
  113    HG2  GLN  16          2HG       GLN  16  11.500   2.727  -1.109
  114    HG3  GLN  16          1HG       GLN  16  10.990   4.414  -1.116
  115   HE21  GLN  16          1HE2      GLN  16  12.217   5.941  -0.060
  116   HE22  GLN  16          2HE2      GLN  16  13.852   5.641   0.417
  117    H    ARG  17           H        ARG  17   7.903   4.411   1.893
  118    HA   ARG  17           HA       ARG  17   7.591   2.671   4.062
  119    HB2  ARG  17          2HB       ARG  17   6.307   5.249   3.242
  120    HB3  ARG  17          1HB       ARG  17   5.664   4.368   4.617
  121    HG2  ARG  17          2HG       ARG  17   7.413   4.887   5.940
  122    HG3  ARG  17          1HG       ARG  17   8.574   4.828   4.615
  123    HD2  ARG  17          2HD       ARG  17   8.075   6.990   3.910
  124    HD3  ARG  17          1HD       ARG  17   6.539   7.025   4.786
  125    HE   ARG  17           HE       ARG  17   8.837   6.792   6.501
  126   HH11  ARG  17          1HH1      ARG  17   6.793   9.069   4.770
  127   HH12  ARG  17          2HH1      ARG  17   7.176  10.386   5.829
  128   HH21  ARG  17          1HH2      ARG  17   9.327   8.549   7.882
  129   HH22  ARG  17          2HH2      ARG  17   8.617  10.101   7.576
  130    H    ILE  18           H        ILE  18   5.215   3.690   1.581
  131    HA   ILE  18           HA       ILE  18   3.063   2.293   2.670
  132    HB   ILE  18           HB       ILE  18   3.500   3.002  -0.226
  133   HG12  ILE  18          2HG1      ILE  18   1.631   4.582   1.366
  134   HG13  ILE  18          1HG1      ILE  18   3.281   4.673   1.976
  135   HG21  ILE  18          1HG2      ILE  18   1.015   2.274   1.323
  136   HG22  ILE  18          2HG2      ILE  18   1.771   1.334   0.032
  137   HG23  ILE  18          3HG2      ILE  18   1.030   2.894  -0.330
  138   HD11  ILE  18          1HD1      ILE  18   4.075   5.421  -0.142
  139   HD12  ILE  18          2HD1      ILE  18   2.733   6.447   0.370
  140   HD13  ILE  18          3HD1      ILE  18   2.480   5.212  -0.866
  141    H    LYS  19           H        LYS  19   5.299   1.251   0.072
  142    HA   LYS  19           HA       LYS  19   4.001  -1.213  -0.418
  143    HB2  LYS  19          2HB       LYS  19   6.974  -0.810  -0.645
  144    HB3  LYS  19          1HB       LYS  19   5.943  -1.882  -1.585
  145    HG2  LYS  19          2HG       LYS  19   4.931  -0.061  -2.748
  146    HG3  LYS  19          1HG       LYS  19   5.750   1.113  -1.724
  147    HD2  LYS  19          2HD       LYS  19   6.843   0.996  -3.864
  148    HD3  LYS  19          1HD       LYS  19   7.917   0.343  -2.632
  149    HE2  LYS  19          2HE       LYS  19   6.149  -1.392  -4.302
  150    HE3  LYS  19          1HE       LYS  19   7.721  -0.866  -4.881
  151    HZ1  LYS  19          1HZ       LYS  19   8.679  -1.862  -2.821
  152    HZ2  LYS  19          2HZ       LYS  19   8.005  -2.982  -3.899
  153    HZ3  LYS  19          3HZ       LYS  19   7.161  -2.545  -2.503
  154    H    THR  20           H        THR  20   6.758  -0.338   1.603
  155    HA   THR  20           HA       THR  20   7.489  -2.955   2.127
  156    HB   THR  20           HB       THR  20   8.998  -0.975   2.365
  157    HG1  THR  20          1HG       THR  20  10.024  -2.581   3.297
  158   HG21  THR  20          1HG2      THR  20   9.019   0.202   4.538
  159   HG22  THR  20          2HG2      THR  20   7.523  -0.627   4.975
  160   HG23  THR  20          3HG2      THR  20   7.537   0.506   3.626
  161    H    ALA  21           H        ALA  21   5.384  -0.744   3.862
  162    HA   ALA  21           HA       ALA  21   5.210  -2.407   6.159
  163    HB1  ALA  21          1HB       ALA  21   4.828  -0.003   6.296
  164    HB2  ALA  21          2HB       ALA  21   3.420  -0.898   6.868
  165    HB3  ALA  21          3HB       ALA  21   3.409  -0.165   5.262
  166    H    PHE  22           H        PHE  22   2.845  -1.556   3.664
  167    HA   PHE  22           HA       PHE  22   0.730  -3.158   4.260
  168    HB2  PHE  22          2HB       PHE  22   0.325  -1.861   2.479
  169    HB3  PHE  22          1HB       PHE  22   1.968  -1.943   1.893
  170    HD1  PHE  22          1HD       PHE  22  -1.208  -3.824   1.967
  171    HD2  PHE  22          2HD       PHE  22   2.440  -3.082  -0.043
  172    HE1  PHE  22          1HE       PHE  22  -2.059  -5.084  -0.016
  173    HE2  PHE  22          2HE       PHE  22   1.651  -4.361  -1.982
  174    HZ   PHE  22           HZ       PHE  22  -0.598  -5.360  -1.970
  175    H    LEU  23           H        LEU  23   3.420  -4.262   2.150
  176    HA   LEU  23           HA       LEU  23   2.486  -6.890   1.871
  177    HB2  LEU  23          2HB       LEU  23   5.337  -5.918   1.805
  178    HB3  LEU  23          1HB       LEU  23   4.719  -7.389   1.072
  179    HG   LEU  23           HG       LEU  23   3.637  -4.708   0.275
  180   HD11  LEU  23          1HD1      LEU  23   6.060  -4.579   0.044
  181   HD12  LEU  23          2HD1      LEU  23   5.274  -4.653  -1.534
  182   HD13  LEU  23          3HD1      LEU  23   6.059  -6.085  -0.874
  183   HD21  LEU  23          1HD2      LEU  23   3.246  -5.957  -1.843
  184   HD22  LEU  23          2HD2      LEU  23   2.352  -6.575  -0.454
  185   HD23  LEU  23          3HD2      LEU  23   3.797  -7.419  -1.026
  186    H    SER  24           H        SER  24   5.100  -5.666   4.004
  187    HA   SER  24           HA       SER  24   5.690  -8.177   5.111
  188    HB2  SER  24          2HB       SER  24   7.327  -6.521   5.094
  189    HB3  SER  24          1HB       SER  24   6.341  -5.408   6.038
  190    HG   SER  24           HG       SER  24   6.444  -7.373   7.601
  191    H    TYR  25           H        TYR  25   3.378  -5.769   5.921
  192    HA   TYR  25           HA       TYR  25   3.032  -6.450   8.641
  193    HB2  TYR  25          2HB       TYR  25   1.571  -4.738   6.665
  194    HB3  TYR  25          1HB       TYR  25   0.697  -5.255   8.118
  195    HD1  TYR  25          1HD       TYR  25   4.216  -4.152   7.481
  196    HD2  TYR  25          2HD       TYR  25   0.651  -3.594   9.724
  197    HE1  TYR  25          1HE       TYR  25   5.330  -2.406   8.778
  198    HE2  TYR  25          2HE       TYR  25   1.754  -1.836  11.045
  199    HH   TYR  25           HH       TYR  25   4.125  -1.226  11.675
  200    H    ALA  26           H        ALA  26   1.162  -7.272   5.712
  201    HA   ALA  26           HA       ALA  26  -0.667  -8.846   7.248
  202    HB1  ALA  26          1HB       ALA  26  -1.665  -9.432   5.181
  203    HB2  ALA  26          2HB       ALA  26  -0.215  -8.980   4.284
  204    HB3  ALA  26          3HB       ALA  26  -1.183  -7.740   5.083
  205    H    GLN  27           H        GLN  27   1.476  -9.994   4.591
  206    HA   GLN  27           HA       GLN  27   1.795 -12.440   6.195
  207    HB2  GLN  27          2HB       GLN  27   2.228 -12.624   3.272
  208    HB3  GLN  27          1HB       GLN  27   1.603 -13.827   4.392
  209    HG2  GLN  27          2HG       GLN  27  -0.241 -13.384   3.102
  210    HG3  GLN  27          1HG       GLN  27  -0.506 -12.258   4.443
  211   HE21  GLN  27          1HE2      GLN  27  -1.359 -12.163   1.595
  212   HE22  GLN  27          2HE2      GLN  27  -0.769 -10.637   1.025
  213    H    GLY  28           H        GLY  28   3.361  -9.946   4.400
  214    HA2  GLY  28          2HA       GLY  28   5.714  -9.677   4.172
  215    HA3  GLY  28          1HA       GLY  28   5.922 -11.381   4.539
  216    H    GLN  29           H        GLN  29   3.498 -11.752   2.610
  217    HA   GLN  29           HA       GLN  29   5.078 -12.387   0.306
  218    HB2  GLN  29          2HB       GLN  29   2.076 -12.445   0.600
  219    HB3  GLN  29          1HB       GLN  29   3.044 -13.330  -0.572
  220    HG2  GLN  29          2HG       GLN  29   4.052 -14.630   1.204
  221    HG3  GLN  29          1HG       GLN  29   3.150 -13.707   2.405
  222   HE21  GLN  29          1HE2      GLN  29   0.742 -13.650   0.690
  223   HE22  GLN  29          2HE2      GLN  29   0.059 -15.233   0.798
  224    H    ASP  30           H        ASP  30   3.246 -11.906  -1.779
  225    HA   ASP  30           HA       ASP  30   4.081  -9.187  -2.397
  226    HB2  ASP  30          2HB       ASP  30   2.689 -11.161  -4.213
  227    HB3  ASP  30          1HB       ASP  30   3.581  -9.723  -4.691
  228    H    LYS  31           H        LYS  31   1.543 -10.218  -0.819
  229    HA   LYS  31           HA       LYS  31  -0.258  -8.215  -1.929
  230    HB2  LYS  31          2HB       LYS  31  -0.941 -11.125  -1.504
  231    HB3  LYS  31          1HB       LYS  31  -2.172  -9.871  -1.509
  232    HG2  LYS  31          2HG       LYS  31  -0.861  -9.326  -3.818
  233    HG3  LYS  31          1HG       LYS  31  -0.702 -11.073  -3.736
  234    HD2  LYS  31          2HD       LYS  31  -3.283  -9.525  -3.518
  235    HD3  LYS  31          1HD       LYS  31  -2.728 -10.398  -4.946
  236    HE2  LYS  31          2HE       LYS  31  -3.201 -11.676  -2.273
  237    HE3  LYS  31          1HE       LYS  31  -4.430 -11.515  -3.519
  238    HZ1  LYS  31          1HZ       LYS  31  -1.848 -12.945  -3.841
  239    HZ2  LYS  31          2HZ       LYS  31  -3.070 -12.835  -5.003
  240    HZ3  LYS  31          3HZ       LYS  31  -3.341 -13.690  -3.570
  241    H    VAL  32           H        VAL  32  -2.344  -8.424  -0.262
  242    HA   VAL  32           HA       VAL  32  -1.248  -8.846   2.421
  243    HB   VAL  32           HB       VAL  32  -2.499  -6.355   1.392
  244   HG11  VAL  32          1HG1      VAL  32  -2.916  -5.693   3.772
  245   HG12  VAL  32          2HG1      VAL  32  -2.800  -7.403   4.188
  246   HG13  VAL  32          3HG1      VAL  32  -4.065  -6.846   3.099
  247   HG21  VAL  32          1HG2      VAL  32  -0.848  -5.441   2.975
  248   HG22  VAL  32          2HG2      VAL  32  -0.162  -6.419   1.678
  249   HG23  VAL  32          3HG2      VAL  32  -0.322  -7.091   3.302
  250    H    THR  33           H        THR  33  -2.462  -9.967   3.748
  251    HA   THR  33           HA       THR  33  -5.011 -10.949   3.002
  252    HB   THR  33           HB       THR  33  -5.094 -11.628   5.462
  253    HG1  THR  33          1HG       THR  33  -3.422 -11.105   6.741
  254   HG21  THR  33          1HG2      THR  33  -4.257 -13.143   3.724
  255   HG22  THR  33          2HG2      THR  33  -3.351 -13.333   5.226
  256   HG23  THR  33          3HG2      THR  33  -2.650 -12.433   3.881
  257    H    GLU  34           H        GLU  34  -6.968 -10.485   4.325
  258    HA   GLU  34           HA       GLU  34  -7.483  -7.832   3.609
  259    HB2  GLU  34          2HB       GLU  34  -9.134  -9.466   3.275
  260    HB3  GLU  34          1HB       GLU  34  -9.246  -9.818   5.005
  261    HG2  GLU  34          2HG       GLU  34 -10.236  -7.686   5.435
  262    HG3  GLU  34          1HG       GLU  34  -9.915  -7.145   3.788
  263    H    ALA  35           H        ALA  35  -6.530  -9.056   6.636
  264    HA   ALA  35           HA       ALA  35  -7.783  -7.306   8.433
  265    HB1  ALA  35          1HB       ALA  35  -6.008  -7.908   9.993
  266    HB2  ALA  35          2HB       ALA  35  -5.072  -8.608   8.673
  267    HB3  ALA  35          3HB       ALA  35  -6.610  -9.334   9.148
  268    H    MET  36           H        MET  36  -4.505  -7.148   6.993
  269    HA   MET  36           HA       MET  36  -3.964  -4.550   7.951
  270    HB2  MET  36          2HB       MET  36  -2.755  -6.321   5.879
  271    HB3  MET  36          1HB       MET  36  -2.302  -4.635   5.917
  272    HG2  MET  36          2HG       MET  36  -2.067  -6.567   8.201
  273    HG3  MET  36          1HG       MET  36  -0.744  -5.999   7.179
  274    HE1  MET  36          1HE       MET  36  -0.328  -3.322   6.852
  275    HE2  MET  36          2HE       MET  36  -0.982  -2.101   7.942
  276    HE3  MET  36          3HE       MET  36  -2.050  -2.943   6.817
  277    H    ILE  37           H        ILE  37  -5.791  -5.806   5.318
  278    HA   ILE  37           HA       ILE  37  -5.662  -3.445   3.707
  279    HB   ILE  37           HB       ILE  37  -7.177  -5.944   3.658
  280   HG12  ILE  37          2HG1      ILE  37  -5.654  -6.197   2.052
  281   HG13  ILE  37          1HG1      ILE  37  -6.487  -4.944   1.167
  282   HG21  ILE  37          1HG2      ILE  37  -8.656  -5.061   1.874
  283   HG22  ILE  37          2HG2      ILE  37  -8.151  -3.431   2.318
  284   HG23  ILE  37          3HG2      ILE  37  -9.024  -4.432   3.479
  285   HD11  ILE  37          1HD1      ILE  37  -4.256  -4.427   3.080
  286   HD12  ILE  37          2HD1      ILE  37  -5.061  -3.250   2.037
  287   HD13  ILE  37          3HD1      ILE  37  -4.096  -4.540   1.330
  288    H    ASP  38           H        ASP  38  -7.938  -4.706   6.109
  289    HA   ASP  38           HA       ASP  38  -9.837  -2.702   6.094
  290    HB2  ASP  38          2HB       ASP  38  -9.690  -4.968   7.272
  291    HB3  ASP  38          1HB       ASP  38  -8.850  -4.107   8.553
  292    H    GLN  39           H        GLN  39  -6.682  -2.845   7.703
  293    HA   GLN  39           HA       GLN  39  -7.025  -0.602   9.371
  294    HB2  GLN  39          2HB       GLN  39  -4.840  -0.888   9.965
  295    HB3  GLN  39          1HB       GLN  39  -5.056  -2.418   9.140
  296    HG2  GLN  39          2HG       GLN  39  -3.037  -1.701   8.324
  297    HG3  GLN  39          1HG       GLN  39  -4.131  -1.160   7.067
  298   HE21  GLN  39          1HE2      GLN  39  -2.852   0.489   6.310
  299   HE22  GLN  39          2HE2      GLN  39  -2.501   1.904   7.241
  300    H    LEU  40           H        LEU  40  -5.787  -0.948   6.091
  301    HA   LEU  40           HA       LEU  40  -5.296   1.810   5.695
  302    HB2  LEU  40          2HB       LEU  40  -4.251   0.161   4.279
  303    HB3  LEU  40          1HB       LEU  40  -5.821  -0.392   3.687
  304    HG   LEU  40           HG       LEU  40  -5.832   2.299   3.090
  305   HD11  LEU  40          1HD1      LEU  40  -3.232   1.556   1.999
  306   HD12  LEU  40          2HD1      LEU  40  -3.249   1.749   3.753
  307   HD13  LEU  40          3HD1      LEU  40  -3.775   3.082   2.714
  308   HD21  LEU  40          1HD2      LEU  40  -6.613   0.544   1.612
  309   HD22  LEU  40          2HD2      LEU  40  -4.960  -0.031   1.382
  310   HD23  LEU  40          3HD2      LEU  40  -5.434   1.553   0.770
  311    H    ILE  41           H        ILE  41  -7.997  -0.267   4.611
  312    HA   ILE  41           HA       ILE  41  -9.382   1.749   3.265
  313    HB   ILE  41           HB       ILE  41 -10.390  -0.795   4.529
  314   HG12  ILE  41          2HG1      ILE  41  -8.748  -0.722   2.520
  315   HG13  ILE  41          1HG1      ILE  41 -10.159  -1.763   2.409
  316   HG21  ILE  41          1HG2      ILE  41 -11.873   1.116   2.726
  317   HG22  ILE  41          2HG2      ILE  41 -12.250   0.751   4.410
  318   HG23  ILE  41          3HG2      ILE  41 -12.427  -0.497   3.176
  319   HD11  ILE  41          1HD1      ILE  41  -9.937   0.988   1.210
  320   HD12  ILE  41          2HD1      ILE  41 -11.277  -0.148   1.007
  321   HD13  ILE  41          3HD1      ILE  41  -9.687  -0.525   0.341
  322    H    CYS  42           H        CYS  42  -9.707   0.694   6.652
  323    HA   CYS  42           HA       CYS  42 -11.881   2.472   7.186
  324    HB2  CYS  42          2HB       CYS  42 -11.540   0.445   8.525
  325    HB3  CYS  42          1HB       CYS  42  -9.994   1.067   9.093
  326    HG   CYS  42           HG       CYS  42 -11.664   3.437  10.053
  327    H    GLY  43           H        GLY  43  -8.490   2.750   6.999
  328    HA2  GLY  43          2HA       GLY  43  -7.879   4.887   8.645
  329    HA3  GLY  43          1HA       GLY  43  -7.114   4.571   7.097
  330    H    ALA  44           H        ALA  44  -9.025   5.128   5.246
  331    HA   ALA  44           HA       ALA  44  -9.280   8.014   5.592
  332    HB1  ALA  44          1HB       ALA  44  -8.370   7.067   3.482
  333    HB2  ALA  44          2HB       ALA  44  -9.756   8.132   3.248
  334    HB3  ALA  44          3HB       ALA  44  -9.962   6.384   3.152
  335    H    PHE  45           H        PHE  45 -11.347   5.188   5.144
  336    HA   PHE  45           HA       PHE  45 -13.625   6.788   5.989
  337    HB2  PHE  45          2HB       PHE  45 -14.811   5.271   4.095
  338    HB3  PHE  45          1HB       PHE  45 -14.409   6.982   3.950
  339    HD1  PHE  45          1HD       PHE  45 -12.576   3.762   3.655
  340    HD2  PHE  45          2HD       PHE  45 -13.474   7.521   1.901
  341    HE1  PHE  45          1HE       PHE  45 -11.139   3.201   1.735
  342    HE2  PHE  45          2HE       PHE  45 -12.026   6.981  -0.013
  343    HZ   PHE  45           HZ       PHE  45 -10.848   4.815  -0.095
  344    HA   PRO  46           HA       PRO  46 -14.509   2.862   7.831
  345    HB2  PRO  46          2HB       PRO  46 -15.509   3.877  10.099
  346    HB3  PRO  46          1HB       PRO  46 -13.780   3.779   9.796
  347    HG2  PRO  46          2HG       PRO  46 -15.562   6.143   9.755
  348    HG3  PRO  46          1HG       PRO  46 -13.828   6.051  10.103
  349    HD2  PRO  46          2HD       PRO  46 -15.071   6.786   7.626
  350    HD3  PRO  46          1HD       PRO  46 -13.338   6.585   7.951
  351    H    GLY  47           H        GLY  47 -16.722   2.422   9.222
  352    HA2  GLY  47          2HA       GLY  47 -19.032   2.344   9.205
  353    HA3  GLY  47          1HA       GLY  47 -19.034   3.767   8.177
  354    H    LEU  48           H        LEU  48 -17.174   1.001   7.269
  355    HA   LEU  48           HA       LEU  48 -19.010   0.528   5.035
  356    HB2  LEU  48          2HB       LEU  48 -16.158  -0.347   5.479
  357    HB3  LEU  48          1HB       LEU  48 -17.116  -0.785   4.078
  358    HG   LEU  48           HG       LEU  48 -16.180   1.981   4.840
  359   HD11  LEU  48          1HD1      LEU  48 -15.531   0.169   2.520
  360   HD12  LEU  48          2HD1      LEU  48 -14.463   0.576   3.863
  361   HD13  LEU  48          3HD1      LEU  48 -14.958   1.826   2.721
  362   HD21  LEU  48          1HD2      LEU  48 -17.920   1.114   2.536
  363   HD22  LEU  48          2HD2      LEU  48 -17.224   2.718   2.748
  364   HD23  LEU  48          3HD2      LEU  48 -18.418   2.117   3.896
  365    H    SER  49           H        SER  49 -20.274  -1.226   5.007
  366    HA   SER  49           HA       SER  49 -19.954  -3.343   6.918
  367    HB2  SER  49          2HB       SER  49 -22.183  -2.665   6.020
  368    HB3  SER  49          1HB       SER  49 -21.687  -3.255   4.432
  369    HG   SER  49           HG       SER  49 -22.944  -4.706   5.899
  370    H    TRP  50           H        TRP  50 -19.537  -5.647   6.229
  371    HA   TRP  50           HA       TRP  50 -17.082  -5.698   4.909
  372    HB2  TRP  50          2HB       TRP  50 -17.812  -7.467   6.502
  373    HB3  TRP  50          1HB       TRP  50 -18.889  -8.090   5.252
  374    HD1  TRP  50           HD       TRP  50 -15.102  -7.303   5.517
  375    HE1  TRP  50          1HE       TRP  50 -13.845  -9.128   4.203
  376    HE3  TRP  50          3HE       TRP  50 -19.122  -9.970   3.848
  377    HZ2  TRP  50          2HZ       TRP  50 -14.515 -11.394   2.690
  378    HZ3  TRP  50          3HZ       TRP  50 -18.720 -11.958   2.456
  379    HH2  TRP  50           HH       TRP  50 -16.452 -12.662   1.892
  380    H    GLU  51           H        GLU  51 -20.295  -6.537   3.698
  381    HA   GLU  51           HA       GLU  51 -19.604  -7.429   1.168
  382    HB2  GLU  51          2HB       GLU  51 -22.005  -5.909   2.157
  383    HB3  GLU  51          1HB       GLU  51 -21.867  -6.427   0.483
  384    HG2  GLU  51          2HG       GLU  51 -21.680  -8.297   2.823
  385    HG3  GLU  51          1HG       GLU  51 -23.168  -7.954   1.969
  386    H    GLN  52           H        GLN  52 -20.288  -4.097   2.180
  387    HA   GLN  52           HA       GLN  52 -19.830  -2.856  -0.285
  388    HB2  GLN  52          2HB       GLN  52 -20.961  -1.691   1.486
  389    HB3  GLN  52          1HB       GLN  52 -19.567  -1.832   2.542
  390    HG2  GLN  52          2HG       GLN  52 -19.763   0.415   1.699
  391    HG3  GLN  52          1HG       GLN  52 -18.304  -0.346   1.071
  392   HE21  GLN  52          1HE2      GLN  52 -18.163  -0.826  -1.113
  393   HE22  GLN  52          2HE2      GLN  52 -19.247  -0.143  -2.273
  394    H    LEU  53           H        LEU  53 -17.592  -3.725   2.306
  395    HA   LEU  53           HA       LEU  53 -15.451  -2.198   1.165
  396    HB2  LEU  53          2HB       LEU  53 -15.480  -2.496   3.549
  397    HB3  LEU  53          1HB       LEU  53 -15.515  -4.237   3.382
  398    HG   LEU  53           HG       LEU  53 -13.168  -2.775   2.246
  399   HD11  LEU  53          1HD1      LEU  53 -12.046  -2.789   4.407
  400   HD12  LEU  53          2HD1      LEU  53 -13.502  -3.414   5.184
  401   HD13  LEU  53          3HD1      LEU  53 -13.499  -1.793   4.491
  402   HD21  LEU  53          1HD2      LEU  53 -13.482  -5.410   3.688
  403   HD22  LEU  53          2HD2      LEU  53 -12.000  -4.799   2.946
  404   HD23  LEU  53          3HD2      LEU  53 -13.398  -5.183   1.939
  405    H    GLN  54           H        GLN  54 -16.408  -5.595   1.232
  406    HA   GLN  54           HA       GLN  54 -13.980  -6.440   0.023
  407    HB2  GLN  54          2HB       GLN  54 -14.836  -8.607   0.071
  408    HB3  GLN  54          1HB       GLN  54 -15.509  -7.822   1.476
  409    HG2  GLN  54          2HG       GLN  54 -17.619  -8.018   0.755
  410    HG3  GLN  54          1HG       GLN  54 -17.186  -7.699  -0.924
  411   HE21  GLN  54          1HE2      GLN  54 -18.903  -9.784   0.302
  412   HE22  GLN  54          2HE2      GLN  54 -18.247 -11.286  -0.262
  413    H    GLU  55           H        GLU  55 -17.137  -5.454  -1.176
  414    HA   GLU  55           HA       GLU  55 -16.701  -6.320  -3.855
  415    HB2  GLU  55          2HB       GLU  55 -18.612  -4.976  -4.462
  416    HB3  GLU  55          1HB       GLU  55 -18.957  -5.835  -2.972
  417    HG2  GLU  55          2HG       GLU  55 -19.726  -3.858  -2.295
  418    HG3  GLU  55          1HG       GLU  55 -18.052  -3.496  -1.990
  419    H    LYS  56           H        LYS  56 -15.911  -3.438  -2.045
  420    HA   LYS  56           HA       LYS  56 -14.921  -1.754  -3.982
  421    HB2  LYS  56          2HB       LYS  56 -14.423  -2.231  -1.146
  422    HB3  LYS  56          1HB       LYS  56 -12.930  -1.795  -1.984
  423    HG2  LYS  56          2HG       LYS  56 -13.951   0.231  -2.825
  424    HG3  LYS  56          1HG       LYS  56 -15.518  -0.241  -2.172
  425    HD2  LYS  56          2HD       LYS  56 -14.609  -0.109   0.091
  426    HD3  LYS  56          1HD       LYS  56 -13.042   0.384  -0.568
  427    HE2  LYS  56          2HE       LYS  56 -14.394   2.258  -1.726
  428    HE3  LYS  56          1HE       LYS  56 -15.644   1.870  -0.543
  429    HZ1  LYS  56          1HZ       LYS  56 -14.230   3.661   0.216
  430    HZ2  LYS  56          2HZ       LYS  56 -12.862   2.677   0.079
  431    HZ3  LYS  56          3HZ       LYS  56 -14.058   2.308   1.217
  432    H    LYS  57           H        LYS  57 -13.348  -4.425  -2.430
  433    HA   LYS  57           HA       LYS  57 -11.032  -4.218  -4.182
  434    HB2  LYS  57          2HB       LYS  57 -10.900  -6.263  -2.147
  435    HB3  LYS  57          1HB       LYS  57  -9.921  -4.806  -2.331
  436    HG2  LYS  57          2HG       LYS  57 -11.820  -3.504  -1.319
  437    HG3  LYS  57          1HG       LYS  57 -12.594  -5.048  -0.991
  438    HD2  LYS  57          2HD       LYS  57  -9.938  -4.174   0.113
  439    HD3  LYS  57          1HD       LYS  57 -11.479  -4.231   0.975
  440    HE2  LYS  57          2HE       LYS  57  -9.958  -6.577  -0.138
  441    HE3  LYS  57          1HE       LYS  57 -10.177  -6.156   1.552
  442    HZ1  LYS  57          1HZ       LYS  57 -12.152  -7.247  -0.332
  443    HZ2  LYS  57          2HZ       LYS  57 -12.657  -6.346   1.004
  444    HZ3  LYS  57          3HZ       LYS  57 -11.766  -7.764   1.242
  445    H    LYS  58           H        LYS  58 -13.870  -5.632  -4.564
  446    HA   LYS  58           HA       LYS  58 -13.323  -8.316  -5.189
  447    HB2  LYS  58          2HB       LYS  58 -15.424  -6.354  -5.940
  448    HB3  LYS  58          1HB       LYS  58 -15.251  -7.764  -6.975
  449    HG2  LYS  58          2HG       LYS  58 -15.598  -7.953  -3.998
  450    HG3  LYS  58          1HG       LYS  58 -16.950  -7.939  -5.131
  451    HD2  LYS  58          2HD       LYS  58 -15.999  -9.924  -6.242
  452    HD3  LYS  58          1HD       LYS  58 -14.699  -9.948  -5.050
  453    HE2  LYS  58          2HE       LYS  58 -16.266 -10.339  -3.271
  454    HE3  LYS  58          1HE       LYS  58 -17.630 -10.134  -4.370
  455    HZ1  LYS  58          1HZ       LYS  58 -16.966 -12.115  -5.542
  456    HZ2  LYS  58          2HZ       LYS  58 -17.144 -12.468  -3.901
  457    HZ3  LYS  58          3HZ       LYS  58 -15.602 -12.292  -4.563
  458    H    GLY  59           H        GLY  59 -11.994  -9.122  -6.640
  459    HA2  GLY  59          2HA       GLY  59 -11.544  -9.114  -9.132
  460    HA3  GLY  59          1HA       GLY  59 -11.170  -7.412  -8.888
  461    H    ARG  60           H        ARG  60  -9.219  -6.825  -8.213
  462    HA   ARG  60           HA       ARG  60  -7.155  -8.813  -8.156
  463    HB2  ARG  60          2HB       ARG  60  -5.736  -6.692  -7.598
  464    HB3  ARG  60          1HB       ARG  60  -6.352  -6.978  -9.216
  465    HG2  ARG  60          2HG       ARG  60  -6.572  -4.657  -8.424
  466    HG3  ARG  60          1HG       ARG  60  -8.088  -5.387  -8.919
  467    HD2  ARG  60          2HD       ARG  60  -8.739  -5.716  -6.637
  468    HD3  ARG  60          1HD       ARG  60  -7.158  -5.225  -6.065
  469    HE   ARG  60           HE       ARG  60  -7.669  -2.966  -6.835
  470   HH11  ARG  60          1HH1      ARG  60 -10.415  -5.131  -6.644
  471   HH12  ARG  60          2HH1      ARG  60 -11.545  -3.861  -6.306
  472   HH21  ARG  60          1HH2      ARG  60  -9.153  -1.311  -6.386
  473   HH22  ARG  60          2HH2      ARG  60 -10.828  -1.697  -6.152
  474    H    ALA  61           H        ALA  61  -9.225  -8.297  -5.853
  475    HA   ALA  61           HA       ALA  61  -7.313  -9.022  -3.784
  476    HB1  ALA  61          1HB       ALA  61  -7.693  -6.502  -3.747
  477    HB2  ALA  61          2HB       ALA  61  -7.895  -7.369  -2.227
  478    HB3  ALA  61          3HB       ALA  61  -9.308  -6.871  -3.162
  479    H    ALA  62           H        ALA  62  -9.511 -10.206  -5.366
  480    HA   ALA  62           HA       ALA  62 -11.755 -10.572  -3.640
  481    HB1  ALA  62          1HB       ALA  62 -12.466 -12.231  -5.288
  482    HB2  ALA  62          2HB       ALA  62 -10.894 -12.120  -6.078
  483    HB3  ALA  62          3HB       ALA  62 -11.970 -10.724  -6.057
  484    H    ALA  63           H        ALA  63 -12.375 -12.492  -2.596
  485    HA   ALA  63           HA       ALA  63 -12.073 -14.175  -1.117
  486    HB1  ALA  63          1HB       ALA  63  -9.717 -14.922  -2.838
  487    HB2  ALA  63          2HB       ALA  63 -11.378 -15.468  -3.067
  488    HB3  ALA  63          3HB       ALA  63 -10.485 -15.941  -1.621
  489    H    ASN  64           H        ASN  64 -10.701 -11.568  -0.944
  490    HA   ASN  64           HA       ASN  64  -9.651 -10.447   0.696
  491    HB2  ASN  64          2HB       ASN  64  -9.450 -13.138   2.049
  492    HB3  ASN  64          1HB       ASN  64  -9.086 -11.587   2.809
  493   HD21  ASN  64          1HD2      ASN  64 -11.202 -10.348   1.136
  494   HD22  ASN  64          2HD2      ASN  64 -12.689 -10.743   1.930
  495    H    GLY  65           H        GLY  65  -8.092  -9.750  -0.479
  496    HA2  GLY  65          2HA       GLY  65  -5.471 -10.176   0.341
  497    HA3  GLY  65          1HA       GLY  65  -5.707 -11.217  -1.047
  498    H    TYR  66           H        TYR  66  -5.727  -7.842   0.052
  499    HA   TYR  66           HA       TYR  66  -5.842  -6.672  -2.517
  500    HB2  TYR  66          2HB       TYR  66  -5.404  -5.663   0.056
  501    HB3  TYR  66          1HB       TYR  66  -3.983  -5.225  -0.870
  502    HD1  TYR  66          1HD       TYR  66  -5.149  -2.999   0.024
  503    HD2  TYR  66          2HD       TYR  66  -6.566  -5.298  -3.225
  504    HE1  TYR  66          1HE       TYR  66  -6.313  -1.021  -0.835
  505    HE2  TYR  66          2HE       TYR  66  -7.748  -3.351  -4.108
  506    HH   TYR  66           HH       TYR  66  -7.186  -0.206  -2.998
  507    H    ASP  67           H        ASP  67  -4.367  -6.168  -4.015
  508    HA   ASP  67           HA       ASP  67  -1.786  -7.483  -3.730
  509    HB2  ASP  67          2HB       ASP  67  -2.112  -8.259  -5.810
  510    HB3  ASP  67          1HB       ASP  67  -3.751  -7.644  -5.696
  511    H    ARG  68           H        ARG  68  -0.023  -6.403  -4.677
  512    HA   ARG  68           HA       ARG  68   0.351  -3.940  -3.443
  513    HB2  ARG  68          2HB       ARG  68   2.549  -3.935  -4.726
  514    HB3  ARG  68          1HB       ARG  68   2.241  -5.321  -3.691
  515    HG2  ARG  68          2HG       ARG  68   1.396  -6.510  -5.746
  516    HG3  ARG  68          1HG       ARG  68   2.058  -5.171  -6.680
  517    HD2  ARG  68          2HD       ARG  68   4.254  -5.687  -6.085
  518    HD3  ARG  68          1HD       ARG  68   3.748  -6.668  -4.709
  519    HE   ARG  68           HE       ARG  68   2.703  -7.900  -6.939
  520   HH11  ARG  68          1HH1      ARG  68   5.905  -7.059  -5.789
  521   HH12  ARG  68          2HH1      ARG  68   6.672  -8.418  -6.552
  522   HH21  ARG  68          1HH2      ARG  68   3.700  -9.701  -7.920
  523   HH22  ARG  68          2HH2      ARG  68   5.419  -9.918  -7.764
  524    H    SER  69           H        SER  69  -0.495  -4.661  -6.772
  525    HA   SER  69           HA       SER  69   0.001  -2.018  -7.736
  526    HB2  SER  69          2HB       SER  69  -1.879  -4.091  -8.892
  527    HB3  SER  69          1HB       SER  69  -1.130  -2.739  -9.742
  528    HG   SER  69           HG       SER  69  -0.063  -5.192  -8.991
  529    H    ALA  70           H        ALA  70  -2.843  -3.775  -6.616
  530    HA   ALA  70           HA       ALA  70  -4.760  -1.750  -7.026
  531    HB1  ALA  70          1HB       ALA  70  -4.843  -3.846  -4.866
  532    HB2  ALA  70          2HB       ALA  70  -5.180  -4.197  -6.568
  533    HB3  ALA  70          3HB       ALA  70  -6.200  -3.064  -5.680
  534    H    PHE  71           H        PHE  71  -3.052  -2.809  -4.139
  535    HA   PHE  71           HA       PHE  71  -4.082  -0.980  -2.330
  536    HB2  PHE  71          2HB       PHE  71  -2.764  -2.968  -1.703
  537    HB3  PHE  71          1HB       PHE  71  -1.322  -2.221  -2.383
  538    HD1  PHE  71          1HD       PHE  71  -3.739  -2.107   0.354
  539    HD2  PHE  71          2HD       PHE  71  -0.135  -0.516  -1.211
  540    HE1  PHE  71          1HE       PHE  71  -3.274  -1.075   2.525
  541    HE2  PHE  71          2HE       PHE  71   0.343   0.521   0.963
  542    HZ   PHE  71           HZ       PHE  71  -1.226   0.253   2.829
  543    H    PHE  72           H        PHE  72  -1.170  -0.754  -4.357
  544    HA   PHE  72           HA       PHE  72  -0.336   1.729  -3.324
  545    HB2  PHE  72          2HB       PHE  72   1.190   0.262  -4.542
  546    HB3  PHE  72          1HB       PHE  72   0.269   0.518  -6.021
  547    HD1  PHE  72          1HD       PHE  72   1.914   2.538  -3.358
  548    HD2  PHE  72          2HD       PHE  72   1.107   2.061  -7.510
  549    HE1  PHE  72          1HE       PHE  72   3.271   4.525  -3.843
  550    HE2  PHE  72          2HE       PHE  72   2.469   4.050  -8.006
  551    HZ   PHE  72           HZ       PHE  72   3.553   5.286  -6.171
  552    H    SER  73           H        SER  73  -2.394   0.858  -6.003
  553    HA   SER  73           HA       SER  73  -2.619   3.396  -7.184
  554    HB2  SER  73          2HB       SER  73  -3.322   1.200  -8.203
  555    HB3  SER  73          1HB       SER  73  -4.733   1.228  -7.146
  556    HG   SER  73           HG       SER  73  -5.606   2.331  -8.700
  557    H    LEU  74           H        LEU  74  -4.337   1.867  -4.527
  558    HA   LEU  74           HA       LEU  74  -6.298   3.934  -4.245
  559    HB2  LEU  74          2HB       LEU  74  -6.710   1.627  -3.505
  560    HB3  LEU  74          1HB       LEU  74  -5.415   1.767  -2.334
  561    HG   LEU  74           HG       LEU  74  -6.685   3.289  -0.996
  562   HD11  LEU  74          1HD1      LEU  74  -7.687   4.635  -2.744
  563   HD12  LEU  74          2HD1      LEU  74  -8.930   4.039  -1.645
  564   HD13  LEU  74          3HD1      LEU  74  -8.714   3.285  -3.224
  565   HD21  LEU  74          1HD2      LEU  74  -8.345   0.993  -2.011
  566   HD22  LEU  74          2HD2      LEU  74  -8.728   1.924  -0.562
  567   HD23  LEU  74          3HD2      LEU  74  -7.236   0.988  -0.640
  568    H    VAL  75           H        VAL  75  -3.319   3.082  -2.503
  569    HA   VAL  75           HA       VAL  75  -3.523   5.145  -0.574
  570    HB   VAL  75           HB       VAL  75  -0.996   3.775  -1.504
  571   HG11  VAL  75          1HG1      VAL  75  -0.190   5.386  -0.156
  572   HG12  VAL  75          2HG1      VAL  75  -0.536   4.123   1.032
  573   HG13  VAL  75          3HG1      VAL  75  -1.657   5.468   0.817
  574   HG21  VAL  75          1HG2      VAL  75  -3.091   2.919   0.462
  575   HG22  VAL  75          2HG2      VAL  75  -1.432   2.330   0.539
  576   HG23  VAL  75          3HG2      VAL  75  -2.418   2.009  -0.893
  577    H    ALA  76           H        ALA  76  -1.927   4.985  -3.730
  578    HA   ALA  76           HA       ALA  76  -0.416   7.355  -3.436
  579    HB1  ALA  76          1HB       ALA  76   0.127   5.618  -5.074
  580    HB2  ALA  76          2HB       ALA  76  -0.023   7.208  -5.823
  581    HB3  ALA  76          3HB       ALA  76  -1.327   6.031  -5.981
  582    H    SER  77           H        SER  77  -3.722   6.990  -3.740
  583    HA   SER  77           HA       SER  77  -4.004   9.668  -4.919
  584    HB2  SER  77          2HB       SER  77  -5.236   7.797  -6.040
  585    HB3  SER  77          1HB       SER  77  -6.143   7.556  -4.551
  586    HG   SER  77           HG       SER  77  -7.026   9.598  -4.780
  587    H    ASP  78           H        ASP  78  -3.854   8.115  -2.002
  588    HA   ASP  78           HA       ASP  78  -5.599  10.099  -0.713
  589    HB2  ASP  78          2HB       ASP  78  -5.417   7.141  -0.242
  590    HB3  ASP  78          1HB       ASP  78  -5.922   8.220   1.057
  591    H    GLU  79           H        GLU  79  -4.312  11.463   0.295
  592    HA   GLU  79           HA       GLU  79  -1.699  10.913   1.219
  593    HB2  GLU  79          2HB       GLU  79  -1.950  13.154   0.918
  594    HB3  GLU  79          1HB       GLU  79  -3.637  13.151   1.393
  595    HG2  GLU  79          2HG       GLU  79  -1.596  12.744   3.509
  596    HG3  GLU  79          1HG       GLU  79  -1.755  14.352   2.808
  597    H    GLN  80           H        GLN  80  -4.837  10.686   2.786
  598    HA   GLN  80           HA       GLN  80  -4.002  10.329   5.422
  599    HB2  GLN  80          2HB       GLN  80  -6.190   8.686   4.152
  600    HB3  GLN  80          1HB       GLN  80  -6.052   9.187   5.828
  601    HG2  GLN  80          2HG       GLN  80  -7.251  10.986   5.419
  602    HG3  GLN  80          1HG       GLN  80  -6.095  11.510   4.196
  603   HE21  GLN  80          1HE2      GLN  80  -6.575   9.090   2.577
  604   HE22  GLN  80          2HE2      GLN  80  -8.081   9.368   1.778
  605    H    TYR  81           H        TYR  81  -3.725   8.278   2.661
  606    HA   TYR  81           HA       TYR  81  -3.464   5.853   4.207
  607    HB2  TYR  81          2HB       TYR  81  -3.733   6.446   1.278
  608    HB3  TYR  81          1HB       TYR  81  -3.203   4.860   1.836
  609    HD1  TYR  81          1HD       TYR  81  -5.593   4.921   0.252
  610    HD2  TYR  81          2HD       TYR  81  -5.167   5.664   4.413
  611    HE1  TYR  81          1HE       TYR  81  -7.919   4.160   0.645
  612    HE2  TYR  81          2HE       TYR  81  -7.447   4.934   4.781
  613    HH   TYR  81           HH       TYR  81  -9.543   4.692   3.507
  614    H    VAL  82           H        VAL  82  -1.522   7.881   2.044
  615    HA   VAL  82           HA       VAL  82   0.715   6.222   2.055
  616    HB   VAL  82           HB       VAL  82   1.854   8.266   1.368
  617   HG11  VAL  82          1HG1      VAL  82   0.628   8.608  -0.742
  618   HG12  VAL  82          2HG1      VAL  82  -0.716   7.705  -0.038
  619   HG13  VAL  82          3HG1      VAL  82   0.828   6.904  -0.326
  620   HG21  VAL  82          1HG2      VAL  82  -0.698   9.572   2.019
  621   HG22  VAL  82          2HG2      VAL  82   0.413  10.256   0.831
  622   HG23  VAL  82          3HG2      VAL  82   0.941  10.022   2.501
  623    H    ARG  83           H        ARG  83  -0.127   9.055   3.919
  624    HA   ARG  83           HA       ARG  83   2.002   8.938   5.725
  625    HB2  ARG  83          2HB       ARG  83  -0.701  10.250   5.859
  626    HB3  ARG  83          1HB       ARG  83   0.519  10.451   7.091
  627    HG2  ARG  83          2HG       ARG  83   2.042  11.320   5.281
  628    HG3  ARG  83          1HG       ARG  83   0.606  11.350   4.253
  629    HD2  ARG  83          2HD       ARG  83  -0.448  12.888   5.503
  630    HD3  ARG  83          1HD       ARG  83   0.584  12.666   6.911
  631    HE   ARG  83           HE       ARG  83   2.165  13.571   4.790
  632   HH11  ARG  83          1HH1      ARG  83  -0.435  14.744   6.816
  633   HH12  ARG  83          2HH1      ARG  83   0.083  16.397   6.738
  634   HH21  ARG  83          1HH2      ARG  83   2.852  15.742   4.685
  635   HH22  ARG  83          2HH2      ARG  83   1.951  16.966   5.527
  636    H    PHE  84           H        PHE  84  -1.116   7.372   5.637
  637    HA   PHE  84           HA       PHE  84  -1.316   6.627   8.340
  638    HB2  PHE  84          2HB       PHE  84  -2.751   6.031   6.056
  639    HB3  PHE  84          1HB       PHE  84  -2.059   4.466   6.495
  640    HD1  PHE  84          1HD       PHE  84  -2.850   3.266   8.378
  641    HD2  PHE  84          2HD       PHE  84  -4.203   7.231   7.654
  642    HE1  PHE  84          1HE       PHE  84  -4.611   2.973  10.072
  643    HE2  PHE  84          2HE       PHE  84  -5.961   6.948   9.346
  644    HZ   PHE  84           HZ       PHE  84  -6.168   4.815  10.557
  645    H    ILE  85           H        ILE  85   0.310   5.044   5.642
  646    HA   ILE  85           HA       ILE  85   1.353   2.980   7.359
  647    HB   ILE  85           HB       ILE  85   1.613   3.541   4.443
  648   HG12  ILE  85          2HG1      ILE  85   0.795   1.192   6.165
  649   HG13  ILE  85          1HG1      ILE  85  -0.246   2.188   5.156
  650   HG21  ILE  85          1HG2      ILE  85   3.463   1.847   6.091
  651   HG22  ILE  85          2HG2      ILE  85   3.878   3.117   4.939
  652   HG23  ILE  85          3HG2      ILE  85   3.222   1.583   4.367
  653   HD11  ILE  85          1HD1      ILE  85   0.801   1.281   3.160
  654   HD12  ILE  85          2HD1      ILE  85   0.156  -0.005   4.180
  655   HD13  ILE  85          3HD1      ILE  85   1.891   0.308   4.153
  656    H    ALA  86           H        ALA  86   2.716   5.795   5.679
  657    HA   ALA  86           HA       ALA  86   5.328   5.709   6.481
  658    HB1  ALA  86          1HB       ALA  86   3.621   8.196   6.496
  659    HB2  ALA  86          2HB       ALA  86   4.291   7.454   5.045
  660    HB3  ALA  86          3HB       ALA  86   5.368   8.111   6.279
  661    H    GLN  87           H        GLN  87   2.547   6.636   8.434
  662    HA   GLN  87           HA       GLN  87   4.103   7.382  10.738
  663    HB2  GLN  87          2HB       GLN  87   1.880   8.338  10.320
  664    HB3  GLN  87          1HB       GLN  87   1.160   6.736  10.411
  665    HG2  GLN  87          2HG       GLN  87   1.792   6.585  12.762
  666    HG3  GLN  87          1HG       GLN  87   2.515   8.192  12.672
  667   HE21  GLN  87          1HE2      GLN  87   0.293   7.183  14.311
  668   HE22  GLN  87          2HE2      GLN  87  -1.055   8.207  13.949
  669    H    HIS  88           H        HIS  88   2.410   4.562   9.589
  670    HA   HIS  88           HA       HIS  88   2.552   3.024  11.962
  671    HB2  HIS  88          2HB       HIS  88   1.343   2.777   9.484
  672    HB3  HIS  88          1HB       HIS  88   2.557   1.506   9.460
  673    HD1  HIS  88          1HD       HIS  88   2.348   0.588  12.418
  674    HD2  HIS  88          2HD       HIS  88  -0.900   1.324   9.920
  675    HE1  HIS  88          1HE       HIS  88   0.440  -0.735  13.383
  676    HE2  HIS  88          2HE       HIS  88  -1.544  -0.171  11.937
  677    H    PHE  89           H        PHE  89   4.637   3.350   9.133
  678    HA   PHE  89           HA       PHE  89   6.771   1.883  10.456
  679    HB2  PHE  89          2HB       PHE  89   5.233   0.258   9.254
  680    HB3  PHE  89          1HB       PHE  89   5.746   1.017   7.757
  681    HD1  PHE  89          1HD       PHE  89   7.648   0.290   6.663
  682    HD2  PHE  89          2HD       PHE  89   7.032  -0.794  10.729
  683    HE1  PHE  89          1HE       PHE  89   9.501  -1.322   6.509
  684    HE2  PHE  89          2HE       PHE  89   8.909  -2.380  10.597
  685    HZ   PHE  89           HZ       PHE  89  10.146  -2.645   8.485
  686    HA   PRO  90           HA       PRO  90   8.824   5.292   8.289
  687    HB2  PRO  90          2HB       PRO  90  11.336   4.534   9.139
  688    HB3  PRO  90          1HB       PRO  90  10.227   5.550  10.063
  689    HG2  PRO  90          2HG       PRO  90  10.753   2.619  10.300
  690    HG3  PRO  90          1HG       PRO  90  10.514   3.823  11.579
  691    HD2  PRO  90          2HD       PRO  90   8.561   2.142  10.861
  692    HD3  PRO  90          1HD       PRO  90   8.209   3.820  11.324
  693    H    CYS  91           H        CYS  91  10.359   5.520   6.594
  694    HA   CYS  91           HA       CYS  91  10.160   3.480   4.632
  695    HB2  CYS  91          2HB       CYS  91  11.599   5.069   3.299
  696    HB3  CYS  91          1HB       CYS  91  10.156   5.822   3.998
  697    HG   CYS  91           HG       CYS  91  13.246   6.780   4.270
  698    H    ALA  92           H        ALA  92  11.523   2.076   3.898
  699    HA   ALA  92           HA       ALA  92  13.566   1.019   5.483
  700    HB1  ALA  92          1HB       ALA  92  12.320  -0.265   3.795
  701    HB2  ALA  92          2HB       ALA  92  14.067  -0.426   3.605
  702    HB3  ALA  92          3HB       ALA  92  13.153   0.625   2.521
  703    HA   PRO  93           HA       PRO  93  17.072   3.514   4.599
  704    HB2  PRO  93          2HB       PRO  93  19.046   1.786   5.116
  705    HB3  PRO  93          1HB       PRO  93  18.023   2.437   6.392
  706    HG2  PRO  93          2HG       PRO  93  17.887  -0.217   5.019
  707    HG3  PRO  93          1HG       PRO  93  17.701   0.157   6.742
  708    HD2  PRO  93          2HD       PRO  93  15.590  -0.277   5.078
  709    HD3  PRO  93          1HD       PRO  93  15.508   0.793   6.492
  710    H    GLU  94           H        GLU  94  16.039   2.737   2.217
  711    HA   GLU  94           HA       GLU  94  18.290   1.690   0.661
  712    HB2  GLU  94          2HB       GLU  94  15.463   2.296  -0.231
  713    HB3  GLU  94          1HB       GLU  94  16.708   1.530  -1.205
  714    HG2  GLU  94          2HG       GLU  94  15.474   0.393   1.294
  715    HG3  GLU  94          1HG       GLU  94  15.101  -0.087  -0.361
  716    H    GLU  95           H        GLU  95  17.129   4.540   1.756
  717    HA   GLU  95           HA       GLU  95  17.236   6.177  -0.571
  718    HB2  GLU  95          2HB       GLU  95  17.378   6.962   2.348
  719    HB3  GLU  95          1HB       GLU  95  17.092   8.054   1.002
  720    HG2  GLU  95          2HG       GLU  95  15.013   7.113   0.534
  721    HG3  GLU  95          1HG       GLU  95  15.290   5.750   1.619
  722    H    GLU  96           H        GLU  96  19.176   5.991  -1.602
  723    HA   GLU  96           HA       GLU  96  21.556   6.876  -0.115
  724    HB2  GLU  96          2HB       GLU  96  21.826   4.689  -1.154
  725    HB3  GLU  96          1HB       GLU  96  21.331   5.337  -2.710
  726    HG2  GLU  96          2HG       GLU  96  23.317   6.821  -2.665
  727    HG3  GLU  96          1HG       GLU  96  23.834   6.009  -1.188
  728    H    LYS  97           H        LYS  97  20.275   7.051  -3.435
  729    HA   LYS  97           HA       LYS  97  20.243   9.857  -3.569
  730    HB2  LYS  97          2HB       LYS  97  22.651   9.730  -3.480
  731    HB3  LYS  97          1HB       LYS  97  22.687   8.551  -4.776
  732    HG2  LYS  97          2HG       LYS  97  21.734  10.271  -6.291
  733    HG3  LYS  97          1HG       LYS  97  21.891  11.441  -4.979
  734    HD2  LYS  97          2HD       LYS  97  24.158   9.853  -6.182
  735    HD3  LYS  97          1HD       LYS  97  23.783  11.534  -6.556
  736    HE2  LYS  97          2HE       LYS  97  24.165  12.135  -4.215
  737    HE3  LYS  97          1HE       LYS  97  24.548  10.454  -3.848
  738    HZ1  LYS  97          1HZ       LYS  97  26.527  11.842  -4.180
  739    HZ2  LYS  97          2HZ       LYS  97  26.049  12.139  -5.774
  740    HZ3  LYS  97          3HZ       LYS  97  26.444  10.570  -5.289
  741    HA   PRO  98           HA       PRO  98  19.310   8.131  -7.882
  742    HB2  PRO  98          2HB       PRO  98  20.097   5.413  -8.262
  743    HB3  PRO  98          1HB       PRO  98  20.854   6.852  -8.942
  744    HG2  PRO  98          2HG       PRO  98  22.045   5.175  -7.099
  745    HG3  PRO  98          1HG       PRO  98  22.508   6.863  -7.375
  746    HD2  PRO  98          2HD       PRO  98  20.726   5.705  -5.261
  747    HD3  PRO  98          1HD       PRO  98  21.984   6.947  -5.111
  748    HA   PRO  99           HA       PRO  99  15.576   5.614  -7.349
  749    HB2  PRO  99          2HB       PRO  99  16.142   4.170  -9.877
  750    HB3  PRO  99          1HB       PRO  99  14.733   5.134  -9.424
  751    HG2  PRO  99          2HG       PRO  99  16.497   6.065 -11.177
  752    HG3  PRO  99          1HG       PRO  99  15.770   7.140  -9.966
  753    HD2  PRO  99          2HD       PRO  99  18.476   5.845  -9.969
  754    HD3  PRO  99          1HD       PRO  99  18.028   7.512  -9.553
  755    H    GLU 100           H        GLU 100  15.399   2.946  -8.730
  756    HA   GLU 100           HA       GLU 100  15.399   0.799  -8.005
  757    HB2  GLU 100          2HB       GLU 100  17.588  -0.265  -7.934
  758    HB3  GLU 100          1HB       GLU 100  17.362   0.716  -9.367
  759    HG2  GLU 100          2HG       GLU 100  18.747   2.460  -8.346
  760    HG3  GLU 100          1HG       GLU 100  18.954   1.433  -6.927
  761    H    ILE 101           H        ILE 101  14.715   2.263  -5.959
  762    HA   ILE 101           HA       ILE 101  16.289   1.425  -3.657
  763    HB   ILE 101           HB       ILE 101  14.640   2.946  -2.396
  764   HG12  ILE 101          2HG1      ILE 101  14.111   3.864  -5.239
  765   HG13  ILE 101          1HG1      ILE 101  12.935   3.196  -4.124
  766   HG21  ILE 101          1HG2      ILE 101  16.940   3.534  -2.749
  767   HG22  ILE 101          2HG2      ILE 101  15.937   4.956  -3.043
  768   HG23  ILE 101          3HG2      ILE 101  16.601   4.044  -4.402
  769   HD11  ILE 101          1HD1      ILE 101  14.361   5.793  -3.778
  770   HD12  ILE 101          2HD1      ILE 101  13.171   5.093  -2.682
  771   HD13  ILE 101          3HD1      ILE 101  12.695   5.560  -4.308
  772    H    ASP 102           H        ASP 102  12.847   1.653  -4.438
  773    HA   ASP 102           HA       ASP 102  12.065  -0.949  -4.042
  774    HB2  ASP 102          2HB       ASP 102  12.924  -0.461  -1.664
  775    HB3  ASP 102          1HB       ASP 102  11.568   0.633  -1.512
  776    H    ALA 103           H        ALA 103  11.136   2.212  -2.811
  777    HA   ALA 103           HA       ALA 103   8.515   2.474  -3.305
  778    HB1  ALA 103          1HB       ALA 103   9.156   4.897  -4.042
  779    HB2  ALA 103          2HB       ALA 103  10.797   4.379  -3.641
  780    HB3  ALA 103          3HB       ALA 103   9.537   4.349  -2.410
  781    H    LEU 104           H        LEU 104  10.788   3.718  -5.719
  782    HA   LEU 104           HA       LEU 104   8.736   3.244  -7.760
  783    HB2  LEU 104          2HB       LEU 104  11.128   5.031  -8.085
  784    HB3  LEU 104          1HB       LEU 104   9.598   5.086  -8.940
  785    HG   LEU 104           HG       LEU 104  10.025   5.853  -6.048
  786   HD11  LEU 104          1HD1      LEU 104  11.003   7.459  -7.581
  787   HD12  LEU 104          2HD1      LEU 104   9.561   8.125  -6.812
  788   HD13  LEU 104          3HD1      LEU 104   9.486   7.548  -8.476
  789   HD21  LEU 104          1HD2      LEU 104   7.545   6.007  -7.763
  790   HD22  LEU 104          2HD2      LEU 104   7.715   6.679  -6.140
  791   HD23  LEU 104          3HD2      LEU 104   7.802   4.935  -6.384
  792    H    GLU 105           H        GLU 105  11.599   2.078  -6.610
  793    HA   GLU 105           HA       GLU 105  13.480   1.096  -7.464
  794    HB2  GLU 105          2HB       GLU 105  12.775  -1.073  -8.661
  795    HB3  GLU 105          1HB       GLU 105  12.282  -0.812  -6.999
  796    HG2  GLU 105          2HG       GLU 105  10.068  -0.076  -7.812
  797    HG3  GLU 105          1HG       GLU 105  10.579  -0.464  -9.454
  798    H    LEU 106           H        LEU 106  12.489  -0.391 -10.266
  799    HA   LEU 106           HA       LEU 106  13.228   1.843 -12.004
  800    HB2  LEU 106          2HB       LEU 106  14.629  -0.831 -11.965
  801    HB3  LEU 106          1HB       LEU 106  14.736   0.290 -13.305
  802    HG   LEU 106           HG       LEU 106  15.657   0.900 -10.496
  803   HD11  LEU 106          1HD1      LEU 106  17.919   0.638 -11.409
  804   HD12  LEU 106          2HD1      LEU 106  17.232   0.103 -12.944
  805   HD13  LEU 106          3HD1      LEU 106  17.004  -0.868 -11.488
  806   HD21  LEU 106          1HD2      LEU 106  16.025   2.368 -13.107
  807   HD22  LEU 106          2HD2      LEU 106  16.791   2.795 -11.579
  808   HD23  LEU 106          3HD2      LEU 106  15.038   2.892 -11.742
  809    H    LYS 107           H        LYS 107  13.087  -1.598 -12.688
  810    HA   LYS 107           HA       LYS 107  10.452  -1.565 -13.770
  811    HB2  LYS 107          2HB       LYS 107  11.351  -2.212 -16.120
  812    HB3  LYS 107          1HB       LYS 107  11.226  -0.518 -15.694
  813    HG2  LYS 107          2HG       LYS 107  13.288  -0.793 -16.811
  814    HG3  LYS 107          1HG       LYS 107  13.667  -0.585 -15.102
  815    HD2  LYS 107          2HD       LYS 107  13.975  -2.988 -14.863
  816    HD3  LYS 107          1HD       LYS 107  13.533  -3.229 -16.553
  817    HE2  LYS 107          2HE       LYS 107  15.467  -1.881 -17.236
  818    HE3  LYS 107          1HE       LYS 107  15.910  -1.666 -15.545
  819    HZ1  LYS 107          1HZ       LYS 107  17.204  -3.417 -16.555
  820    HZ2  LYS 107          2HZ       LYS 107  15.806  -4.252 -17.002
  821    HZ3  LYS 107          3HZ       LYS 107  16.194  -4.069 -15.366
  822    H    THR 108           H        THR 108   9.936  -3.698 -14.786
  823    HA   THR 108           HA       THR 108   9.708  -5.928 -14.417
  824    HB   THR 108           HB       THR 108  11.735  -7.306 -14.862
  825    HG1  THR 108          1HG       THR 108  13.007  -5.060 -14.139
  826   HG21  THR 108          1HG2      THR 108  10.365  -6.485 -16.708
  827   HG22  THR 108          2HG2      THR 108  12.068  -6.541 -17.163
  828   HG23  THR 108          3HG2      THR 108  11.315  -4.999 -16.762
  829    H    GLN 109           H        GLN 109  11.583  -7.780 -13.231
  830    HA   GLN 109           HA       GLN 109  12.140  -8.680 -11.228
  831    HB2  GLN 109          2HB       GLN 109  12.542  -5.828 -10.306
  832    HB3  GLN 109          1HB       GLN 109  13.241  -7.275  -9.592
  833    HG2  GLN 109          2HG       GLN 109  13.857  -6.110 -12.297
  834    HG3  GLN 109          1HG       GLN 109  14.908  -6.128 -10.883
  835   HE21  GLN 109          1HE2      GLN 109  14.200  -8.858 -10.150
  836   HE22  GLN 109          2HE2      GLN 109  14.985  -9.887 -11.298
  837    H    LYS 110           H        LYS 110   9.507  -8.515 -11.672
  838    HA   LYS 110           HA       LYS 110   8.244  -7.451  -9.259
  839    HB2  LYS 110          2HB       LYS 110   7.226  -6.927 -11.436
  840    HB3  LYS 110          1HB       LYS 110   7.040  -8.643 -11.766
  841    HG2  LYS 110          2HG       LYS 110   5.512  -8.827  -9.853
  842    HG3  LYS 110          1HG       LYS 110   5.676  -7.092  -9.576
  843    HD2  LYS 110          2HD       LYS 110   4.729  -6.627 -11.760
  844    HD3  LYS 110          1HD       LYS 110   4.632  -8.355 -12.110
  845    HE2  LYS 110          2HE       LYS 110   3.073  -8.649 -10.261
  846    HE3  LYS 110          1HE       LYS 110   3.188  -6.935  -9.876
  847    HZ1  LYS 110          1HZ       LYS 110   1.204  -7.415 -11.151
  848    HZ2  LYS 110          2HZ       LYS 110   2.129  -8.073 -12.403
  849    HZ3  LYS 110          3HZ       LYS 110   2.247  -6.426 -12.042
  850    H    GLY 111           H        GLY 111   9.393 -10.358 -10.590
  851    HA2  GLY 111          2HA       GLY 111   9.399 -12.514  -9.799
  852    HA3  GLY 111          1HA       GLY 111   8.706 -11.895  -8.305
  853    H    PHE 112           H        PHE 112   6.886 -12.856  -7.822
  854    HA   PHE 112           HA       PHE 112   4.862 -13.856  -7.951
  855    HB2  PHE 112          2HB       PHE 112   4.274 -11.609  -8.884
  856    HB3  PHE 112          1HB       PHE 112   4.532 -12.256 -10.498
  857    HD1  PHE 112          1HD       PHE 112   2.734 -13.121 -11.657
  858    HD2  PHE 112          2HD       PHE 112   2.554 -12.906  -7.413
  859    HE1  PHE 112          1HE       PHE 112   0.391 -13.868 -11.722
  860    HE2  PHE 112          2HE       PHE 112   0.210 -13.653  -7.473
  861    HZ   PHE 112           HZ       PHE 112  -0.872 -14.132  -9.628
  Start of MODEL   19
    1    H1   GLY   1          1HT       GLY   1  -2.542  26.002  -5.089
    2    H2   GLY   1          2HT       GLY   1  -2.794  24.831  -3.903
    3    H    GLY   1           H        GLY   1  -2.434  25.615  -4.211
    4    H3   GLY   1          3HT       GLY   1  -3.803  24.889  -5.259
    5    HA2  GLY   1          1HA       GLY   1  -2.250  23.082  -5.487
    6    HA3  GLY   1          2HA       GLY   1  -1.947  24.324  -6.695
    7    H    SER   2           H        SER   2  -0.481  22.306  -4.572
    8    HA   SER   2           HA       SER   2   1.861  24.080  -4.366
    9    HB2  SER   2          2HB       SER   2   0.824  23.519  -2.158
   10    HB3  SER   2          1HB       SER   2   1.136  21.816  -2.487
   11    HG   SER   2           HG       SER   2   2.979  23.902  -2.010
   12    H    ALA   3           H        ALA   3   0.931  20.643  -4.385
   13    HA   ALA   3           HA       ALA   3   1.822  18.805  -5.359
   14    HB1  ALA   3          1HB       ALA   3   1.087  20.042  -7.366
   15    HB2  ALA   3          2HB       ALA   3   2.467  18.988  -7.671
   16    HB3  ALA   3          3HB       ALA   3   2.706  20.726  -7.504
   17    H    MET   4           H        MET   4   3.371  19.014  -3.460
   18    HA   MET   4           HA       MET   4   6.109  19.608  -4.105
   19    HB2  MET   4          2HB       MET   4   4.883  18.141  -1.762
   20    HB3  MET   4          1HB       MET   4   6.590  18.534  -1.900
   21    HG2  MET   4          2HG       MET   4   4.328  20.514  -1.790
   22    HG3  MET   4          1HG       MET   4   5.413  20.106  -0.464
   23    HE1  MET   4          1HE       MET   4   6.645  23.688  -1.248
   24    HE2  MET   4          2HE       MET   4   6.146  22.547  -0.000
   25    HE3  MET   4          3HE       MET   4   4.985  23.092  -1.210
   26    H    GLY   5           H        GLY   5   6.263  18.329  -6.023
   27    HA2  GLY   5          2HA       GLY   5   7.320  16.457  -6.967
   28    HA3  GLY   5          1HA       GLY   5   7.011  15.562  -5.484
   29    H    HIS   6           H        HIS   6   6.441  14.067  -7.483
   30    HA   HIS   6           HA       HIS   6   3.734  14.538  -8.422
   31    HB2  HIS   6          2HB       HIS   6   5.712  12.334  -9.004
   32    HB3  HIS   6          1HB       HIS   6   4.075  12.360  -9.649
   33    HD1  HIS   6          1HD       HIS   6   3.522  14.310 -11.360
   34    HD2  HIS   6          2HD       HIS   6   7.530  13.900 -10.339
   35    HE1  HIS   6          1HE       HIS   6   4.797  15.629 -13.077
   36    HE2  HIS   6          2HE       HIS   6   7.202  15.505 -12.332
   37    H    MET   7           H        MET   7   2.524  12.212  -8.541
   38    HA   MET   7           HA       MET   7   1.204  10.791  -7.403
   39    HB2  MET   7          2HB       MET   7   3.551  10.691  -5.533
   40    HB3  MET   7          1HB       MET   7   2.102   9.732  -5.292
   41    HG2  MET   7          2HG       MET   7   3.624   8.300  -6.335
   42    HG3  MET   7          1HG       MET   7   2.510   8.787  -7.606
   43    HE1  MET   7          1HE       MET   7   6.097   9.097  -6.118
   44    HE2  MET   7          2HE       MET   7   5.569  10.778  -6.024
   45    HE3  MET   7          3HE       MET   7   6.842  10.315  -7.150
   46    H    VAL   8           H        VAL   8   2.503  11.838  -4.421
   47    HA   VAL   8           HA       VAL   8   0.677  13.904  -3.853
   48    HB   VAL   8           HB       VAL   8  -0.940  12.047  -3.922
   49   HG11  VAL   8          1HG1      VAL   8   0.399  10.183  -3.272
   50   HG12  VAL   8          2HG1      VAL   8  -0.959  10.333  -2.158
   51   HG13  VAL   8          3HG1      VAL   8   0.649  10.861  -1.665
   52   HG21  VAL   8          1HG2      VAL   8  -0.555  13.249  -1.185
   53   HG22  VAL   8          2HG2      VAL   8  -2.018  12.437  -1.740
   54   HG23  VAL   8          3HG2      VAL   8  -1.481  13.919  -2.529
   55    H    LYS   9           H        LYS   9   0.758  12.400  -1.018
   56    HA   LYS   9           HA       LYS   9   3.106  13.697  -0.068
   57    HB2  LYS   9          2HB       LYS   9   1.252  11.664   1.234
   58    HB3  LYS   9          1HB       LYS   9   2.590  12.471   2.060
   59    HG2  LYS   9          2HG       LYS   9   0.316  13.925   0.747
   60    HG3  LYS   9          1HG       LYS   9   0.383  13.509   2.459
   61    HD2  LYS   9          2HD       LYS   9   2.428  14.822   2.698
   62    HD3  LYS   9          1HD       LYS   9   2.372  15.223   0.982
   63    HE2  LYS   9          2HE       LYS   9   0.217  16.335   1.323
   64    HE3  LYS   9          1HE       LYS   9   0.299  15.946   3.041
   65    HZ1  LYS   9          1HZ       LYS   9   1.022  18.206   2.622
   66    HZ2  LYS   9          2HZ       LYS   9   2.211  17.664   1.552
   67    HZ3  LYS   9          3HZ       LYS   9   2.317  17.283   3.197
   68    H    ILE  10           H        ILE  10   3.868  12.027  -2.176
   69    HA   ILE  10           HA       ILE  10   5.159   9.797  -0.808
   70    HB   ILE  10           HB       ILE  10   4.134   9.836  -3.646
   71   HG12  ILE  10          2HG1      ILE  10   3.167   8.344  -1.194
   72   HG13  ILE  10          1HG1      ILE  10   2.315   9.636  -2.029
   73   HG21  ILE  10          1HG2      ILE  10   4.804   7.509  -3.741
   74   HG22  ILE  10          2HG2      ILE  10   5.427   7.599  -2.094
   75   HG23  ILE  10          3HG2      ILE  10   6.195   8.531  -3.380
   76   HD11  ILE  10          1HD1      ILE  10   1.387   7.457  -2.573
   77   HD12  ILE  10          2HD1      ILE  10   2.958   6.930  -3.175
   78   HD13  ILE  10          3HD1      ILE  10   2.086   8.221  -3.999
   79    H    SER  11           H        SER  11   7.150  10.735  -0.506
   80    HA   SER  11           HA       SER  11   8.693  11.419  -2.897
   81    HB2  SER  11          2HB       SER  11   9.576  11.206   0.002
   82    HB3  SER  11          1HB       SER  11  10.515  11.890  -1.325
   83    HG   SER  11           HG       SER  11   7.995  12.982  -0.942
   84    H    HIS  12           H        HIS  12  11.098  10.180  -2.529
   85    HA   HIS  12           HA       HIS  12  10.777   7.513  -3.257
   86    HB2  HIS  12          2HB       HIS  12  13.054   8.748  -1.692
   87    HB3  HIS  12          1HB       HIS  12  13.100   7.143  -2.403
   88    HD1  HIS  12          1HD       HIS  12  13.363  10.759  -3.304
   89    HD2  HIS  12          2HD       HIS  12  13.470   7.039  -5.152
   90    HE1  HIS  12          1HE       HIS  12  14.270  11.178  -5.608
   91    HE2  HIS  12          2HE       HIS  12  14.354   8.911  -6.704
   92    H    GLU  13           H        GLU  13  11.520   8.890  -0.125
   93    HA   GLU  13           HA       GLU  13  11.607   6.555   1.355
   94    HB2  GLU  13          2HB       GLU  13  11.253   8.046   3.313
   95    HB3  GLU  13          1HB       GLU  13  12.502   8.607   2.197
   96    HG2  GLU  13          2HG       GLU  13  10.864  10.174   1.211
   97    HG3  GLU  13          1HG       GLU  13   9.698   9.673   2.434
   98    H    ASP  14           H        ASP  14   8.831   8.505   0.370
   99    HA   ASP  14           HA       ASP  14   7.114   7.292   2.309
  100    HB2  ASP  14          2HB       ASP  14   6.547   9.037  -0.062
  101    HB3  ASP  14          1HB       ASP  14   5.333   8.512   1.100
  102    H    THR  15           H        THR  15   7.672   6.856  -1.188
  103    HA   THR  15           HA       THR  15   5.589   4.952  -1.514
  104    HB   THR  15           HB       THR  15   7.806   4.333  -3.235
  105    HG1  THR  15          1HG       THR  15   7.146   7.080  -2.949
  106   HG21  THR  15          1HG2      THR  15   6.208   5.019  -4.986
  107   HG22  THR  15          2HG2      THR  15   5.121   5.602  -3.726
  108   HG23  THR  15          3HG2      THR  15   5.518   3.888  -3.823
  109    H    GLN  16           H        GLN  16   9.000   4.727  -0.629
  110    HA   GLN  16           HA       GLN  16   9.223   1.951  -0.414
  111    HB2  GLN  16          2HB       GLN  16  10.509   4.118   1.267
  112    HB3  GLN  16          1HB       GLN  16  10.990   2.425   1.291
  113    HG2  GLN  16          2HG       GLN  16  11.758   2.512  -0.937
  114    HG3  GLN  16          1HG       GLN  16  11.000   4.078  -1.205
  115   HE21  GLN  16          1HE2      GLN  16  12.798   3.236   1.672
  116   HE22  GLN  16          2HE2      GLN  16  14.120   4.312   1.386
  117    H    ARG  17           H        ARG  17   8.018   4.383   1.825
  118    HA   ARG  17           HA       ARG  17   7.594   2.748   4.059
  119    HB2  ARG  17          2HB       ARG  17   6.504   5.347   3.103
  120    HB3  ARG  17          1HB       ARG  17   5.694   4.545   4.440
  121    HG2  ARG  17          2HG       ARG  17   7.390   4.927   5.877
  122    HG3  ARG  17          1HG       ARG  17   8.627   4.829   4.621
  123    HD2  ARG  17          2HD       ARG  17   8.258   7.007   3.911
  124    HD3  ARG  17          1HD       ARG  17   6.679   7.103   4.700
  125    HE   ARG  17           HE       ARG  17   8.260   6.839   6.812
  126   HH11  ARG  17          1HH1      ARG  17   8.459   8.899   4.018
  127   HH12  ARG  17          2HH1      ARG  17   9.491  10.074   4.778
  128   HH21  ARG  17          1HH2      ARG  17   9.550   8.418   7.876
  129   HH22  ARG  17          2HH2      ARG  17  10.091   9.808   6.991
  130    H    ILE  18           H        ILE  18   5.256   3.813   1.556
  131    HA   ILE  18           HA       ILE  18   3.080   2.409   2.599
  132    HB   ILE  18           HB       ILE  18   3.592   3.121  -0.286
  133   HG12  ILE  18          2HG1      ILE  18   1.659   4.692   1.231
  134   HG13  ILE  18          1HG1      ILE  18   3.284   4.791   1.904
  135   HG21  ILE  18          1HG2      ILE  18   1.146   2.962  -0.501
  136   HG22  ILE  18          2HG2      ILE  18   1.050   2.393   1.171
  137   HG23  ILE  18          3HG2      ILE  18   1.878   1.417  -0.053
  138   HD11  ILE  18          1HD1      ILE  18   2.574   5.325  -0.964
  139   HD12  ILE  18          2HD1      ILE  18   4.156   5.521  -0.200
  140   HD13  ILE  18          3HD1      ILE  18   2.810   6.555   0.279
  141    H    LYS  19           H        LYS  19   5.492   1.447   0.200
  142    HA   LYS  19           HA       LYS  19   4.356  -1.043  -0.437
  143    HB2  LYS  19          2HB       LYS  19   6.715   0.416  -1.051
  144    HB3  LYS  19          1HB       LYS  19   7.188  -1.212  -0.546
  145    HG2  LYS  19          2HG       LYS  19   6.101  -2.209  -2.314
  146    HG3  LYS  19          1HG       LYS  19   4.967  -0.865  -2.511
  147    HD2  LYS  19          2HD       LYS  19   6.535   0.449  -3.618
  148    HD3  LYS  19          1HD       LYS  19   7.899  -0.494  -3.019
  149    HE2  LYS  19          2HE       LYS  19   5.833  -1.505  -4.950
  150    HE3  LYS  19          1HE       LYS  19   7.380  -0.817  -5.434
  151    HZ1  LYS  19          1HZ       LYS  19   6.995  -3.245  -3.770
  152    HZ2  LYS  19          2HZ       LYS  19   8.487  -2.557  -4.144
  153    HZ3  LYS  19          3HZ       LYS  19   7.530  -3.212  -5.378
  154    H    THR  20           H        THR  20   7.027  -0.233   1.764
  155    HA   THR  20           HA       THR  20   7.559  -2.876   2.416
  156    HB   THR  20           HB       THR  20   9.226  -1.141   2.781
  157    HG1  THR  20          1HG       THR  20   8.562  -3.046   4.565
  158   HG21  THR  20          1HG2      THR  20   7.335  -0.175   4.920
  159   HG22  THR  20          2HG2      THR  20   7.908   0.711   3.507
  160   HG23  THR  20          3HG2      THR  20   9.026   0.318   4.815
  161    H    ALA  21           H        ALA  21   5.400  -0.549   3.948
  162    HA   ALA  21           HA       ALA  21   5.020  -2.191   6.241
  163    HB1  ALA  21          1HB       ALA  21   3.223  -0.649   6.824
  164    HB2  ALA  21          2HB       ALA  21   3.320   0.073   5.215
  165    HB3  ALA  21          3HB       ALA  21   4.674   0.224   6.334
  166    H    PHE  22           H        PHE  22   2.857  -1.332   3.557
  167    HA   PHE  22           HA       PHE  22   0.704  -2.897   4.072
  168    HB2  PHE  22          2HB       PHE  22   0.324  -1.668   2.255
  169    HB3  PHE  22          1HB       PHE  22   1.998  -1.713   1.743
  170    HD1  PHE  22          1HD       PHE  22  -1.107  -3.733   1.740
  171    HD2  PHE  22          2HD       PHE  22   2.581  -2.856  -0.145
  172    HE1  PHE  22          1HE       PHE  22  -1.797  -5.111  -0.211
  173    HE2  PHE  22          2HE       PHE  22   1.943  -4.244  -2.060
  174    HZ   PHE  22           HZ       PHE  22  -0.242  -5.370  -2.100
  175    H    LEU  23           H        LEU  23   3.520  -4.059   2.184
  176    HA   LEU  23           HA       LEU  23   2.537  -6.681   1.837
  177    HB2  LEU  23          2HB       LEU  23   5.443  -5.881   1.941
  178    HB3  LEU  23          1HB       LEU  23   4.729  -7.226   1.061
  179    HG   LEU  23           HG       LEU  23   3.888  -4.441   0.384
  180   HD11  LEU  23          1HD1      LEU  23   5.717  -4.361  -1.274
  181   HD12  LEU  23          2HD1      LEU  23   6.413  -5.813  -0.549
  182   HD13  LEU  23          3HD1      LEU  23   6.308  -4.320   0.390
  183   HD21  LEU  23          1HD2      LEU  23   4.164  -7.035  -1.107
  184   HD22  LEU  23          2HD2      LEU  23   3.696  -5.508  -1.848
  185   HD23  LEU  23          3HD2      LEU  23   2.669  -6.239  -0.612
  186    H    SER  24           H        SER  24   5.030  -5.442   4.092
  187    HA   SER  24           HA       SER  24   5.547  -7.924   5.291
  188    HB2  SER  24          2HB       SER  24   7.186  -6.278   5.356
  189    HB3  SER  24          1HB       SER  24   6.137  -5.126   6.182
  190    HG   SER  24           HG       SER  24   7.469  -7.399   7.167
  191    H    TYR  25           H        TYR  25   3.184  -5.491   5.931
  192    HA   TYR  25           HA       TYR  25   2.654  -6.157   8.630
  193    HB2  TYR  25          2HB       TYR  25   1.302  -4.470   6.547
  194    HB3  TYR  25          1HB       TYR  25   0.379  -4.913   7.995
  195    HD1  TYR  25          1HD       TYR  25   4.027  -4.256   7.841
  196    HD2  TYR  25          2HD       TYR  25   0.220  -2.824   9.072
  197    HE1  TYR  25          1HE       TYR  25   5.125  -2.471   9.107
  198    HE2  TYR  25          2HE       TYR  25   1.303  -1.032  10.357
  199    HH   TYR  25           HH       TYR  25   4.680  -0.357  10.090
  200    H    ALA  26           H        ALA  26   0.910  -6.931   5.602
  201    HA   ALA  26           HA       ALA  26  -0.981  -8.528   7.046
  202    HB1  ALA  26          1HB       ALA  26  -1.446  -7.403   4.902
  203    HB2  ALA  26          2HB       ALA  26  -1.885  -9.111   4.944
  204    HB3  ALA  26          3HB       ALA  26  -0.413  -8.599   4.114
  205    H    GLN  27           H        GLN  27   1.308  -9.546   4.496
  206    HA   GLN  27           HA       GLN  27   1.241 -12.175   5.793
  207    HB2  GLN  27          2HB       GLN  27   1.955 -12.005   2.905
  208    HB3  GLN  27          1HB       GLN  27   1.074 -13.252   3.804
  209    HG2  GLN  27          2HG       GLN  27  -0.869 -11.633   3.950
  210    HG3  GLN  27          1HG       GLN  27   0.016 -10.629   2.794
  211   HE21  GLN  27          1HE2      GLN  27  -1.144 -10.820   1.010
  212   HE22  GLN  27          2HE2      GLN  27  -1.495 -12.333   0.219
  213    H    GLY  28           H        GLY  28   3.237  -9.678   4.525
  214    HA2  GLY  28          2HA       GLY  28   5.604  -9.607   4.635
  215    HA3  GLY  28          1HA       GLY  28   5.622 -11.351   4.855
  216    H    GLN  29           H        GLN  29   3.482 -11.388   2.609
  217    HA   GLN  29           HA       GLN  29   5.423 -11.404   0.434
  218    HB2  GLN  29          2HB       GLN  29   3.268 -12.560  -0.616
  219    HB3  GLN  29          1HB       GLN  29   4.489 -13.459   0.245
  220    HG2  GLN  29          2HG       GLN  29   3.005 -13.171   2.257
  221    HG3  GLN  29          1HG       GLN  29   1.797 -12.532   1.144
  222   HE21  GLN  29          1HE2      GLN  29   0.794 -13.865  -0.309
  223   HE22  GLN  29          2HE2      GLN  29   0.895 -15.592  -0.213
  224    H    ASP  30           H        ASP  30   3.840 -11.264  -1.736
  225    HA   ASP  30           HA       ASP  30   3.876  -8.481  -2.111
  226    HB2  ASP  30          2HB       ASP  30   2.850 -10.665  -3.903
  227    HB3  ASP  30          1HB       ASP  30   3.153  -9.006  -4.404
  228    H    LYS  31           H        LYS  31   1.371 -10.216  -0.730
  229    HA   LYS  31           HA       LYS  31  -0.529  -8.203  -1.666
  230    HB2  LYS  31          2HB       LYS  31  -1.043 -11.169  -1.442
  231    HB3  LYS  31          1HB       LYS  31  -2.328  -9.975  -1.530
  232    HG2  LYS  31          2HG       LYS  31  -0.813  -9.312  -3.686
  233    HG3  LYS  31          1HG       LYS  31  -0.617 -11.057  -3.640
  234    HD2  LYS  31          2HD       LYS  31  -3.238  -9.543  -3.683
  235    HD3  LYS  31          1HD       LYS  31  -2.542 -10.458  -5.017
  236    HE2  LYS  31          2HE       LYS  31  -3.271 -11.670  -2.370
  237    HE3  LYS  31          1HE       LYS  31  -4.398 -11.522  -3.713
  238    HZ1  LYS  31          1HZ       LYS  31  -3.403 -13.698  -3.713
  239    HZ2  LYS  31          2HZ       LYS  31  -1.847 -13.042  -3.707
  240    HZ3  LYS  31          3HZ       LYS  31  -2.837 -12.846  -5.062
  241    H    VAL  32           H        VAL  32  -2.598  -8.482  -0.225
  242    HA   VAL  32           HA       VAL  32  -1.717  -8.830   2.539
  243    HB   VAL  32           HB       VAL  32  -2.962  -6.430   1.274
  244   HG11  VAL  32          1HG1      VAL  32  -3.289  -5.624   3.680
  245   HG12  VAL  32          2HG1      VAL  32  -3.232  -7.327   4.131
  246   HG13  VAL  32          3HG1      VAL  32  -4.487  -6.746   3.040
  247   HG21  VAL  32          1HG2      VAL  32  -0.689  -6.931   3.154
  248   HG22  VAL  32          2HG2      VAL  32  -1.314  -5.329   2.782
  249   HG23  VAL  32          3HG2      VAL  32  -0.630  -6.326   1.500
  250    H    THR  33           H        THR  33  -3.099  -9.707   3.888
  251    HA   THR  33           HA       THR  33  -5.451 -10.974   2.983
  252    HB   THR  33           HB       THR  33  -5.780 -11.428   5.454
  253    HG1  THR  33          1HG       THR  33  -4.106 -10.778   6.836
  254   HG21  THR  33          1HG2      THR  33  -3.856 -12.948   5.613
  255   HG22  THR  33          2HG2      THR  33  -3.088 -12.114   4.262
  256   HG23  THR  33          3HG2      THR  33  -4.591 -13.003   4.011
  257    H    GLU  34           H        GLU  34  -7.488 -10.694   4.399
  258    HA   GLU  34           HA       GLU  34  -8.581  -8.182   3.784
  259    HB2  GLU  34          2HB       GLU  34 -10.075  -9.918   3.760
  260    HB3  GLU  34          1HB       GLU  34  -9.533 -10.571   5.305
  261    HG2  GLU  34          2HG       GLU  34 -10.767  -7.901   5.401
  262    HG3  GLU  34          1HG       GLU  34 -11.835  -9.221   4.932
  263    H    ALA  35           H        ALA  35  -6.959  -9.300   6.596
  264    HA   ALA  35           HA       ALA  35  -8.180  -7.634   8.548
  265    HB1  ALA  35          1HB       ALA  35  -6.309  -8.300   9.967
  266    HB2  ALA  35          2HB       ALA  35  -5.484  -8.978   8.565
  267    HB3  ALA  35          3HB       ALA  35  -6.995  -9.696   9.134
  268    H    MET  36           H        MET  36  -4.992  -7.601   7.045
  269    HA   MET  36           HA       MET  36  -4.320  -5.035   8.023
  270    HB2  MET  36          2HB       MET  36  -3.008  -7.150   6.761
  271    HB3  MET  36          1HB       MET  36  -2.868  -5.810   5.649
  272    HG2  MET  36          2HG       MET  36  -2.120  -5.680   8.551
  273    HG3  MET  36          1HG       MET  36  -0.985  -6.002   7.243
  274    HE1  MET  36          1HE       MET  36  -2.557  -4.024   5.062
  275    HE2  MET  36          2HE       MET  36  -0.829  -4.362   5.135
  276    HE3  MET  36          3HE       MET  36  -1.401  -2.694   5.139
  277    H    ILE  37           H        ILE  37  -6.026  -6.221   5.217
  278    HA   ILE  37           HA       ILE  37  -5.812  -3.768   3.743
  279    HB   ILE  37           HB       ILE  37  -7.223  -6.269   3.373
  280   HG12  ILE  37          2HG1      ILE  37  -5.917  -6.113   1.572
  281   HG13  ILE  37          1HG1      ILE  37  -6.875  -4.756   1.039
  282   HG21  ILE  37          1HG2      ILE  37  -8.558  -3.713   2.534
  283   HG22  ILE  37          2HG2      ILE  37  -9.212  -4.950   3.605
  284   HG23  ILE  37          3HG2      ILE  37  -8.945  -5.309   1.900
  285   HD11  ILE  37          1HD1      ILE  37  -4.482  -4.279   1.080
  286   HD12  ILE  37          2HD1      ILE  37  -4.497  -4.490   2.824
  287   HD13  ILE  37          3HD1      ILE  37  -5.434  -3.190   2.082
  288    H    ASP  38           H        ASP  38  -8.031  -5.034   6.149
  289    HA   ASP  38           HA       ASP  38  -9.870  -2.943   6.240
  290    HB2  ASP  38          2HB       ASP  38  -9.567  -5.300   7.440
  291    HB3  ASP  38          1HB       ASP  38  -8.976  -4.272   8.740
  292    H    GLN  39           H        GLN  39  -6.637  -3.284   7.556
  293    HA   GLN  39           HA       GLN  39  -6.559  -1.135   9.337
  294    HB2  GLN  39          2HB       GLN  39  -4.705  -2.541   9.437
  295    HB3  GLN  39          1HB       GLN  39  -4.539  -2.621   7.696
  296    HG2  GLN  39          2HG       GLN  39  -3.876  -0.105   9.185
  297    HG3  GLN  39          1HG       GLN  39  -2.734  -1.425   9.086
  298   HE21  GLN  39          1HE2      GLN  39  -2.639   1.324   7.994
  299   HE22  GLN  39          2HE2      GLN  39  -2.359   1.137   6.297
  300    H    LEU  40           H        LEU  40  -5.678  -1.214   5.887
  301    HA   LEU  40           HA       LEU  40  -5.307   1.614   5.790
  302    HB2  LEU  40          2HB       LEU  40  -4.097   0.217   4.275
  303    HB3  LEU  40          1HB       LEU  40  -5.591  -0.419   3.587
  304    HG   LEU  40           HG       LEU  40  -5.747   2.352   3.242
  305   HD11  LEU  40          1HD1      LEU  40  -3.125   1.798   3.748
  306   HD12  LEU  40          2HD1      LEU  40  -3.716   3.187   2.832
  307   HD13  LEU  40          3HD1      LEU  40  -3.186   1.730   1.984
  308   HD21  LEU  40          1HD2      LEU  40  -6.572   0.733   1.653
  309   HD22  LEU  40          2HD2      LEU  40  -4.935   0.157   1.337
  310   HD23  LEU  40          3HD2      LEU  40  -5.403   1.787   0.854
  311    H    ILE  41           H        ILE  41  -7.929  -0.525   4.660
  312    HA   ILE  41           HA       ILE  41  -9.396   1.506   3.396
  313    HB   ILE  41           HB       ILE  41 -10.234  -1.161   4.498
  314   HG12  ILE  41          2HG1      ILE  41  -8.720  -0.905   2.463
  315   HG13  ILE  41          1HG1      ILE  41 -10.162  -1.878   2.240
  316   HG21  ILE  41          1HG2      ILE  41 -12.181   0.295   4.613
  317   HG22  ILE  41          2HG2      ILE  41 -12.367  -0.891   3.321
  318   HG23  ILE  41          3HG2      ILE  41 -11.937   0.775   2.934
  319   HD11  ILE  41          1HD1      ILE  41  -9.761  -0.445   0.331
  320   HD12  ILE  41          2HD1      ILE  41  -9.788   0.978   1.371
  321   HD13  ILE  41          3HD1      ILE  41 -11.256   0.021   1.145
  322    H    CYS  42           H        CYS  42  -9.597   0.312   6.746
  323    HA   CYS  42           HA       CYS  42 -11.792   2.025   7.421
  324    HB2  CYS  42          2HB       CYS  42 -11.295  -0.061   8.663
  325    HB3  CYS  42          1HB       CYS  42  -9.793   0.652   9.235
  326    HG   CYS  42           HG       CYS  42 -11.145   0.990  11.456
  327    H    GLY  43           H        GLY  43  -8.401   2.340   7.127
  328    HA2  GLY  43          2HA       GLY  43  -7.719   4.443   8.752
  329    HA3  GLY  43          1HA       GLY  43  -7.070   4.193   7.139
  330    H    ALA  44           H        ALA  44  -9.218   4.764   5.490
  331    HA   ALA  44           HA       ALA  44  -9.586   7.618   6.085
  332    HB1  ALA  44          1HB       ALA  44  -8.591   6.982   3.898
  333    HB2  ALA  44          2HB       ALA  44 -10.068   7.938   3.755
  334    HB3  ALA  44          3HB       ALA  44 -10.114   6.196   3.480
  335    H    PHE  45           H        PHE  45 -11.495   4.825   4.941
  336    HA   PHE  45           HA       PHE  45 -13.859   6.219   5.979
  337    HB2  PHE  45          2HB       PHE  45 -14.931   4.624   4.093
  338    HB3  PHE  45          1HB       PHE  45 -14.610   6.353   3.937
  339    HD1  PHE  45          1HD       PHE  45 -12.661   3.194   3.670
  340    HD2  PHE  45          2HD       PHE  45 -13.631   6.935   1.914
  341    HE1  PHE  45          1HE       PHE  45 -11.173   2.679   1.772
  342    HE2  PHE  45          2HE       PHE  45 -12.138   6.442   0.019
  343    HZ   PHE  45           HZ       PHE  45 -10.901   4.311  -0.052
  344    HA   PRO  46           HA       PRO  46 -14.528   2.294   7.892
  345    HB2  PRO  46          2HB       PRO  46 -15.305   3.286  10.245
  346    HB3  PRO  46          1HB       PRO  46 -13.606   3.195   9.788
  347    HG2  PRO  46          2HG       PRO  46 -15.410   5.554   9.878
  348    HG3  PRO  46          1HG       PRO  46 -13.665   5.467  10.163
  349    HD2  PRO  46          2HD       PRO  46 -14.962   6.252   7.747
  350    HD3  PRO  46          1HD       PRO  46 -13.228   5.954   7.988
  351    H    GLY  47           H        GLY  47 -16.599   1.697   9.263
  352    HA2  GLY  47          2HA       GLY  47 -18.917   1.718   9.495
  353    HA3  GLY  47          1HA       GLY  47 -18.979   3.156   8.485
  354    H    LEU  48           H        LEU  48 -17.163   0.479   7.348
  355    HA   LEU  48           HA       LEU  48 -19.129   0.111   5.211
  356    HB2  LEU  48          2HB       LEU  48 -16.252  -0.784   5.393
  357    HB3  LEU  48          1HB       LEU  48 -17.297  -1.008   4.005
  358    HG   LEU  48           HG       LEU  48 -16.353   1.647   5.087
  359   HD11  LEU  48          1HD1      LEU  48 -15.074   1.740   2.992
  360   HD12  LEU  48          2HD1      LEU  48 -15.603   0.100   2.611
  361   HD13  LEU  48          3HD1      LEU  48 -14.579   0.393   4.015
  362   HD21  LEU  48          1HD2      LEU  48 -18.581   1.811   4.100
  363   HD22  LEU  48          2HD2      LEU  48 -18.002   1.001   2.645
  364   HD23  LEU  48          3HD2      LEU  48 -17.374   2.591   3.077
  365    H    SER  49           H        SER  49 -20.378  -1.647   5.169
  366    HA   SER  49           HA       SER  49 -19.769  -3.968   6.766
  367    HB2  SER  49          2HB       SER  49 -21.868  -3.631   4.600
  368    HB3  SER  49          1HB       SER  49 -21.820  -4.892   5.837
  369    HG   SER  49           HG       SER  49 -21.775  -2.868   7.299
  370    H    TRP  50           H        TRP  50 -19.611  -6.183   5.621
  371    HA   TRP  50           HA       TRP  50 -17.199  -6.092   4.260
  372    HB2  TRP  50          2HB       TRP  50 -18.019  -8.081   5.505
  373    HB3  TRP  50          1HB       TRP  50 -19.127  -8.411   4.178
  374    HD1  TRP  50           HD       TRP  50 -15.291  -7.955   4.583
  375    HE1  TRP  50          1HE       TRP  50 -14.165  -9.597   2.941
  376    HE3  TRP  50          3HE       TRP  50 -19.477  -9.927   2.425
  377    HZ2  TRP  50          2HZ       TRP  50 -14.976 -11.473   1.030
  378    HZ3  TRP  50          3HZ       TRP  50 -19.210 -11.639   0.685
  379    HH2  TRP  50           HH       TRP  50 -16.995 -12.407  -0.001
  380    H    GLU  51           H        GLU  51 -20.448  -6.459   2.895
  381    HA   GLU  51           HA       GLU  51 -19.692  -6.926   0.244
  382    HB2  GLU  51          2HB       GLU  51 -22.104  -5.496   1.356
  383    HB3  GLU  51          1HB       GLU  51 -21.906  -5.875  -0.347
  384    HG2  GLU  51          2HG       GLU  51 -21.780  -8.258   0.226
  385    HG3  GLU  51          1HG       GLU  51 -22.055  -7.855   1.905
  386    H    GLN  52           H        GLN  52 -20.355  -3.849   1.883
  387    HA   GLN  52           HA       GLN  52 -19.792  -2.213  -0.345
  388    HB2  GLN  52          2HB       GLN  52 -20.011  -1.724   2.600
  389    HB3  GLN  52          1HB       GLN  52 -19.426  -0.451   1.539
  390    HG2  GLN  52          2HG       GLN  52 -22.088  -1.837   1.390
  391    HG3  GLN  52          1HG       GLN  52 -21.782  -0.182   1.917
  392   HE21  GLN  52          1HE2      GLN  52 -19.704   0.089  -0.231
  393   HE22  GLN  52          2HE2      GLN  52 -20.618   0.359  -1.678
  394    H    LEU  53           H        LEU  53 -17.769  -3.551   2.190
  395    HA   LEU  53           HA       LEU  53 -15.583  -1.818   1.568
  396    HB2  LEU  53          2HB       LEU  53 -15.700  -2.632   3.806
  397    HB3  LEU  53          1HB       LEU  53 -15.800  -4.293   3.268
  398    HG   LEU  53           HG       LEU  53 -13.335  -2.838   2.499
  399   HD11  LEU  53          1HD1      LEU  53 -12.327  -3.139   4.705
  400   HD12  LEU  53          2HD1      LEU  53 -13.874  -3.688   5.347
  401   HD13  LEU  53          3HD1      LEU  53 -13.693  -2.025   4.786
  402   HD21  LEU  53          1HD2      LEU  53 -12.314  -4.975   3.019
  403   HD22  LEU  53          2HD2      LEU  53 -13.716  -5.213   1.974
  404   HD23  LEU  53          3HD2      LEU  53 -13.833  -5.562   3.698
  405    H    GLN  54           H        GLN  54 -16.478  -5.153   0.814
  406    HA   GLN  54           HA       GLN  54 -14.050  -5.887  -0.346
  407    HB2  GLN  54          2HB       GLN  54 -15.131  -7.788  -1.188
  408    HB3  GLN  54          1HB       GLN  54 -15.968  -7.396   0.292
  409    HG2  GLN  54          2HG       GLN  54 -17.870  -6.678  -0.808
  410    HG3  GLN  54          1HG       GLN  54 -17.014  -6.436  -2.329
  411   HE21  GLN  54          1HE2      GLN  54 -18.529  -8.763  -0.229
  412   HE22  GLN  54          2HE2      GLN  54 -18.561 -10.056  -1.372
  413    H    GLU  55           H        GLU  55 -16.858  -4.231  -1.698
  414    HA   GLU  55           HA       GLU  55 -15.830  -4.243  -4.369
  415    HB2  GLU  55          2HB       GLU  55 -17.649  -2.684  -4.874
  416    HB3  GLU  55          1HB       GLU  55 -18.216  -4.108  -4.023
  417    HG2  GLU  55          2HG       GLU  55 -18.351  -2.850  -1.968
  418    HG3  GLU  55          1HG       GLU  55 -17.701  -1.442  -2.757
  419    H    LYS  56           H        LYS  56 -15.615  -2.074  -1.627
  420    HA   LYS  56           HA       LYS  56 -14.611   0.254  -2.696
  421    HB2  LYS  56          2HB       LYS  56 -14.685  -0.862  -0.169
  422    HB3  LYS  56          1HB       LYS  56 -12.954  -0.798  -0.495
  423    HG2  LYS  56          2HG       LYS  56 -13.501   1.218   0.611
  424    HG3  LYS  56          1HG       LYS  56 -13.310   1.647  -1.094
  425    HD2  LYS  56          2HD       LYS  56 -15.766   1.489  -1.365
  426    HD3  LYS  56          1HD       LYS  56 -15.912   1.174   0.364
  427    HE2  LYS  56          2HE       LYS  56 -16.364   3.475   0.059
  428    HE3  LYS  56          1HE       LYS  56 -14.746   3.372   0.746
  429    HZ1  LYS  56          1HZ       LYS  56 -14.915   4.973  -1.091
  430    HZ2  LYS  56          2HZ       LYS  56 -15.325   3.720  -2.144
  431    HZ3  LYS  56          3HZ       LYS  56 -13.802   3.744  -1.416
  432    H    LYS  57           H        LYS  57 -13.095  -2.818  -2.260
  433    HA   LYS  57           HA       LYS  57 -10.506  -1.835  -3.223
  434    HB2  LYS  57          2HB       LYS  57 -10.399  -4.492  -2.196
  435    HB3  LYS  57          1HB       LYS  57  -9.672  -3.029  -1.530
  436    HG2  LYS  57          2HG       LYS  57 -11.860  -2.518  -0.455
  437    HG3  LYS  57          1HG       LYS  57 -12.441  -4.069  -1.032
  438    HD2  LYS  57          2HD       LYS  57 -10.060  -3.748   0.772
  439    HD3  LYS  57          1HD       LYS  57 -11.704  -4.087   1.321
  440    HE2  LYS  57          2HE       LYS  57 -10.017  -5.843  -0.455
  441    HE3  LYS  57          1HE       LYS  57 -10.448  -6.125   1.216
  442    HZ1  LYS  57          1HZ       LYS  57 -12.390  -5.941  -1.012
  443    HZ2  LYS  57          2HZ       LYS  57 -12.748  -6.299   0.602
  444    HZ3  LYS  57          3HZ       LYS  57 -11.846  -7.389  -0.325
  445    H    LYS  58           H        LYS  58 -12.982  -2.806  -4.799
  446    HA   LYS  58           HA       LYS  58 -12.403  -5.310  -5.952
  447    HB2  LYS  58          2HB       LYS  58 -14.079  -4.805  -7.588
  448    HB3  LYS  58          1HB       LYS  58 -14.614  -4.192  -6.033
  449    HG2  LYS  58          2HG       LYS  58 -13.862  -1.931  -6.718
  450    HG3  LYS  58          1HG       LYS  58 -13.470  -2.586  -8.308
  451    HD2  LYS  58          2HD       LYS  58 -16.203  -2.607  -7.026
  452    HD3  LYS  58          1HD       LYS  58 -15.667  -1.483  -8.272
  453    HE2  LYS  58          2HE       LYS  58 -15.887  -4.477  -8.561
  454    HE3  LYS  58          1HE       LYS  58 -17.011  -3.290  -9.218
  455    HZ1  LYS  58          1HZ       LYS  58 -15.532  -3.970 -10.937
  456    HZ2  LYS  58          2HZ       LYS  58 -14.170  -3.668  -9.988
  457    HZ3  LYS  58          3HZ       LYS  58 -15.131  -2.380 -10.522
  458    H    GLY  59           H        GLY  59 -10.192  -3.169  -6.060
  459    HA2  GLY  59          2HA       GLY  59  -9.537  -3.116  -8.876
  460    HA3  GLY  59          1HA       GLY  59  -8.502  -2.607  -7.544
  461    H    ARG  60           H        ARG  60  -9.991  -5.517  -8.848
  462    HA   ARG  60           HA       ARG  60  -9.381  -7.654  -8.987
  463    HB2  ARG  60          2HB       ARG  60  -7.238  -8.165  -9.938
  464    HB3  ARG  60          1HB       ARG  60  -7.880  -6.711 -10.660
  465    HG2  ARG  60          2HG       ARG  60  -5.654  -6.217 -10.442
  466    HG3  ARG  60          1HG       ARG  60  -6.341  -5.475  -8.996
  467    HD2  ARG  60          2HD       ARG  60  -5.467  -7.056  -7.598
  468    HD3  ARG  60          1HD       ARG  60  -5.346  -8.283  -8.864
  469    HE   ARG  60           HE       ARG  60  -3.416  -6.216  -8.202
  470   HH11  ARG  60          1HH1      ARG  60  -4.484  -8.547 -10.605
  471   HH12  ARG  60          2HH1      ARG  60  -2.937  -8.646 -11.380
  472   HH21  ARG  60          1HH2      ARG  60  -1.378  -6.362  -9.215
  473   HH22  ARG  60          2HH2      ARG  60  -1.166  -7.404 -10.588
  474    H    ALA  61           H        ALA  61  -9.270  -6.377  -6.308
  475    HA   ALA  61           HA       ALA  61  -7.377  -8.098  -4.907
  476    HB1  ALA  61          1HB       ALA  61  -8.003  -5.695  -4.172
  477    HB2  ALA  61          2HB       ALA  61  -7.891  -6.945  -2.931
  478    HB3  ALA  61          3HB       ALA  61  -9.469  -6.433  -3.536
  479    H    ALA  62           H        ALA  62 -10.290  -8.316  -6.337
  480    HA   ALA  62           HA       ALA  62 -11.969  -9.847  -6.360
  481    HB1  ALA  62          1HB       ALA  62 -10.060 -11.430  -6.289
  482    HB2  ALA  62          2HB       ALA  62 -11.511 -12.063  -5.512
  483    HB3  ALA  62          3HB       ALA  62 -10.182 -11.449  -4.531
  484    H    ALA  63           H        ALA  63 -12.497 -11.628  -3.932
  485    HA   ALA  63           HA       ALA  63 -14.176  -9.935  -2.444
  486    HB1  ALA  63          1HB       ALA  63 -14.407 -12.388  -2.470
  487    HB2  ALA  63          2HB       ALA  63 -14.320 -11.745  -0.832
  488    HB3  ALA  63          3HB       ALA  63 -12.912 -12.525  -1.546
  489    H    ASN  64           H        ASN  64 -11.030 -11.353  -1.568
  490    HA   ASN  64           HA       ASN  64 -10.192  -8.834  -0.424
  491    HB2  ASN  64          2HB       ASN  64 -10.676 -11.270   1.257
  492    HB3  ASN  64          1HB       ASN  64  -9.388 -10.152   1.683
  493   HD21  ASN  64          1HD2      ASN  64  -9.941  -7.988   2.189
  494   HD22  ASN  64          2HD2      ASN  64 -11.516  -7.607   2.796
  495    H    GLY  65           H        GLY  65  -7.955  -8.656  -0.228
  496    HA2  GLY  65          2HA       GLY  65  -5.809 -10.012  -0.277
  497    HA3  GLY  65          1HA       GLY  65  -6.487 -10.733  -1.732
  498    H    TYR  66           H        TYR  66  -5.823  -7.509  -0.366
  499    HA   TYR  66           HA       TYR  66  -5.574  -6.265  -2.912
  500    HB2  TYR  66          2HB       TYR  66  -5.447  -5.433  -0.194
  501    HB3  TYR  66          1HB       TYR  66  -3.986  -4.899  -1.000
  502    HD1  TYR  66          1HD       TYR  66  -5.141  -2.758  -0.123
  503    HD2  TYR  66          2HD       TYR  66  -6.557  -4.949  -3.438
  504    HE1  TYR  66          1HE       TYR  66  -6.287  -0.741  -0.920
  505    HE2  TYR  66          2HE       TYR  66  -7.729  -2.962  -4.267
  506    HH   TYR  66           HH       TYR  66  -7.112   0.124  -3.155
  507    H    ASP  67           H        ASP  67  -3.890  -5.966  -4.197
  508    HA   ASP  67           HA       ASP  67  -1.418  -7.278  -3.383
  509    HB2  ASP  67          2HB       ASP  67  -1.280  -8.166  -5.454
  510    HB3  ASP  67          1HB       ASP  67  -3.001  -7.779  -5.542
  511    H    ARG  68           H        ARG  68   0.484  -6.219  -4.593
  512    HA   ARG  68           HA       ARG  68   0.734  -3.684  -3.455
  513    HB2  ARG  68          2HB       ARG  68   2.903  -3.571  -4.673
  514    HB3  ARG  68          1HB       ARG  68   2.673  -5.077  -3.794
  515    HG2  ARG  68          2HG       ARG  68   1.894  -6.083  -5.973
  516    HG3  ARG  68          1HG       ARG  68   2.478  -4.611  -6.748
  517    HD2  ARG  68          2HD       ARG  68   4.704  -5.058  -5.659
  518    HD3  ARG  68          1HD       ARG  68   4.068  -6.636  -5.200
  519    HE   ARG  68           HE       ARG  68   3.640  -6.378  -7.922
  520   HH11  ARG  68          1HH1      ARG  68   6.369  -6.508  -5.742
  521   HH12  ARG  68          2HH1      ARG  68   7.450  -7.148  -6.933
  522   HH21  ARG  68          1HH2      ARG  68   5.048  -7.254  -9.487
  523   HH22  ARG  68          2HH2      ARG  68   6.692  -7.598  -9.060
  524    H    SER  69           H        SER  69  -0.138  -4.612  -6.746
  525    HA   SER  69           HA       SER  69   0.132  -1.994  -7.832
  526    HB2  SER  69          2HB       SER  69  -1.605  -4.264  -8.830
  527    HB3  SER  69          1HB       SER  69  -1.032  -2.882  -9.764
  528    HG   SER  69           HG       SER  69   1.130  -3.915  -8.790
  529    H    ALA  70           H        ALA  70  -2.623  -3.865  -6.608
  530    HA   ALA  70           HA       ALA  70  -4.596  -1.884  -7.094
  531    HB1  ALA  70          1HB       ALA  70  -5.033  -4.322  -6.693
  532    HB2  ALA  70          2HB       ALA  70  -6.045  -3.225  -5.748
  533    HB3  ALA  70          3HB       ALA  70  -4.678  -4.036  -4.980
  534    H    PHE  71           H        PHE  71  -2.850  -2.856  -4.189
  535    HA   PHE  71           HA       PHE  71  -4.014  -1.091  -2.392
  536    HB2  PHE  71          2HB       PHE  71  -2.593  -2.985  -1.723
  537    HB3  PHE  71          1HB       PHE  71  -1.191  -2.186  -2.392
  538    HD1  PHE  71          1HD       PHE  71  -3.564  -2.250   0.360
  539    HD2  PHE  71          2HD       PHE  71  -0.187  -0.287  -1.298
  540    HE1  PHE  71          1HE       PHE  71  -3.183  -1.117   2.505
  541    HE2  PHE  71          2HE       PHE  71   0.203   0.838   0.843
  542    HZ   PHE  71           HZ       PHE  71  -1.291   0.442   2.739
  543    H    PHE  72           H        PHE  72  -1.155  -0.685  -4.456
  544    HA   PHE  72           HA       PHE  72  -0.431   1.829  -3.408
  545    HB2  PHE  72          2HB       PHE  72   1.132   0.424  -4.676
  546    HB3  PHE  72          1HB       PHE  72   0.188   0.700  -6.136
  547    HD1  PHE  72          1HD       PHE  72   1.838   2.657  -3.431
  548    HD2  PHE  72          2HD       PHE  72   0.921   2.337  -7.573
  549    HE1  PHE  72          1HE       PHE  72   3.135   4.695  -3.868
  550    HE2  PHE  72          2HE       PHE  72   2.221   4.375  -8.021
  551    HZ   PHE  72           HZ       PHE  72   3.330   5.560  -6.168
  552    H    SER  73           H        SER  73  -2.580   0.859  -5.963
  553    HA   SER  73           HA       SER  73  -2.900   3.320  -7.250
  554    HB2  SER  73          2HB       SER  73  -4.873   1.042  -6.939
  555    HB3  SER  73          1HB       SER  73  -5.052   2.381  -8.074
  556    HG   SER  73           HG       SER  73  -3.063   0.356  -8.037
  557    H    LEU  74           H        LEU  74  -4.532   1.961  -4.421
  558    HA   LEU  74           HA       LEU  74  -6.380   4.137  -4.170
  559    HB2  LEU  74          2HB       LEU  74  -6.775   1.861  -3.264
  560    HB3  LEU  74          1HB       LEU  74  -5.511   2.144  -2.085
  561    HG   LEU  74           HG       LEU  74  -6.817   3.853  -1.004
  562   HD11  LEU  74          1HD1      LEU  74  -9.088   4.403  -1.772
  563   HD12  LEU  74          2HD1      LEU  74  -8.831   3.415  -3.211
  564   HD13  LEU  74          3HD1      LEU  74  -7.863   4.868  -2.953
  565   HD21  LEU  74          1HD2      LEU  74  -8.822   2.486  -0.390
  566   HD22  LEU  74          2HD2      LEU  74  -7.281   1.635  -0.279
  567   HD23  LEU  74          3HD2      LEU  74  -8.345   1.351  -1.656
  568    H    VAL  75           H        VAL  75  -3.289   3.346  -2.607
  569    HA   VAL  75           HA       VAL  75  -3.458   5.475  -0.709
  570    HB   VAL  75           HB       VAL  75  -0.920   4.087  -1.554
  571   HG11  VAL  75          1HG1      VAL  75  -0.539   4.354   0.972
  572   HG12  VAL  75          2HG1      VAL  75  -1.765   5.618   0.840
  573   HG13  VAL  75          3HG1      VAL  75  -0.282   5.723  -0.111
  574   HG21  VAL  75          1HG2      VAL  75  -3.105   3.116   0.263
  575   HG22  VAL  75          2HG2      VAL  75  -1.438   2.558   0.411
  576   HG23  VAL  75          3HG2      VAL  75  -2.337   2.268  -1.086
  577    H    ALA  76           H        ALA  76  -2.113   5.144  -3.916
  578    HA   ALA  76           HA       ALA  76  -0.350   7.330  -3.887
  579    HB1  ALA  76          1HB       ALA  76  -0.370   7.172  -6.302
  580    HB2  ALA  76          2HB       ALA  76  -1.827   6.180  -6.245
  581    HB3  ALA  76          3HB       ALA  76  -0.313   5.561  -5.582
  582    H    SER  77           H        SER  77  -3.790   7.246  -4.029
  583    HA   SER  77           HA       SER  77  -3.846  10.044  -4.912
  584    HB2  SER  77          2HB       SER  77  -6.380   9.601  -4.967
  585    HB3  SER  77          1HB       SER  77  -5.385   8.822  -6.194
  586    HG   SER  77           HG       SER  77  -6.117   7.559  -3.754
  587    H    ASP  78           H        ASP  78  -4.256   8.037  -2.138
  588    HA   ASP  78           HA       ASP  78  -5.593  10.217  -0.700
  589    HB2  ASP  78          2HB       ASP  78  -5.478   7.245  -0.228
  590    HB3  ASP  78          1HB       ASP  78  -6.055   8.370   0.999
  591    H    GLU  79           H        GLU  79  -4.132  11.497   0.217
  592    HA   GLU  79           HA       GLU  79  -1.506  10.727   0.891
  593    HB2  GLU  79          2HB       GLU  79  -1.172  12.899   1.491
  594    HB3  GLU  79          1HB       GLU  79  -2.591  13.097   0.484
  595    HG2  GLU  79          2HG       GLU  79  -4.008  13.228   2.426
  596    HG3  GLU  79          1HG       GLU  79  -2.641  12.863   3.483
  597    H    GLN  80           H        GLN  80  -4.500  10.801   2.739
  598    HA   GLN  80           HA       GLN  80  -3.295  10.622   5.296
  599    HB2  GLN  80          2HB       GLN  80  -5.442  10.311   6.164
  600    HB3  GLN  80          1HB       GLN  80  -5.712  11.224   4.689
  601    HG2  GLN  80          2HG       GLN  80  -5.850   8.330   4.372
  602    HG3  GLN  80          1HG       GLN  80  -7.115   9.060   5.368
  603   HE21  GLN  80          1HE2      GLN  80  -7.283   7.858   2.724
  604   HE22  GLN  80          2HE2      GLN  80  -7.914   9.086   1.684
  605    H    TYR  81           H        TYR  81  -3.941   8.389   2.830
  606    HA   TYR  81           HA       TYR  81  -3.526   6.014   4.399
  607    HB2  TYR  81          2HB       TYR  81  -3.897   6.579   1.475
  608    HB3  TYR  81          1HB       TYR  81  -3.303   5.009   2.001
  609    HD1  TYR  81          1HD       TYR  81  -5.697   4.936   0.493
  610    HD2  TYR  81          2HD       TYR  81  -5.249   5.805   4.628
  611    HE1  TYR  81          1HE       TYR  81  -7.987   4.114   0.916
  612    HE2  TYR  81          2HE       TYR  81  -7.511   5.017   5.042
  613    HH   TYR  81           HH       TYR  81  -9.279   3.225   2.830
  614    H    VAL  82           H        VAL  82  -1.701   7.986   2.132
  615    HA   VAL  82           HA       VAL  82   0.651   6.475   2.098
  616    HB   VAL  82           HB       VAL  82   0.068   9.393   1.689
  617   HG11  VAL  82          1HG1      VAL  82   2.282   9.916   1.168
  618   HG12  VAL  82          2HG1      VAL  82   2.777   8.221   1.181
  619   HG13  VAL  82          3HG1      VAL  82   2.379   9.032   2.695
  620   HG21  VAL  82          1HG2      VAL  82  -0.648   7.872  -0.052
  621   HG22  VAL  82          2HG2      VAL  82   0.968   7.173  -0.144
  622   HG23  VAL  82          3HG2      VAL  82   0.703   8.849  -0.629
  623    H    ARG  83           H        ARG  83  -0.233   9.250   4.149
  624    HA   ARG  83           HA       ARG  83   2.002   8.884   5.859
  625    HB2  ARG  83          2HB       ARG  83   0.813  10.455   7.414
  626    HB3  ARG  83          1HB       ARG  83   1.185  11.079   5.824
  627    HG2  ARG  83          2HG       ARG  83  -1.220  10.352   5.246
  628    HG3  ARG  83          1HG       ARG  83  -1.465  10.322   6.993
  629    HD2  ARG  83          2HD       ARG  83  -0.938  12.550   5.129
  630    HD3  ARG  83          1HD       ARG  83  -2.131  12.441   6.413
  631    HE   ARG  83           HE       ARG  83   0.094  12.489   7.849
  632   HH11  ARG  83          1HH1      ARG  83  -0.870  14.493   5.130
  633   HH12  ARG  83          2HH1      ARG  83   0.091  15.843   5.642
  634   HH21  ARG  83          1HH2      ARG  83   1.350  14.289   8.508
  635   HH22  ARG  83          2HH2      ARG  83   1.333  15.736   7.549
  636    H    PHE  84           H        PHE  84  -1.193   7.530   5.759
  637    HA   PHE  84           HA       PHE  84  -1.402   6.703   8.439
  638    HB2  PHE  84          2HB       PHE  84  -3.019   6.313   6.379
  639    HB3  PHE  84          1HB       PHE  84  -2.155   4.783   6.258
  640    HD1  PHE  84          1HD       PHE  84  -2.397   3.084   7.938
  641    HD2  PHE  84          2HD       PHE  84  -4.474   6.779   8.245
  642    HE1  PHE  84          1HE       PHE  84  -3.867   2.108   9.653
  643    HE2  PHE  84          2HE       PHE  84  -5.949   5.814   9.961
  644    HZ   PHE  84           HZ       PHE  84  -5.647   3.476  10.668
  645    H    ILE  85           H        ILE  85   0.195   5.162   5.681
  646    HA   ILE  85           HA       ILE  85   1.296   3.087   7.341
  647    HB   ILE  85           HB       ILE  85   1.546   3.758   4.446
  648   HG12  ILE  85          2HG1      ILE  85   0.838   1.292   6.051
  649   HG13  ILE  85          1HG1      ILE  85  -0.262   2.308   5.129
  650   HG21  ILE  85          1HG2      ILE  85   3.220   1.832   4.326
  651   HG22  ILE  85          2HG2      ILE  85   3.478   2.118   6.045
  652   HG23  ILE  85          3HG2      ILE  85   3.815   3.396   4.881
  653   HD11  ILE  85          1HD1      ILE  85   0.821   1.589   3.058
  654   HD12  ILE  85          2HD1      ILE  85   0.176   0.229   3.977
  655   HD13  ILE  85          3HD1      ILE  85   1.908   0.552   3.987
  656    H    ALA  86           H        ALA  86   2.664   5.913   5.648
  657    HA   ALA  86           HA       ALA  86   5.290   5.710   6.388
  658    HB1  ALA  86          1HB       ALA  86   3.749   8.297   6.349
  659    HB2  ALA  86          2HB       ALA  86   4.319   7.455   4.909
  660    HB3  ALA  86          3HB       ALA  86   5.477   8.080   6.083
  661    H    GLN  87           H        GLN  87   2.633   6.964   8.387
  662    HA   GLN  87           HA       GLN  87   4.387   7.807  10.468
  663    HB2  GLN  87          2HB       GLN  87   1.405   7.352  10.492
  664    HB3  GLN  87          1HB       GLN  87   2.313   8.024  11.840
  665    HG2  GLN  87          2HG       GLN  87   1.978   9.225   9.104
  666    HG3  GLN  87          1HG       GLN  87   1.283   9.805  10.615
  667   HE21  GLN  87          1HE2      GLN  87   3.032  11.128   8.678
  668   HE22  GLN  87          2HE2      GLN  87   4.412  11.656   9.571
  669    H    HIS  88           H        HIS  88   2.450   4.930   9.818
  670    HA   HIS  88           HA       HIS  88   2.997   3.629  12.294
  671    HB2  HIS  88          2HB       HIS  88   1.992   2.670   9.628
  672    HB3  HIS  88          1HB       HIS  88   2.393   1.521  10.896
  673    HD1  HIS  88          1HD       HIS  88   1.194   3.078  13.305
  674    HD2  HIS  88          2HD       HIS  88  -0.748   2.452   9.668
  675    HE1  HIS  88          1HE       HIS  88  -1.258   3.259  13.809
  676    HE2  HIS  88          2HE       HIS  88  -2.405   3.025  11.582
  677    H    PHE  89           H        PHE  89   4.627   3.698   9.178
  678    HA   PHE  89           HA       PHE  89   6.853   2.162  10.307
  679    HB2  PHE  89          2HB       PHE  89   5.056   0.770   8.984
  680    HB3  PHE  89          1HB       PHE  89   5.845   1.466   7.579
  681    HD1  PHE  89          1HD       PHE  89   7.793   0.529   6.725
  682    HD2  PHE  89          2HD       PHE  89   6.485  -0.538  10.630
  683    HE1  PHE  89          1HE       PHE  89   9.453  -1.285   6.782
  684    HE2  PHE  89          2HE       PHE  89   8.162  -2.337  10.705
  685    HZ   PHE  89           HZ       PHE  89   9.650  -2.713   8.779
  686    HA   PRO  90           HA       PRO  90   8.706   5.670   8.070
  687    HB2  PRO  90          2HB       PRO  90  11.101   4.594   9.421
  688    HB3  PRO  90          1HB       PRO  90  10.440   6.229   9.445
  689    HG2  PRO  90          2HG       PRO  90  10.253   4.639  11.580
  690    HG3  PRO  90          1HG       PRO  90   8.937   5.743  11.135
  691    HD2  PRO  90          2HD       PRO  90   9.168   2.790  10.688
  692    HD3  PRO  90          1HD       PRO  90   7.762   3.746  11.202
  693    H    CYS  91           H        CYS  91  10.236   5.828   6.387
  694    HA   CYS  91           HA       CYS  91  10.544   3.535   4.737
  695    HB2  CYS  91          2HB       CYS  91  11.840   5.074   3.307
  696    HB3  CYS  91          1HB       CYS  91  10.371   5.872   3.906
  697    HG   CYS  91           HG       CYS  91  12.844   6.408   6.016
  698    H    ALA  92           H        ALA  92  12.294   2.349   4.277
  699    HA   ALA  92           HA       ALA  92  13.875   1.473   6.318
  700    HB1  ALA  92          1HB       ALA  92  13.574   0.275   4.184
  701    HB2  ALA  92          2HB       ALA  92  15.247   0.316   4.758
  702    HB3  ALA  92          3HB       ALA  92  14.734   1.379   3.439
  703    HA   PRO  93           HA       PRO  93  16.957   4.477   7.039
  704    HB2  PRO  93          2HB       PRO  93  18.473   3.072   8.713
  705    HB3  PRO  93          1HB       PRO  93  16.809   3.476   9.137
  706    HG2  PRO  93          2HG       PRO  93  17.886   0.915   7.992
  707    HG3  PRO  93          1HG       PRO  93  16.795   1.139   9.374
  708    HD2  PRO  93          2HD       PRO  93  15.921   0.515   6.866
  709    HD3  PRO  93          1HD       PRO  93  14.966   1.473   8.023
  710    H    GLU  94           H        GLU  94  17.683   1.521   5.462
  711    HA   GLU  94           HA       GLU  94  20.390   2.428   4.858
  712    HB2  GLU  94          2HB       GLU  94  19.438  -0.339   5.575
  713    HB3  GLU  94          1HB       GLU  94  20.960  -0.059   4.742
  714    HG2  GLU  94          2HG       GLU  94  20.224   1.068   7.436
  715    HG3  GLU  94          1HG       GLU  94  21.241  -0.346   7.159
  716    H    GLU  95           H        GLU  95  20.994   2.315   2.846
  717    HA   GLU  95           HA       GLU  95  19.059   1.389   0.846
  718    HB2  GLU  95          2HB       GLU  95  20.318   2.841  -0.721
  719    HB3  GLU  95          1HB       GLU  95  19.668   3.726   0.649
  720    HG2  GLU  95          2HG       GLU  95  21.764   3.872   1.676
  721    HG3  GLU  95          1HG       GLU  95  22.496   2.757   0.523
  722    H    GLU  96           H        GLU  96  21.680   0.273   2.417
  723    HA   GLU  96           HA       GLU  96  23.248  -0.747   0.260
  724    HB2  GLU  96          2HB       GLU  96  24.169  -0.249   2.508
  725    HB3  GLU  96          1HB       GLU  96  23.208  -1.553   3.174
  726    HG2  GLU  96          2HG       GLU  96  25.234  -2.033   1.018
  727    HG3  GLU  96          1HG       GLU  96  25.680  -1.980   2.719
  728    H    LYS  97           H        LYS  97  21.462  -2.558   2.780
  729    HA   LYS  97           HA       LYS  97  21.238  -4.766   0.925
  730    HB2  LYS  97          2HB       LYS  97  21.860  -5.228   3.253
  731    HB3  LYS  97          1HB       LYS  97  20.320  -4.597   3.796
  732    HG2  LYS  97          2HG       LYS  97  20.300  -7.016   3.779
  733    HG3  LYS  97          1HG       LYS  97  19.155  -6.375   2.600
  734    HD2  LYS  97          2HD       LYS  97  20.351  -8.229   1.620
  735    HD3  LYS  97          1HD       LYS  97  20.843  -6.737   0.823
  736    HE2  LYS  97          2HE       LYS  97  22.776  -8.132   1.247
  737    HE3  LYS  97          1HE       LYS  97  22.860  -6.674   2.230
  738    HZ1  LYS  97          1HZ       LYS  97  21.911  -9.312   3.202
  739    HZ2  LYS  97          2HZ       LYS  97  22.124  -7.918   4.135
  740    HZ3  LYS  97          3HZ       LYS  97  23.462  -8.692   3.455
  741    HA   PRO  98           HA       PRO  98  16.541  -3.703   1.351
  742    HB2  PRO  98          2HB       PRO  98  16.569  -0.924   2.328
  743    HB3  PRO  98          1HB       PRO  98  15.551  -2.275   2.834
  744    HG2  PRO  98          2HG       PRO  98  17.479  -1.318   4.426
  745    HG3  PRO  98          1HG       PRO  98  17.108  -3.052   4.359
  746    HD2  PRO  98          2HD       PRO  98  19.333  -1.539   3.029
  747    HD3  PRO  98          1HD       PRO  98  19.383  -3.091   3.885
  748    HA   PRO  99           HA       PRO  99  17.270  -1.845  -2.613
  749    HB2  PRO  99          2HB       PRO  99  14.321  -1.606  -2.763
  750    HB3  PRO  99          1HB       PRO  99  15.440  -2.429  -3.849
  751    HG2  PRO  99          2HG       PRO  99  13.855  -3.805  -2.195
  752    HG3  PRO  99          1HG       PRO  99  15.504  -4.343  -2.560
  753    HD2  PRO  99          2HD       PRO  99  14.450  -2.980  -0.117
  754    HD3  PRO  99          1HD       PRO  99  15.668  -4.263  -0.260
  755    H    GLU 100           H        GLU 100  17.869   0.188  -2.930
  756    HA   GLU 100           HA       GLU 100  17.065   2.269  -1.190
  757    HB2  GLU 100          2HB       GLU 100  18.497   3.704  -2.572
  758    HB3  GLU 100          1HB       GLU 100  19.301   2.204  -2.141
  759    HG2  GLU 100          2HG       GLU 100  18.840   1.322  -4.363
  760    HG3  GLU 100          1HG       GLU 100  18.005   2.821  -4.770
  761    H    ILE 101           H        ILE 101  15.797   1.128  -4.133
  762    HA   ILE 101           HA       ILE 101  13.972   3.421  -4.205
  763    HB   ILE 101           HB       ILE 101  13.768   3.058  -6.690
  764   HG12  ILE 101          2HG1      ILE 101  16.314   1.475  -6.267
  765   HG13  ILE 101          1HG1      ILE 101  14.778   0.841  -6.832
  766   HG21  ILE 101          1HG2      ILE 101  15.784   4.359  -7.219
  767   HG22  ILE 101          2HG2      ILE 101  16.428   3.988  -5.619
  768   HG23  ILE 101          3HG2      ILE 101  14.961   4.955  -5.777
  769   HD11  ILE 101          1HD1      ILE 101  16.456   2.836  -8.289
  770   HD12  ILE 101          2HD1      ILE 101  14.925   2.148  -8.826
  771   HD13  ILE 101          3HD1      ILE 101  16.330   1.112  -8.633
  772    H    ASP 102           H        ASP 102  13.685   1.052  -2.771
  773    HA   ASP 102           HA       ASP 102  12.165  -0.983  -3.910
  774    HB2  ASP 102          2HB       ASP 102  13.014  -0.902  -1.531
  775    HB3  ASP 102          1HB       ASP 102  11.727   0.226  -1.162
  776    H    ALA 103           H        ALA 103  11.374   2.165  -2.792
  777    HA   ALA 103           HA       ALA 103   8.739   2.541  -2.767
  778    HB1  ALA 103          1HB       ALA 103   9.580   4.619  -2.692
  779    HB2  ALA 103          2HB       ALA 103   9.605   4.592  -4.467
  780    HB3  ALA 103          3HB       ALA 103  11.038   4.110  -3.549
  781    H    LEU 104           H        LEU 104  10.614   2.474  -5.782
  782    HA   LEU 104           HA       LEU 104   8.069   2.508  -7.241
  783    HB2  LEU 104          2HB       LEU 104  10.771   3.238  -8.363
  784    HB3  LEU 104          1HB       LEU 104   9.197   3.574  -9.053
  785    HG   LEU 104           HG       LEU 104   9.856   5.639  -8.242
  786   HD11  LEU 104          1HD1      LEU 104   7.645   5.229  -7.462
  787   HD12  LEU 104          2HD1      LEU 104   8.526   6.160  -6.251
  788   HD13  LEU 104          3HD1      LEU 104   8.264   4.433  -6.016
  789   HD21  LEU 104          1HD2      LEU 104  10.981   4.264  -5.837
  790   HD22  LEU 104          2HD2      LEU 104  10.886   6.013  -6.028
  791   HD23  LEU 104          3HD2      LEU 104  11.870   5.057  -7.136
  792    H    GLU 105           H        GLU 105  10.939   0.745  -6.642
  793    HA   GLU 105           HA       GLU 105  11.665  -1.311  -7.216
  794    HB2  GLU 105          2HB       GLU 105   9.314  -1.836  -6.467
  795    HB3  GLU 105          1HB       GLU 105   8.844  -1.835  -8.159
  796    HG2  GLU 105          2HG       GLU 105  10.518  -3.636  -8.551
  797    HG3  GLU 105          1HG       GLU 105  10.780  -3.697  -6.808
  798    H    LEU 106           H        LEU 106   9.326  -1.691  -9.755
  799    HA   LEU 106           HA       LEU 106   9.550  -2.051 -11.983
  800    HB2  LEU 106          2HB       LEU 106   9.624   0.441 -11.790
  801    HB3  LEU 106          1HB       LEU 106  11.372   0.350 -11.824
  802    HG   LEU 106           HG       LEU 106  11.258  -0.635 -14.094
  803   HD11  LEU 106          1HD1      LEU 106   8.303  -0.099 -13.822
  804   HD12  LEU 106          2HD1      LEU 106   9.077  -1.676 -13.984
  805   HD13  LEU 106          3HD1      LEU 106   9.127  -0.528 -15.321
  806   HD21  LEU 106          1HD2      LEU 106  11.566   1.767 -13.807
  807   HD22  LEU 106          2HD2      LEU 106   9.818   1.997 -13.773
  808   HD23  LEU 106          3HD2      LEU 106  10.603   1.424 -15.243
  809    H    LYS 107           H        LYS 107  11.043  -3.842 -10.761
  810    HA   LYS 107           HA       LYS 107  13.200  -4.333 -12.573
  811    HB2  LYS 107          2HB       LYS 107  14.267  -2.762 -10.960
  812    HB3  LYS 107          1HB       LYS 107  13.894  -3.885  -9.662
  813    HG2  LYS 107          2HG       LYS 107  16.173  -4.192 -10.234
  814    HG3  LYS 107          1HG       LYS 107  15.290  -5.589 -10.851
  815    HD2  LYS 107          2HD       LYS 107  15.250  -4.557 -13.081
  816    HD3  LYS 107          1HD       LYS 107  16.167  -3.188 -12.453
  817    HE2  LYS 107          2HE       LYS 107  17.108  -6.052 -12.480
  818    HE3  LYS 107          1HE       LYS 107  17.585  -4.818 -13.642
  819    HZ1  LYS 107          1HZ       LYS 107  19.246  -5.109 -11.910
  820    HZ2  LYS 107          2HZ       LYS 107  18.113  -4.728 -10.718
  821    HZ3  LYS 107          3HZ       LYS 107  18.582  -3.556 -11.840
  822    H    THR 108           H        THR 108  13.218  -6.466 -12.901
  823    HA   THR 108           HA       THR 108  11.948  -8.279 -11.057
  824    HB   THR 108           HB       THR 108  12.918 -10.021 -12.702
  825    HG1  THR 108          1HG       THR 108  14.480  -8.500 -13.596
  826   HG21  THR 108          1HG2      THR 108  10.994  -7.924 -13.711
  827   HG22  THR 108          2HG2      THR 108  10.577  -9.319 -12.715
  828   HG23  THR 108          3HG2      THR 108  11.174  -9.553 -14.358
  829    H    GLN 109           H        GLN 109  13.269  -7.840  -9.211
  830    HA   GLN 109           HA       GLN 109  16.057  -8.773  -9.413
  831    HB2  GLN 109          2HB       GLN 109  16.512  -7.265  -7.502
  832    HB3  GLN 109          1HB       GLN 109  15.921  -6.405  -8.918
  833    HG2  GLN 109          2HG       GLN 109  13.674  -6.345  -7.922
  834    HG3  GLN 109          1HG       GLN 109  14.306  -7.153  -6.489
  835   HE21  GLN 109          1HE2      GLN 109  13.040  -4.541  -6.782
  836   HE22  GLN 109          2HE2      GLN 109  14.168  -3.393  -6.149
  837    H    LYS 110           H        LYS 110  16.964  -9.825  -7.584
  838    HA   LYS 110           HA       LYS 110  15.031 -11.283  -5.940
  839    HB2  LYS 110          2HB       LYS 110  16.756 -12.593  -7.139
  840    HB3  LYS 110          1HB       LYS 110  18.012 -11.700  -6.290
  841    HG2  LYS 110          2HG       LYS 110  17.179 -12.593  -4.157
  842    HG3  LYS 110          1HG       LYS 110  15.967 -13.523  -5.040
  843    HD2  LYS 110          2HD       LYS 110  17.738 -14.727  -6.215
  844    HD3  LYS 110          1HD       LYS 110  18.957 -13.786  -5.354
  845    HE2  LYS 110          2HE       LYS 110  18.697 -15.960  -4.316
  846    HE3  LYS 110          1HE       LYS 110  18.134 -14.698  -3.224
  847    HZ1  LYS 110          1HZ       LYS 110  15.862 -15.201  -3.862
  848    HZ2  LYS 110          2HZ       LYS 110  16.626 -16.586  -3.267
  849    HZ3  LYS 110          3HZ       LYS 110  16.396 -16.399  -4.928
  850    H    GLY 111           H        GLY 111  14.459  -9.852  -4.358
  851    HA2  GLY 111          2HA       GLY 111  16.406  -8.136  -3.101
  852    HA3  GLY 111          1HA       GLY 111  14.698  -8.245  -2.709
  853    H    PHE 112           H        PHE 112  17.737 -10.026  -2.406
  854    HA   PHE 112           HA       PHE 112  16.966 -10.733   0.326
  855    HB2  PHE 112          2HB       PHE 112  16.542 -12.685  -1.214
  856    HB3  PHE 112          1HB       PHE 112  18.265 -12.704  -1.569
  857    HD1  PHE 112          1HD       PHE 112  19.870 -13.457   0.088
  858    HD2  PHE 112          2HD       PHE 112  15.701 -13.405   0.933
  859    HE1  PHE 112          1HE       PHE 112  20.251 -14.893   2.049
  860    HE2  PHE 112          2HE       PHE 112  16.076 -14.837   2.896
  861    HZ   PHE 112           HZ       PHE 112  18.354 -15.584   3.457
  Start of MODEL   20
    1    H1   GLY   1          1HT       GLY   1   6.046  20.979  -4.988
    2    H2   GLY   1          2HT       GLY   1   4.686  20.120  -5.510
    3    H    GLY   1           H        GLY   1   4.484  20.014  -4.626
    4    H3   GLY   1          3HT       GLY   1   4.870  20.492  -3.874
    5    HA2  GLY   1          1HA       GLY   1   4.646  22.836  -4.321
    6    HA3  GLY   1          2HA       GLY   1   4.509  22.483  -6.037
    7    H    SER   2           H        SER   2   2.466  23.352  -6.272
    8    HA   SER   2           HA       SER   2   0.297  22.330  -4.627
    9    HB2  SER   2          2HB       SER   2  -1.056  23.940  -6.086
   10    HB3  SER   2          1HB       SER   2   0.161  24.664  -5.032
   11    HG   SER   2           HG       SER   2   0.255  25.505  -7.162
   12    H    ALA   3           H        ALA   3   1.917  21.336  -7.325
   13    HA   ALA   3           HA       ALA   3  -0.271  20.351  -8.890
   14    HB1  ALA   3          1HB       ALA   3   1.442  19.181 -10.175
   15    HB2  ALA   3          2HB       ALA   3   2.645  19.581  -8.948
   16    HB3  ALA   3          3HB       ALA   3   1.900  20.862  -9.903
   17    H    MET   4           H        MET   4  -1.554  19.144  -7.510
   18    HA   MET   4           HA       MET   4  -0.398  16.907  -6.073
   19    HB2  MET   4          2HB       MET   4  -2.180  18.281  -5.045
   20    HB3  MET   4          1HB       MET   4  -3.280  17.786  -6.323
   21    HG2  MET   4          2HG       MET   4  -3.166  15.489  -5.583
   22    HG3  MET   4          1HG       MET   4  -1.979  15.921  -4.353
   23    HE1  MET   4          1HE       MET   4  -5.185  17.968  -5.430
   24    HE2  MET   4          2HE       MET   4  -6.377  17.337  -4.293
   25    HE3  MET   4          3HE       MET   4  -5.702  16.286  -5.539
   26    H    GLY   5           H        GLY   5   0.357  15.671  -7.821
   27    HA2  GLY   5          2HA       GLY   5  -1.779  14.361  -9.387
   28    HA3  GLY   5          1HA       GLY   5  -0.135  14.585  -9.969
   29    H    HIS   6           H        HIS   6   1.280  12.980  -9.672
   30    HA   HIS   6           HA       HIS   6   0.438  10.556  -8.425
   31    HB2  HIS   6          2HB       HIS   6   3.130  11.417  -9.498
   32    HB3  HIS   6          1HB       HIS   6   2.806   9.811  -8.861
   33    HD1  HIS   6          1HD       HIS   6   3.634  10.504 -11.854
   34    HD2  HIS   6          2HD       HIS   6  -0.199   9.643 -10.489
   35    HE1  HIS   6          1HE       HIS   6   2.369   9.677 -13.863
   36    HE2  HIS   6          2HE       HIS   6   0.075   9.083 -12.998
   37    H    MET   7           H        MET   7   2.698  13.135  -7.574
   38    HA   MET   7           HA       MET   7   3.118  11.946  -4.947
   39    HB2  MET   7          2HB       MET   7   4.278  14.407  -6.258
   40    HB3  MET   7          1HB       MET   7   4.622  13.936  -4.601
   41    HG2  MET   7          2HG       MET   7   5.519  11.789  -5.452
   42    HG3  MET   7          1HG       MET   7   5.287  12.389  -7.092
   43    HE1  MET   7          1HE       MET   7   6.569  14.526  -8.073
   44    HE2  MET   7          2HE       MET   7   7.739  15.468  -7.150
   45    HE3  MET   7          3HE       MET   7   6.035  15.494  -6.698
   46    H    VAL   8           H        VAL   8   1.853  12.401  -3.311
   47    HA   VAL   8           HA       VAL   8   0.521  14.998  -3.224
   48    HB   VAL   8           HB       VAL   8  -1.205  13.418  -3.739
   49   HG11  VAL   8          1HG1      VAL   8  -0.355  11.837  -1.318
   50   HG12  VAL   8          2HG1      VAL   8  -0.054  11.379  -2.993
   51   HG13  VAL   8          3HG1      VAL   8  -1.709  11.475  -2.389
   52   HG21  VAL   8          1HG2      VAL   8  -1.838  15.158  -2.196
   53   HG22  VAL   8          2HG2      VAL   8  -1.290  14.189  -0.828
   54   HG23  VAL   8          3HG2      VAL   8  -2.678  13.662  -1.783
   55    H    LYS   9           H        LYS   9   1.315  12.273  -1.309
   56    HA   LYS   9           HA       LYS   9   3.016  13.905   0.368
   57    HB2  LYS   9          2HB       LYS   9   0.819  12.119   1.422
   58    HB3  LYS   9          1HB       LYS   9   2.220  12.532   2.394
   59    HG2  LYS   9          2HG       LYS   9   0.513  14.628   1.161
   60    HG3  LYS   9          1HG       LYS   9   0.038  13.852   2.662
   61    HD2  LYS   9          2HD       LYS   9   1.182  15.887   3.203
   62    HD3  LYS   9          1HD       LYS   9   2.213  14.534   3.648
   63    HE2  LYS   9          2HE       LYS   9   3.616  14.886   1.759
   64    HE3  LYS   9          1HE       LYS   9   2.494  16.057   1.066
   65    HZ1  LYS   9          1HZ       LYS   9   4.365  17.152   2.101
   66    HZ2  LYS   9          2HZ       LYS   9   4.044  16.387   3.577
   67    HZ3  LYS   9          3HZ       LYS   9   2.949  17.512   2.952
   68    H    ILE  10           H        ILE  10   3.848  12.449  -1.675
   69    HA   ILE  10           HA       ILE  10   4.875   9.987  -0.494
   70    HB   ILE  10           HB       ILE  10   4.001  10.267  -3.376
   71   HG12  ILE  10          2HG1      ILE  10   2.682   8.601  -1.233
   72   HG13  ILE  10          1HG1      ILE  10   2.105  10.203  -1.680
   73   HG21  ILE  10          1HG2      ILE  10   4.956   7.884  -1.789
   74   HG22  ILE  10          2HG2      ILE  10   5.838   8.708  -3.073
   75   HG23  ILE  10          3HG2      ILE  10   4.355   7.831  -3.446
   76   HD11  ILE  10          1HD1      ILE  10   0.809   8.511  -2.790
   77   HD12  ILE  10          2HD1      ILE  10   2.267   7.788  -3.469
   78   HD13  ILE  10          3HD1      ILE  10   1.758   9.398  -3.980
   79    H    SER  11           H        SER  11   6.881  10.853  -0.100
   80    HA   SER  11           HA       SER  11   8.453  11.622  -2.454
   81    HB2  SER  11          2HB       SER  11   9.192  11.591   0.493
   82    HB3  SER  11          1HB       SER  11  10.204  12.206  -0.818
   83    HG   SER  11           HG       SER  11   8.267  13.607  -1.256
   84    H    HIS  12           H        HIS  12  10.902  10.520  -1.915
   85    HA   HIS  12           HA       HIS  12  10.743   7.880  -2.750
   86    HB2  HIS  12          2HB       HIS  12  12.795   9.090  -0.900
   87    HB3  HIS  12          1HB       HIS  12  12.971   7.547  -1.732
   88    HD1  HIS  12          1HD       HIS  12  13.319   7.644  -4.346
   89    HD2  HIS  12          2HD       HIS  12  13.471  11.310  -2.406
   90    HE1  HIS  12          1HE       HIS  12  14.381   9.229  -5.983
   91    HE2  HIS  12          2HE       HIS  12  14.643  11.384  -4.711
   92    H    GLU  13           H        GLU  13  11.314   9.141   0.438
   93    HA   GLU  13           HA       GLU  13  11.388   6.843   1.922
   94    HB2  GLU  13          2HB       GLU  13  10.530   9.638   2.470
   95    HB3  GLU  13          1HB       GLU  13  10.505   8.425   3.766
   96    HG2  GLU  13          2HG       GLU  13  12.916   8.082   3.396
   97    HG3  GLU  13          1HG       GLU  13  12.892   9.339   2.159
   98    H    ASP  14           H        ASP  14   8.533   8.847   1.109
   99    HA   ASP  14           HA       ASP  14   6.767   7.311   2.703
  100    HB2  ASP  14          2HB       ASP  14   6.129   9.098   0.371
  101    HB3  ASP  14          1HB       ASP  14   4.990   8.529   1.588
  102    H    THR  15           H        THR  15   7.435   7.352  -0.796
  103    HA   THR  15           HA       THR  15   5.592   5.392  -1.532
  104    HB   THR  15           HB       THR  15   8.205   5.278  -2.926
  105    HG1  THR  15          1HG       THR  15   7.977   7.542  -2.382
  106   HG21  THR  15          1HG2      THR  15   6.212   4.135  -3.773
  107   HG22  THR  15          2HG2      THR  15   6.741   5.390  -4.894
  108   HG23  THR  15          3HG2      THR  15   5.352   5.674  -3.839
  109    H    GLN  16           H        GLN  16   8.941   5.113  -0.432
  110    HA   GLN  16           HA       GLN  16   9.163   2.309  -0.569
  111    HB2  GLN  16          2HB       GLN  16  10.548   4.279   1.267
  112    HB3  GLN  16          1HB       GLN  16  11.020   2.596   1.076
  113    HG2  GLN  16          2HG       GLN  16  11.597   2.964  -1.228
  114    HG3  GLN  16          1HG       GLN  16  10.979   4.611  -1.158
  115   HE21  GLN  16          1HE2      GLN  16  12.107   5.068   1.508
  116   HE22  GLN  16          2HE2      GLN  16  13.803   5.289   1.279
  117    H    ARG  17           H        ARG  17   7.963   4.484   1.896
  118    HA   ARG  17           HA       ARG  17   7.652   2.668   4.006
  119    HB2  ARG  17          2HB       ARG  17   6.398   5.279   3.273
  120    HB3  ARG  17          1HB       ARG  17   5.713   4.351   4.596
  121    HG2  ARG  17          2HG       ARG  17   7.409   4.838   5.980
  122    HG3  ARG  17          1HG       ARG  17   8.621   4.726   4.704
  123    HD2  ARG  17          2HD       ARG  17   8.229   6.907   3.971
  124    HD3  ARG  17          1HD       ARG  17   6.689   7.018   4.832
  125    HE   ARG  17           HE       ARG  17   8.877   6.654   6.619
  126   HH11  ARG  17          1HH1      ARG  17   7.203   9.062   4.701
  127   HH12  ARG  17          2HH1      ARG  17   7.742  10.386   5.677
  128   HH21  ARG  17          1HH2      ARG  17   9.584   8.410   7.902
  129   HH22  ARG  17          2HH2      ARG  17   9.089  10.023   7.494
  130    H    ILE  18           H        ILE  18   5.286   3.761   1.544
  131    HA   ILE  18           HA       ILE  18   3.116   2.354   2.573
  132    HB   ILE  18           HB       ILE  18   3.611   3.039  -0.320
  133   HG12  ILE  18          2HG1      ILE  18   1.701   4.649   1.179
  134   HG13  ILE  18          1HG1      ILE  18   3.324   4.746   1.857
  135   HG21  ILE  18          1HG2      ILE  18   1.134   2.929  -0.458
  136   HG22  ILE  18          2HG2      ILE  18   1.107   2.291   1.192
  137   HG23  ILE  18          3HG2      ILE  18   1.894   1.376  -0.100
  138   HD11  ILE  18          1HD1      ILE  18   2.625   5.241  -1.024
  139   HD12  ILE  18          2HD1      ILE  18   4.205   5.435  -0.258
  140   HD13  ILE  18          3HD1      ILE  18   2.870   6.490   0.199
  141    H    LYS  19           H        LYS  19   5.388   1.336  -0.006
  142    HA   LYS  19           HA       LYS  19   4.082  -1.107  -0.541
  143    HB2  LYS  19          2HB       LYS  19   7.061  -0.785  -0.709
  144    HB3  LYS  19          1HB       LYS  19   6.007  -1.780  -1.707
  145    HG2  LYS  19          2HG       LYS  19   6.171   1.224  -1.771
  146    HG3  LYS  19          1HG       LYS  19   6.776   0.102  -2.995
  147    HD2  LYS  19          2HD       LYS  19   4.243  -0.702  -2.951
  148    HD3  LYS  19          1HD       LYS  19   4.006   0.947  -2.369
  149    HE2  LYS  19          2HE       LYS  19   3.750   0.948  -4.740
  150    HE3  LYS  19          1HE       LYS  19   5.242   1.780  -4.314
  151    HZ1  LYS  19          1HZ       LYS  19   5.532   0.285  -6.203
  152    HZ2  LYS  19          2HZ       LYS  19   5.061  -1.028  -5.254
  153    HZ3  LYS  19          3HZ       LYS  19   6.490  -0.193  -4.892
  154    H    THR  20           H        THR  20   6.818  -0.297   1.535
  155    HA   THR  20           HA       THR  20   7.504  -2.928   2.032
  156    HB   THR  20           HB       THR  20   9.068  -1.037   2.369
  157    HG1  THR  20          1HG       THR  20   8.691  -3.161   4.048
  158   HG21  THR  20          1HG2      THR  20   7.462  -0.564   4.884
  159   HG22  THR  20          2HG2      THR  20   7.568   0.524   3.503
  160   HG23  THR  20          3HG2      THR  20   8.997   0.213   4.491
  161    H    ALA  21           H        ALA  21   5.369  -0.737   3.775
  162    HA   ALA  21           HA       ALA  21   5.173  -2.433   6.042
  163    HB1  ALA  21          1HB       ALA  21   3.394  -0.171   5.152
  164    HB2  ALA  21          2HB       ALA  21   4.784  -0.046   6.233
  165    HB3  ALA  21          3HB       ALA  21   3.350  -0.941   6.740
  166    H    PHE  22           H        PHE  22   2.848  -1.593   3.500
  167    HA   PHE  22           HA       PHE  22   0.726  -3.204   4.005
  168    HB2  PHE  22          2HB       PHE  22   0.486  -1.896   2.174
  169    HB3  PHE  22          1HB       PHE  22   2.126  -2.145   1.619
  170    HD1  PHE  22          1HD       PHE  22  -1.135  -3.878   1.832
  171    HD2  PHE  22          2HD       PHE  22   2.472  -3.344  -0.304
  172    HE1  PHE  22          1HE       PHE  22  -2.066  -5.232  -0.038
  173    HE2  PHE  22          2HE       PHE  22   1.602  -4.723  -2.138
  174    HZ   PHE  22           HZ       PHE  22  -0.667  -5.671  -1.998
  175    H    LEU  23           H        LEU  23   3.530  -4.339   2.074
  176    HA   LEU  23           HA       LEU  23   2.577  -6.965   1.780
  177    HB2  LEU  23          2HB       LEU  23   5.451  -6.067   1.789
  178    HB3  LEU  23          1HB       LEU  23   4.781  -7.471   0.975
  179    HG   LEU  23           HG       LEU  23   3.809  -4.727   0.277
  180   HD11  LEU  23          1HD1      LEU  23   6.272  -6.085  -0.819
  181   HD12  LEU  23          2HD1      LEU  23   6.236  -4.614   0.155
  182   HD13  LEU  23          3HD1      LEU  23   5.532  -4.618  -1.464
  183   HD21  LEU  23          1HD2      LEU  23   2.535  -6.536  -0.609
  184   HD22  LEU  23          2HD2      LEU  23   3.994  -7.363  -1.166
  185   HD23  LEU  23          3HD2      LEU  23   3.493  -5.852  -1.927
  186    H    SER  24           H        SER  24   5.150  -5.745   3.960
  187    HA   SER  24           HA       SER  24   5.708  -8.268   5.071
  188    HB2  SER  24          2HB       SER  24   7.002  -7.032   6.760
  189    HB3  SER  24          1HB       SER  24   7.370  -6.614   5.094
  190    HG   SER  24           HG       SER  24   6.384  -4.680   5.339
  191    H    TYR  25           H        TYR  25   3.440  -5.817   5.853
  192    HA   TYR  25           HA       TYR  25   3.047  -6.484   8.566
  193    HB2  TYR  25          2HB       TYR  25   1.633  -4.765   6.567
  194    HB3  TYR  25          1HB       TYR  25   0.727  -5.298   7.993
  195    HD1  TYR  25          1HD       TYR  25   4.247  -4.140   7.444
  196    HD2  TYR  25          2HD       TYR  25   0.634  -3.689   9.637
  197    HE1  TYR  25          1HE       TYR  25   5.312  -2.415   8.818
  198    HE2  TYR  25          2HE       TYR  25   1.685  -1.957  11.025
  199    HH   TYR  25           HH       TYR  25   4.689  -0.539  10.252
  200    H    ALA  26           H        ALA  26   1.175  -7.277   5.622
  201    HA   ALA  26           HA       ALA  26  -0.644  -8.838   7.191
  202    HB1  ALA  26          1HB       ALA  26  -1.626  -9.496   5.094
  203    HB2  ALA  26          2HB       ALA  26  -0.242  -8.843   4.218
  204    HB3  ALA  26          3HB       ALA  26  -1.316  -7.761   5.109
  205    H    GLN  27           H        GLN  27   1.446  -9.983   4.492
  206    HA   GLN  27           HA       GLN  27   1.770 -12.440   6.079
  207    HB2  GLN  27          2HB       GLN  27   2.150 -12.613   3.149
  208    HB3  GLN  27          1HB       GLN  27   1.521 -13.813   4.273
  209    HG2  GLN  27          2HG       GLN  27  -0.343 -13.328   3.043
  210    HG3  GLN  27          1HG       GLN  27  -0.543 -12.184   4.377
  211   HE21  GLN  27          1HE2      GLN  27  -1.531 -12.041   1.618
  212   HE22  GLN  27          2HE2      GLN  27  -0.892 -10.558   0.983
  213    H    GLY  28           H        GLY  28   3.324  -9.955   4.266
  214    HA2  GLY  28          2HA       GLY  28   5.672  -9.704   3.981
  215    HA3  GLY  28          1HA       GLY  28   5.875 -11.413   4.342
  216    H    GLN  29           H        GLN  29   3.374 -11.698   2.451
  217    HA   GLN  29           HA       GLN  29   4.893 -12.298   0.091
  218    HB2  GLN  29          2HB       GLN  29   1.896 -12.312   0.472
  219    HB3  GLN  29          1HB       GLN  29   2.807 -13.162  -0.769
  220    HG2  GLN  29          2HG       GLN  29   3.857 -14.551   0.912
  221    HG3  GLN  29          1HG       GLN  29   3.020 -13.660   2.185
  222   HE21  GLN  29          1HE2      GLN  29   0.528 -13.505   0.616
  223   HE22  GLN  29          2HE2      GLN  29  -0.167 -15.086   0.684
  224    H    ASP  30           H        ASP  30   3.220 -11.705  -1.997
  225    HA   ASP  30           HA       ASP  30   3.867  -8.906  -2.419
  226    HB2  ASP  30          2HB       ASP  30   2.839 -11.081  -4.239
  227    HB3  ASP  30          1HB       ASP  30   3.014  -9.411  -4.762
  228    H    LYS  31           H        LYS  31   1.499  -9.864  -0.734
  229    HA   LYS  31           HA       LYS  31  -0.461  -8.053  -1.867
  230    HB2  LYS  31          2HB       LYS  31  -1.061 -10.967  -1.304
  231    HB3  LYS  31          1HB       LYS  31  -2.297  -9.737  -1.532
  232    HG2  LYS  31          2HG       LYS  31  -0.853  -9.375  -3.769
  233    HG3  LYS  31          1HG       LYS  31  -0.589 -11.092  -3.509
  234    HD2  LYS  31          2HD       LYS  31  -3.277  -9.719  -3.642
  235    HD3  LYS  31          1HD       LYS  31  -2.549 -10.668  -4.931
  236    HE2  LYS  31          2HE       LYS  31  -3.208 -11.729  -2.200
  237    HE3  LYS  31          1HE       LYS  31  -4.291 -11.797  -3.585
  238    HZ1  LYS  31          1HZ       LYS  31  -1.604 -13.047  -3.420
  239    HZ2  LYS  31          2HZ       LYS  31  -2.625 -13.114  -4.764
  240    HZ3  LYS  31          3HZ       LYS  31  -3.080 -13.866  -3.317
  241    H    VAL  32           H        VAL  32  -2.506  -8.330  -0.175
  242    HA   VAL  32           HA       VAL  32  -1.366  -8.672   2.504
  243    HB   VAL  32           HB       VAL  32  -2.740  -6.288   1.423
  244   HG11  VAL  32          1HG1      VAL  32  -3.150  -7.257   4.235
  245   HG12  VAL  32          2HG1      VAL  32  -4.396  -7.002   3.017
  246   HG13  VAL  32          3HG1      VAL  32  -3.501  -5.628   3.665
  247   HG21  VAL  32          1HG2      VAL  32  -1.327  -5.281   3.226
  248   HG22  VAL  32          2HG2      VAL  32  -0.471  -6.092   1.911
  249   HG23  VAL  32          3HG2      VAL  32  -0.658  -6.894   3.476
  250    H    THR  33           H        THR  33  -2.491  -9.989   3.782
  251    HA   THR  33           HA       THR  33  -5.075 -10.938   3.058
  252    HB   THR  33           HB       THR  33  -5.094 -11.840   5.423
  253    HG1  THR  33          1HG       THR  33  -3.550 -10.069   6.108
  254   HG21  THR  33          1HG2      THR  33  -3.291 -13.462   5.048
  255   HG22  THR  33          2HG2      THR  33  -2.637 -12.433   3.774
  256   HG23  THR  33          3HG2      THR  33  -4.224 -13.180   3.578
  257    H    GLU  34           H        GLU  34  -7.004 -10.495   4.478
  258    HA   GLU  34           HA       GLU  34  -7.429  -7.831   3.797
  259    HB2  GLU  34          2HB       GLU  34  -9.149  -9.331   3.460
  260    HB3  GLU  34          1HB       GLU  34  -9.215  -9.794   5.165
  261    HG2  GLU  34          2HG       GLU  34 -10.102  -7.639   5.763
  262    HG3  GLU  34          1HG       GLU  34  -9.882  -7.048   4.117
  263    H    ALA  35           H        ALA  35  -6.474  -9.002   6.870
  264    HA   ALA  35           HA       ALA  35  -7.753  -7.162   8.565
  265    HB1  ALA  35          1HB       ALA  35  -6.124  -7.743  10.229
  266    HB2  ALA  35          2HB       ALA  35  -5.051  -8.411   9.004
  267    HB3  ALA  35          3HB       ALA  35  -6.587  -9.203   9.354
  268    H    MET  36           H        MET  36  -4.506  -7.063   7.050
  269    HA   MET  36           HA       MET  36  -3.946  -4.435   7.922
  270    HB2  MET  36          2HB       MET  36  -2.812  -6.229   5.816
  271    HB3  MET  36          1HB       MET  36  -2.349  -4.545   5.859
  272    HG2  MET  36          2HG       MET  36  -2.084  -6.470   8.139
  273    HG3  MET  36          1HG       MET  36  -0.774  -5.975   7.066
  274    HE1  MET  36          1HE       MET  36  -2.089  -2.851   6.789
  275    HE2  MET  36          2HE       MET  36  -0.375  -3.253   6.680
  276    HE3  MET  36          3HE       MET  36  -0.921  -2.038   7.834
  277    H    ILE  37           H        ILE  37  -5.891  -5.772   5.416
  278    HA   ILE  37           HA       ILE  37  -5.903  -3.429   3.759
  279    HB   ILE  37           HB       ILE  37  -7.343  -5.963   3.808
  280   HG12  ILE  37          2HG1      ILE  37  -5.805  -6.154   2.194
  281   HG13  ILE  37          1HG1      ILE  37  -6.820  -5.078   1.274
  282   HG21  ILE  37          1HG2      ILE  37  -8.909  -5.131   2.072
  283   HG22  ILE  37          2HG2      ILE  37  -8.453  -3.487   2.512
  284   HG23  ILE  37          3HG2      ILE  37  -9.245  -4.532   3.692
  285   HD11  ILE  37          1HD1      ILE  37  -4.526  -4.200   2.971
  286   HD12  ILE  37          2HD1      ILE  37  -5.558  -3.162   1.982
  287   HD13  ILE  37          3HD1      ILE  37  -4.521  -4.361   1.219
  288    H    ASP  38           H        ASP  38  -7.998  -4.706   6.327
  289    HA   ASP  38           HA       ASP  38  -9.947  -2.749   6.410
  290    HB2  ASP  38          2HB       ASP  38  -9.584  -4.957   7.692
  291    HB3  ASP  38          1HB       ASP  38  -8.698  -3.970   8.848
  292    H    GLN  39           H        GLN  39  -6.696  -2.815   7.766
  293    HA   GLN  39           HA       GLN  39  -6.768  -0.523   9.340
  294    HB2  GLN  39          2HB       GLN  39  -4.864  -1.851   9.591
  295    HB3  GLN  39          1HB       GLN  39  -4.617  -2.003   7.863
  296    HG2  GLN  39          2HG       GLN  39  -4.276   0.670   9.129
  297    HG3  GLN  39          1HG       GLN  39  -3.030  -0.559   9.346
  298   HE21  GLN  39          1HE2      GLN  39  -3.117   2.031   7.837
  299   HE22  GLN  39          2HE2      GLN  39  -2.572   1.628   6.253
  300    H    LEU  40           H        LEU  40  -5.835  -0.909   5.953
  301    HA   LEU  40           HA       LEU  40  -5.397   1.863   5.553
  302    HB2  LEU  40          2HB       LEU  40  -4.252   0.197   4.238
  303    HB3  LEU  40          1HB       LEU  40  -5.777  -0.393   3.572
  304    HG   LEU  40           HG       LEU  40  -5.774   2.294   2.905
  305   HD11  LEU  40          1HD1      LEU  40  -3.699   3.069   2.817
  306   HD12  LEU  40          2HD1      LEU  40  -3.196   1.696   1.829
  307   HD13  LEU  40          3HD1      LEU  40  -3.144   1.584   3.591
  308   HD21  LEU  40          1HD2      LEU  40  -5.290   1.486   0.636
  309   HD22  LEU  40          2HD2      LEU  40  -6.467   0.461   1.459
  310   HD23  LEU  40          3HD2      LEU  40  -4.792  -0.069   1.301
  311    H    ILE  41           H        ILE  41  -8.049  -0.318   4.588
  312    HA   ILE  41           HA       ILE  41  -9.425   1.683   3.138
  313    HB   ILE  41           HB       ILE  41 -10.369  -0.951   4.249
  314   HG12  ILE  41          2HG1      ILE  41  -8.602  -0.720   2.373
  315   HG13  ILE  41          1HG1      ILE  41  -9.951  -1.813   2.106
  316   HG21  ILE  41          1HG2      ILE  41 -12.328  -0.697   2.770
  317   HG22  ILE  41          2HG2      ILE  41 -11.825   0.956   2.417
  318   HG23  ILE  41          3HG2      ILE  41 -12.296   0.509   4.057
  319   HD11  ILE  41          1HD1      ILE  41  -9.416  -0.482   0.133
  320   HD12  ILE  41          2HD1      ILE  41  -9.725   0.994   1.049
  321   HD13  ILE  41          3HD1      ILE  41 -11.038  -0.139   0.729
  322    H    CYS  42           H        CYS  42  -9.935   0.459   6.464
  323    HA   CYS  42           HA       CYS  42 -12.149   2.223   6.919
  324    HB2  CYS  42          2HB       CYS  42 -10.428   0.750   8.925
  325    HB3  CYS  42          1HB       CYS  42 -11.973   1.524   9.265
  326    HG   CYS  42           HG       CYS  42 -11.607  -1.518   8.725
  327    H    GLY  43           H        GLY  43  -8.787   2.518   6.887
  328    HA2  GLY  43          2HA       GLY  43  -8.177   4.500   8.687
  329    HA3  GLY  43          1HA       GLY  43  -7.445   4.335   7.100
  330    H    ALA  44           H        ALA  44  -9.211   5.130   5.293
  331    HA   ALA  44           HA       ALA  44  -9.507   7.946   5.981
  332    HB1  ALA  44          1HB       ALA  44 -10.017   6.636   3.312
  333    HB2  ALA  44          2HB       ALA  44  -8.451   7.262   3.826
  334    HB3  ALA  44          3HB       ALA  44  -9.822   8.360   3.636
  335    H    PHE  45           H        PHE  45 -11.550   5.369   4.617
  336    HA   PHE  45           HA       PHE  45 -13.867   6.892   5.585
  337    HB2  PHE  45          2HB       PHE  45 -14.953   5.239   3.762
  338    HB3  PHE  45          1HB       PHE  45 -14.555   6.940   3.513
  339    HD1  PHE  45          1HD       PHE  45 -12.696   3.722   3.517
  340    HD2  PHE  45          2HD       PHE  45 -13.552   7.332   1.452
  341    HE1  PHE  45          1HE       PHE  45 -11.196   3.024   1.689
  342    HE2  PHE  45          2HE       PHE  45 -12.043   6.657  -0.372
  343    HZ   PHE  45           HZ       PHE  45 -10.857   4.497  -0.254
  344    HA   PRO  46           HA       PRO  46 -14.678   3.098   7.705
  345    HB2  PRO  46          2HB       PRO  46 -15.516   4.217   9.967
  346    HB3  PRO  46          1HB       PRO  46 -13.807   4.159   9.551
  347    HG2  PRO  46          2HG       PRO  46 -15.709   6.444   9.397
  348    HG3  PRO  46          1HG       PRO  46 -13.986   6.451   9.803
  349    HD2  PRO  46          2HD       PRO  46 -15.123   7.040   7.271
  350    HD3  PRO  46          1HD       PRO  46 -13.404   6.761   7.624
  351    H    GLY  47           H        GLY  47 -16.838   2.917   9.334
  352    HA2  GLY  47          2HA       GLY  47 -19.153   2.899   9.417
  353    HA3  GLY  47          1HA       GLY  47 -19.176   4.110   8.141
  354    H    LEU  48           H        LEU  48 -17.264   1.343   7.602
  355    HA   LEU  48           HA       LEU  48 -19.117   0.525   5.487
  356    HB2  LEU  48          2HB       LEU  48 -16.234  -0.269   5.912
  357    HB3  LEU  48          1HB       LEU  48 -17.208  -0.619   4.499
  358    HG   LEU  48           HG       LEU  48 -16.171   2.073   5.381
  359   HD11  LEU  48          1HD1      LEU  48 -15.000   1.990   3.233
  360   HD12  LEU  48          2HD1      LEU  48 -15.660   0.379   2.939
  361   HD13  LEU  48          3HD1      LEU  48 -14.545   0.645   4.279
  362   HD21  LEU  48          1HD2      LEU  48 -18.430   2.352   4.519
  363   HD22  LEU  48          2HD2      LEU  48 -18.015   1.411   3.086
  364   HD23  LEU  48          3HD2      LEU  48 -17.247   2.971   3.368
  365    H    SER  49           H        SER  49 -20.330  -1.248   5.794
  366    HA   SER  49           HA       SER  49 -19.679  -3.252   7.730
  367    HB2  SER  49          2HB       SER  49 -21.478  -4.569   6.615
  368    HB3  SER  49          1HB       SER  49 -22.009  -2.937   7.026
  369    HG   SER  49           HG       SER  49 -21.972  -2.372   4.930
  370    H    TRP  50           H        TRP  50 -19.162  -5.589   7.000
  371    HA   TRP  50           HA       TRP  50 -16.778  -5.502   5.549
  372    HB2  TRP  50          2HB       TRP  50 -17.266  -7.359   7.095
  373    HB3  TRP  50          1HB       TRP  50 -18.508  -7.946   5.987
  374    HD1  TRP  50           HD       TRP  50 -14.700  -7.263   5.883
  375    HE1  TRP  50          1HE       TRP  50 -13.661  -8.975   4.268
  376    HE3  TRP  50          3HE       TRP  50 -18.970  -9.611   4.375
  377    HZ2  TRP  50          2HZ       TRP  50 -14.565 -11.046   2.606
  378    HZ3  TRP  50          3HZ       TRP  50 -18.794 -11.447   2.755
  379    HH2  TRP  50           HH       TRP  50 -16.627 -12.160   1.886
  380    H    GLU  51           H        GLU  51 -20.055  -6.163   4.524
  381    HA   GLU  51           HA       GLU  51 -19.546  -7.053   1.927
  382    HB2  GLU  51          2HB       GLU  51 -21.857  -5.420   2.979
  383    HB3  GLU  51          1HB       GLU  51 -21.822  -6.205   1.406
  384    HG2  GLU  51          2HG       GLU  51 -21.624  -8.375   2.488
  385    HG3  GLU  51          1HG       GLU  51 -21.639  -7.601   4.059
  386    H    GLN  52           H        GLN  52 -20.282  -3.732   3.028
  387    HA   GLN  52           HA       GLN  52 -19.873  -2.557   0.504
  388    HB2  GLN  52          2HB       GLN  52 -21.132  -1.406   2.227
  389    HB3  GLN  52          1HB       GLN  52 -19.709  -1.326   3.257
  390    HG2  GLN  52          2HG       GLN  52 -20.150   0.807   2.172
  391    HG3  GLN  52          1HG       GLN  52 -18.605   0.127   1.665
  392   HE21  GLN  52          1HE2      GLN  52 -18.467   1.169  -0.246
  393   HE22  GLN  52          2HE2      GLN  52 -19.526   0.891  -1.580
  394    H    LEU  53           H        LEU  53 -17.652  -3.418   3.056
  395    HA   LEU  53           HA       LEU  53 -15.519  -1.793   2.040
  396    HB2  LEU  53          2HB       LEU  53 -15.526  -2.354   4.389
  397    HB3  LEU  53          1HB       LEU  53 -15.517  -4.067   4.024
  398    HG   LEU  53           HG       LEU  53 -13.242  -2.544   2.912
  399   HD11  LEU  53          1HD1      LEU  53 -13.478  -1.431   5.080
  400   HD12  LEU  53          2HD1      LEU  53 -12.050  -2.463   5.054
  401   HD13  LEU  53          3HD1      LEU  53 -13.509  -2.996   5.892
  402   HD21  LEU  53          1HD2      LEU  53 -13.438  -4.994   2.741
  403   HD22  LEU  53          2HD2      LEU  53 -13.432  -5.114   4.500
  404   HD23  LEU  53          3HD2      LEU  53 -12.007  -4.514   3.651
  405    H    GLN  54           H        GLN  54 -16.494  -5.188   1.768
  406    HA   GLN  54           HA       GLN  54 -14.258  -6.023   0.292
  407    HB2  GLN  54          2HB       GLN  54 -15.354  -8.008  -0.098
  408    HB3  GLN  54          1HB       GLN  54 -16.111  -7.439   1.364
  409    HG2  GLN  54          2HG       GLN  54 -18.077  -6.800   0.222
  410    HG3  GLN  54          1HG       GLN  54 -17.305  -7.000  -1.351
  411   HE21  GLN  54          1HE2      GLN  54 -18.709  -8.646   1.384
  412   HE22  GLN  54          2HE2      GLN  54 -18.873 -10.183   0.623
  413    H    GLU  55           H        GLU  55 -17.189  -4.342  -0.587
  414    HA   GLU  55           HA       GLU  55 -16.996  -4.399  -3.381
  415    HB2  GLU  55          2HB       GLU  55 -17.877  -2.064  -1.788
  416    HB3  GLU  55          1HB       GLU  55 -18.373  -2.475  -3.408
  417    HG2  GLU  55          2HG       GLU  55 -19.007  -4.106  -0.986
  418    HG3  GLU  55          1HG       GLU  55 -20.054  -2.883  -1.641
  419    H    LYS  56           H        LYS  56 -15.631  -2.309  -0.964
  420    HA   LYS  56           HA       LYS  56 -14.578  -0.273  -2.488
  421    HB2  LYS  56          2HB       LYS  56 -14.603  -0.681   0.096
  422    HB3  LYS  56          1HB       LYS  56 -13.028  -1.437  -0.196
  423    HG2  LYS  56          2HG       LYS  56 -12.779   0.886   0.495
  424    HG3  LYS  56          1HG       LYS  56 -12.172   0.630  -1.139
  425    HD2  LYS  56          2HD       LYS  56 -13.366   2.684  -1.153
  426    HD3  LYS  56          1HD       LYS  56 -14.381   1.504  -1.979
  427    HE2  LYS  56          2HE       LYS  56 -15.693   1.206   0.066
  428    HE3  LYS  56          1HE       LYS  56 -14.676   2.390   0.887
  429    HZ1  LYS  56          1HZ       LYS  56 -16.402   2.912  -1.474
  430    HZ2  LYS  56          2HZ       LYS  56 -15.400   4.053  -0.730
  431    HZ3  LYS  56          3HZ       LYS  56 -16.712   3.407   0.113
  432    H    LYS  57           H        LYS  57 -13.128  -3.388  -1.677
  433    HA   LYS  57           HA       LYS  57 -10.924  -2.764  -3.517
  434    HB2  LYS  57          2HB       LYS  57 -10.326  -5.007  -1.876
  435    HB3  LYS  57          1HB       LYS  57  -9.542  -3.437  -1.918
  436    HG2  LYS  57          2HG       LYS  57 -10.185  -3.508   0.265
  437    HG3  LYS  57          1HG       LYS  57 -11.605  -2.746  -0.441
  438    HD2  LYS  57          2HD       LYS  57 -12.449  -4.419   0.957
  439    HD3  LYS  57          1HD       LYS  57 -12.558  -5.081  -0.673
  440    HE2  LYS  57          2HE       LYS  57 -10.425  -6.294  -0.257
  441    HE3  LYS  57          1HE       LYS  57 -10.466  -5.700   1.392
  442    HZ1  LYS  57          1HZ       LYS  57 -12.181  -7.050   1.972
  443    HZ2  LYS  57          2HZ       LYS  57 -11.481  -8.018   0.765
  444    HZ3  LYS  57          3HZ       LYS  57 -12.837  -7.077   0.410
  445    H    LYS  58           H        LYS  58 -13.678  -4.128  -3.960
  446    HA   LYS  58           HA       LYS  58 -13.217  -6.859  -4.502
  447    HB2  LYS  58          2HB       LYS  58 -15.335  -6.865  -5.640
  448    HB3  LYS  58          1HB       LYS  58 -15.470  -5.853  -4.210
  449    HG2  LYS  58          2HG       LYS  58 -15.243  -3.856  -5.595
  450    HG3  LYS  58          1HG       LYS  58 -15.089  -4.869  -7.032
  451    HD2  LYS  58          2HD       LYS  58 -17.339  -5.745  -6.665
  452    HD3  LYS  58          1HD       LYS  58 -17.490  -4.768  -5.205
  453    HE2  LYS  58          2HE       LYS  58 -17.068  -3.684  -7.983
  454    HE3  LYS  58          1HE       LYS  58 -18.619  -3.760  -7.154
  455    HZ1  LYS  58          1HZ       LYS  58 -16.257  -2.259  -6.159
  456    HZ2  LYS  58          2HZ       LYS  58 -17.817  -2.249  -5.501
  457    HZ3  LYS  58          3HZ       LYS  58 -17.538  -1.567  -7.020
  458    H    GLY  59           H        GLY  59 -12.175  -4.120  -6.198
  459    HA2  GLY  59          2HA       GLY  59 -12.338  -5.097  -8.860
  460    HA3  GLY  59          1HA       GLY  59 -11.303  -3.793  -8.304
  461    H    ARG  60           H        ARG  60  -9.704  -5.102  -6.470
  462    HA   ARG  60           HA       ARG  60  -8.467  -7.290  -7.927
  463    HB2  ARG  60          2HB       ARG  60  -7.714  -4.987  -8.846
  464    HB3  ARG  60          1HB       ARG  60  -6.792  -4.868  -7.356
  465    HG2  ARG  60          2HG       ARG  60  -5.395  -5.693  -9.138
  466    HG3  ARG  60          1HG       ARG  60  -5.632  -6.955  -7.927
  467    HD2  ARG  60          2HD       ARG  60  -7.233  -8.074  -9.290
  468    HD3  ARG  60          1HD       ARG  60  -7.295  -6.725 -10.428
  469    HE   ARG  60           HE       ARG  60  -4.657  -7.643 -10.323
  470   HH11  ARG  60          1HH1      ARG  60  -7.786  -8.820 -11.366
  471   HH12  ARG  60          2HH1      ARG  60  -7.126  -9.881 -12.562
  472   HH21  ARG  60          1HH2      ARG  60  -3.788  -9.031 -11.885
  473   HH22  ARG  60          2HH2      ARG  60  -4.840 -10.017 -12.851
  474    H    ALA  61           H        ALA  61  -9.558  -7.616  -5.528
  475    HA   ALA  61           HA       ALA  61  -7.151  -8.030  -3.898
  476    HB1  ALA  61          1HB       ALA  61  -8.231  -7.473  -1.861
  477    HB2  ALA  61          2HB       ALA  61  -9.799  -7.328  -2.654
  478    HB3  ALA  61          3HB       ALA  61  -8.538  -6.142  -2.976
  479    H    ALA  62           H        ALA  62  -9.543  -9.411  -5.589
  480    HA   ALA  62           HA       ALA  62 -10.593 -11.428  -5.660
  481    HB1  ALA  62          1HB       ALA  62  -8.266 -12.163  -5.832
  482    HB2  ALA  62          2HB       ALA  62  -9.252 -13.346  -4.975
  483    HB3  ALA  62          3HB       ALA  62  -8.171 -12.281  -4.076
  484    H    ALA  63           H        ALA  63 -11.714  -9.847  -3.805
  485    HA   ALA  63           HA       ALA  63 -12.908  -9.667  -1.902
  486    HB1  ALA  63          1HB       ALA  63 -13.705 -11.656  -0.759
  487    HB2  ALA  63          2HB       ALA  63 -12.551 -12.651  -1.648
  488    HB3  ALA  63          3HB       ALA  63 -13.859 -11.836  -2.505
  489    H    ASN  64           H        ASN  64 -10.456 -12.163  -1.153
  490    HA   ASN  64           HA       ASN  64  -9.464 -10.331   0.917
  491    HB2  ASN  64          2HB       ASN  64  -9.810 -13.317   1.074
  492    HB3  ASN  64          1HB       ASN  64  -8.712 -12.450   2.141
  493   HD21  ASN  64          1HD2      ASN  64 -10.398 -10.092   2.231
  494   HD22  ASN  64          2HD2      ASN  64 -11.727 -10.477   3.272
  495    H    GLY  65           H        GLY  65  -7.565  -9.616   0.548
  496    HA2  GLY  65          2HA       GLY  65  -5.178 -10.300   0.297
  497    HA3  GLY  65          1HA       GLY  65  -5.718 -11.266  -1.065
  498    H    TYR  66           H        TYR  66  -5.779  -7.858   0.077
  499    HA   TYR  66           HA       TYR  66  -5.931  -6.706  -2.498
  500    HB2  TYR  66          2HB       TYR  66  -5.728  -5.646   0.047
  501    HB3  TYR  66          1HB       TYR  66  -4.191  -5.207  -0.692
  502    HD1  TYR  66          1HD       TYR  66  -5.071  -2.905  -0.168
  503    HD2  TYR  66          2HD       TYR  66  -6.842  -5.360  -3.138
  504    HE1  TYR  66          1HE       TYR  66  -6.067  -0.908  -1.188
  505    HE2  TYR  66          2HE       TYR  66  -7.858  -3.383  -4.174
  506    HH   TYR  66           HH       TYR  66  -6.922  -0.218  -3.402
  507    H    ASP  67           H        ASP  67  -4.580  -6.355  -4.062
  508    HA   ASP  67           HA       ASP  67  -2.009  -7.654  -3.885
  509    HB2  ASP  67          2HB       ASP  67  -3.776  -7.966  -5.715
  510    HB3  ASP  67          1HB       ASP  67  -3.262  -6.381  -6.293
  511    H    ARG  68           H        ARG  68  -0.297  -6.560  -5.111
  512    HA   ARG  68           HA       ARG  68   0.346  -4.261  -3.563
  513    HB2  ARG  68          2HB       ARG  68   2.488  -4.388  -5.117
  514    HB3  ARG  68          1HB       ARG  68   2.231  -5.550  -3.822
  515    HG2  ARG  68          2HG       ARG  68   1.310  -7.138  -5.452
  516    HG3  ARG  68          1HG       ARG  68   1.611  -5.976  -6.742
  517    HD2  ARG  68          2HD       ARG  68   3.802  -6.951  -4.933
  518    HD3  ARG  68          1HD       ARG  68   3.332  -7.836  -6.382
  519    HE   ARG  68           HE       ARG  68   3.856  -5.084  -6.920
  520   HH11  ARG  68          1HH1      ARG  68   5.456  -8.159  -6.328
  521   HH12  ARG  68          2HH1      ARG  68   6.809  -7.784  -7.356
  522   HH21  ARG  68          1HH2      ARG  68   5.626  -4.604  -8.264
  523   HH22  ARG  68          2HH2      ARG  68   6.905  -5.762  -8.446
  524    H    SER  69           H        SER  69  -0.513  -4.784  -6.921
  525    HA   SER  69           HA       SER  69  -0.005  -2.101  -7.747
  526    HB2  SER  69          2HB       SER  69  -1.548  -2.781  -9.672
  527    HB3  SER  69          1HB       SER  69  -0.080  -3.734  -9.466
  528    HG   SER  69           HG       SER  69  -1.258  -5.428  -9.063
  529    H    ALA  70           H        ALA  70  -2.821  -3.863  -6.607
  530    HA   ALA  70           HA       ALA  70  -4.743  -1.835  -7.041
  531    HB1  ALA  70          1HB       ALA  70  -5.098  -4.339  -6.628
  532    HB2  ALA  70          2HB       ALA  70  -6.238  -3.215  -5.889
  533    HB3  ALA  70          3HB       ALA  70  -4.959  -3.941  -4.911
  534    H    PHE  71           H        PHE  71  -2.961  -2.901  -4.201
  535    HA   PHE  71           HA       PHE  71  -4.045  -1.126  -2.350
  536    HB2  PHE  71          2HB       PHE  71  -2.693  -3.088  -1.722
  537    HB3  PHE  71          1HB       PHE  71  -1.268  -2.332  -2.434
  538    HD1  PHE  71          1HD       PHE  71  -3.580  -2.308   0.383
  539    HD2  PHE  71          2HD       PHE  71  -0.139  -0.507  -1.332
  540    HE1  PHE  71          1HE       PHE  71  -3.093  -1.227   2.530
  541    HE2  PHE  71          2HE       PHE  71   0.359   0.572   0.814
  542    HZ   PHE  71           HZ       PHE  71  -1.116   0.223   2.743
  543    H    PHE  72           H        PHE  72  -1.150  -0.819  -4.405
  544    HA   PHE  72           HA       PHE  72  -0.375   1.680  -3.366
  545    HB2  PHE  72          2HB       PHE  72   1.185   0.249  -4.586
  546    HB3  PHE  72          1HB       PHE  72   0.261   0.491  -6.066
  547    HD1  PHE  72          1HD       PHE  72   1.885   2.537  -3.401
  548    HD2  PHE  72          2HD       PHE  72   1.061   2.056  -7.550
  549    HE1  PHE  72          1HE       PHE  72   3.229   4.538  -3.893
  550    HE2  PHE  72          2HE       PHE  72   2.403   4.057  -8.051
  551    HZ   PHE  72           HZ       PHE  72   3.490   5.301  -6.222
  552    H    SER  73           H        SER  73  -2.430   0.780  -6.041
  553    HA   SER  73           HA       SER  73  -2.754   3.237  -7.290
  554    HB2  SER  73          2HB       SER  73  -3.634   1.129  -8.203
  555    HB3  SER  73          1HB       SER  73  -4.819   1.050  -6.900
  556    HG   SER  73           HG       SER  73  -5.851   1.932  -8.642
  557    H    LEU  74           H        LEU  74  -4.472   1.874  -4.517
  558    HA   LEU  74           HA       LEU  74  -6.293   4.039  -4.217
  559    HB2  LEU  74          2HB       LEU  74  -6.691   1.743  -3.370
  560    HB3  LEU  74          1HB       LEU  74  -5.411   1.980  -2.198
  561    HG   LEU  74           HG       LEU  74  -6.705   3.661  -1.047
  562   HD11  LEU  74          1HD1      LEU  74  -8.974   4.234  -1.756
  563   HD12  LEU  74          2HD1      LEU  74  -8.773   3.249  -3.205
  564   HD13  LEU  74          3HD1      LEU  74  -7.789   4.695  -2.977
  565   HD21  LEU  74          1HD2      LEU  74  -8.682   2.254  -0.439
  566   HD22  LEU  74          2HD2      LEU  74  -7.131   1.420  -0.376
  567   HD23  LEU  74          3HD2      LEU  74  -8.213   1.162  -1.744
  568    H    VAL  75           H        VAL  75  -3.324   3.128  -2.472
  569    HA   VAL  75           HA       VAL  75  -3.426   5.244  -0.608
  570    HB   VAL  75           HB       VAL  75  -0.867   3.953  -1.543
  571   HG11  VAL  75          1HG1      VAL  75  -1.753   5.304   0.953
  572   HG12  VAL  75          2HG1      VAL  75  -0.302   5.561  -0.015
  573   HG13  VAL  75          3HG1      VAL  75  -0.457   4.111   0.980
  574   HG21  VAL  75          1HG2      VAL  75  -3.012   2.827   0.216
  575   HG22  VAL  75          2HG2      VAL  75  -1.327   2.327   0.354
  576   HG23  VAL  75          3HG2      VAL  75  -2.202   2.072  -1.159
  577    H    ALA  76           H        ALA  76  -1.954   4.979  -3.797
  578    HA   ALA  76           HA       ALA  76  -0.380   7.309  -3.678
  579    HB1  ALA  76          1HB       ALA  76   0.016   5.606  -5.341
  580    HB2  ALA  76          2HB       ALA  76  -0.318   7.145  -6.135
  581    HB3  ALA  76          3HB       ALA  76  -1.565   5.902  -6.061
  582    H    SER  77           H        SER  77  -3.747   6.945  -3.870
  583    HA   SER  77           HA       SER  77  -4.069   9.650  -4.973
  584    HB2  SER  77          2HB       SER  77  -5.237   7.758  -6.138
  585    HB3  SER  77          1HB       SER  77  -6.175   7.494  -4.672
  586    HG   SER  77           HG       SER  77  -6.984   9.625  -4.902
  587    H    ASP  78           H        ASP  78  -3.899   8.054  -2.079
  588    HA   ASP  78           HA       ASP  78  -5.606  10.059  -0.760
  589    HB2  ASP  78          2HB       ASP  78  -5.436   7.104  -0.302
  590    HB3  ASP  78          1HB       ASP  78  -5.847   8.175   1.037
  591    H    GLU  79           H        GLU  79  -4.185  11.444   0.131
  592    HA   GLU  79           HA       GLU  79  -1.584  10.723   0.966
  593    HB2  GLU  79          2HB       GLU  79  -1.279  12.923   1.437
  594    HB3  GLU  79          1HB       GLU  79  -2.734  13.089   0.473
  595    HG2  GLU  79          2HG       GLU  79  -4.095  13.312   2.414
  596    HG3  GLU  79          1HG       GLU  79  -2.754  12.868   3.476
  597    H    GLN  80           H        GLN  80  -4.661  10.627   2.605
  598    HA   GLN  80           HA       GLN  80  -3.683  10.561   5.251
  599    HB2  GLN  80          2HB       GLN  80  -6.058   8.927   4.418
  600    HB3  GLN  80          1HB       GLN  80  -5.794   9.804   5.915
  601    HG2  GLN  80          2HG       GLN  80  -7.370  11.112   4.901
  602    HG3  GLN  80          1HG       GLN  80  -5.883  11.903   4.380
  603   HE21  GLN  80          1HE2      GLN  80  -7.007   8.844   3.088
  604   HE22  GLN  80          2HE2      GLN  80  -7.405   9.438   1.512
  605    H    TYR  81           H        TYR  81  -3.646   8.329   2.678
  606    HA   TYR  81           HA       TYR  81  -3.428   5.976   4.334
  607    HB2  TYR  81          2HB       TYR  81  -3.691   6.432   1.376
  608    HB3  TYR  81          1HB       TYR  81  -3.244   4.857   2.026
  609    HD1  TYR  81          1HD       TYR  81  -5.623   4.975   0.430
  610    HD2  TYR  81          2HD       TYR  81  -5.168   5.883   4.549
  611    HE1  TYR  81          1HE       TYR  81  -7.975   4.347   0.816
  612    HE2  TYR  81          2HE       TYR  81  -7.499   5.303   4.938
  613    HH   TYR  81           HH       TYR  81  -9.362   3.591   2.769
  614    H    VAL  82           H        VAL  82  -1.461   7.905   2.115
  615    HA   VAL  82           HA       VAL  82   0.762   6.245   2.164
  616    HB   VAL  82           HB       VAL  82   1.932   8.260   1.470
  617   HG11  VAL  82          1HG1      VAL  82   0.924   6.922  -0.234
  618   HG12  VAL  82          2HG1      VAL  82   0.726   8.628  -0.650
  619   HG13  VAL  82          3HG1      VAL  82  -0.624   7.721   0.040
  620   HG21  VAL  82          1HG2      VAL  82  -0.599   9.617   2.077
  621   HG22  VAL  82          2HG2      VAL  82   0.538  10.266   0.893
  622   HG23  VAL  82          3HG2      VAL  82   1.041  10.044   2.571
  623    H    ARG  83           H        ARG  83  -0.017   9.143   4.025
  624    HA   ARG  83           HA       ARG  83   2.134   8.925   5.833
  625    HB2  ARG  83          2HB       ARG  83  -0.458  10.044   6.766
  626    HB3  ARG  83          1HB       ARG  83   1.159  10.572   7.137
  627    HG2  ARG  83          2HG       ARG  83   1.343  11.839   5.205
  628    HG3  ARG  83          1HG       ARG  83   0.051  10.948   4.395
  629    HD2  ARG  83          2HD       ARG  83  -1.579  12.042   5.391
  630    HD3  ARG  83          1HD       ARG  83  -0.677  12.342   6.875
  631    HE   ARG  83           HE       ARG  83  -0.729  13.976   4.454
  632   HH11  ARG  83          1HH1      ARG  83   0.736  13.375   7.579
  633   HH12  ARG  83          2HH1      ARG  83   1.243  15.020   7.794
  634   HH21  ARG  83          1HH2      ARG  83  -0.065  16.134   4.740
  635   HH22  ARG  83          2HH2      ARG  83   0.801  16.589   6.173
  636    H    PHE  84           H        PHE  84  -1.009   7.418   5.670
  637    HA   PHE  84           HA       PHE  84  -1.253   6.626   8.356
  638    HB2  PHE  84          2HB       PHE  84  -2.699   6.132   6.081
  639    HB3  PHE  84          1HB       PHE  84  -2.006   4.546   6.419
  640    HD1  PHE  84          1HD       PHE  84  -2.453   3.451   8.563
  641    HD2  PHE  84          2HD       PHE  84  -4.465   7.005   7.398
  642    HE1  PHE  84          1HE       PHE  84  -4.196   3.003  10.239
  643    HE2  PHE  84          2HE       PHE  84  -6.214   6.571   9.075
  644    HZ   PHE  84           HZ       PHE  84  -6.082   4.566  10.498
  645    H    ILE  85           H        ILE  85   0.377   5.071   5.641
  646    HA   ILE  85           HA       ILE  85   1.402   2.972   7.334
  647    HB   ILE  85           HB       ILE  85   1.688   3.579   4.429
  648   HG12  ILE  85          2HG1      ILE  85   0.911   1.171   6.090
  649   HG13  ILE  85          1HG1      ILE  85  -0.160   2.190   5.138
  650   HG21  ILE  85          1HG2      ILE  85   3.959   3.182   4.975
  651   HG22  ILE  85          2HG2      ILE  85   3.334   1.673   4.305
  652   HG23  ILE  85          3HG2      ILE  85   3.537   1.848   6.045
  653   HD11  ILE  85          1HD1      ILE  85   0.858   1.369   3.089
  654   HD12  ILE  85          2HD1      ILE  85   0.251   0.039   4.074
  655   HD13  ILE  85          3HD1      ILE  85   1.981   0.373   4.023
  656    H    ALA  86           H        ALA  86   2.755   5.826   5.719
  657    HA   ALA  86           HA       ALA  86   5.396   5.635   6.513
  658    HB1  ALA  86          1HB       ALA  86   4.461   7.345   4.974
  659    HB2  ALA  86          2HB       ALA  86   5.532   8.021   6.203
  660    HB3  ALA  86          3HB       ALA  86   3.787   8.181   6.373
  661    H    GLN  87           H        GLN  87   2.613   6.559   8.394
  662    HA   GLN  87           HA       GLN  87   4.108   7.547  10.627
  663    HB2  GLN  87          2HB       GLN  87   1.804   8.298  10.081
  664    HB3  GLN  87          1HB       GLN  87   1.215   6.692  10.483
  665    HG2  GLN  87          2HG       GLN  87   2.044   6.998  12.782
  666    HG3  GLN  87          1HG       GLN  87   2.538   8.638  12.357
  667   HE21  GLN  87          1HE2      GLN  87   0.948  10.194  11.935
  668   HE22  GLN  87          2HE2      GLN  87  -0.686   9.984  12.462
  669    H    HIS  88           H        HIS  88   2.479   4.553   9.736
  670    HA   HIS  88           HA       HIS  88   2.953   3.281  12.263
  671    HB2  HIS  88          2HB       HIS  88   1.928   2.301   9.609
  672    HB3  HIS  88          1HB       HIS  88   2.273   1.183  10.922
  673    HD1  HIS  88          1HD       HIS  88   1.124   2.894  13.255
  674    HD2  HIS  88          2HD       HIS  88  -0.819   2.182   9.639
  675    HE1  HIS  88          1HE       HIS  88  -1.322   3.210  13.728
  676    HE2  HIS  88          2HE       HIS  88  -2.458   2.933  11.502
  677    H    PHE  89           H        PHE  89   4.713   3.567   9.280
  678    HA   PHE  89           HA       PHE  89   6.855   1.909  10.344
  679    HB2  PHE  89          2HB       PHE  89   5.091   0.525   9.030
  680    HB3  PHE  89          1HB       PHE  89   5.787   1.288   7.610
  681    HD1  PHE  89          1HD       PHE  89   7.652   0.374   6.600
  682    HD2  PHE  89          2HD       PHE  89   6.690  -0.740  10.586
  683    HE1  PHE  89          1HE       PHE  89   9.374  -1.380   6.519
  684    HE2  PHE  89          2HE       PHE  89   8.419  -2.487  10.523
  685    HZ   PHE  89           HZ       PHE  89   9.764  -2.810   8.485
  686    HA   PRO  90           HA       PRO  90   8.962   5.400   8.279
  687    HB2  PRO  90          2HB       PRO  90  11.207   3.808   9.420
  688    HB3  PRO  90          1HB       PRO  90  10.900   5.545   9.510
  689    HG2  PRO  90          2HG       PRO  90  10.472   3.987  11.618
  690    HG3  PRO  90          1HG       PRO  90   9.370   5.322  11.234
  691    HD2  PRO  90          2HD       PRO  90   9.015   2.388  10.807
  692    HD3  PRO  90          1HD       PRO  90   7.822   3.613  11.283
  693    H    CYS  91           H        CYS  91  10.372   5.519   6.486
  694    HA   CYS  91           HA       CYS  91  10.130   3.475   4.570
  695    HB2  CYS  91          2HB       CYS  91  11.705   4.885   3.257
  696    HB3  CYS  91          1HB       CYS  91  10.401   5.834   3.994
  697    HG   CYS  91           HG       CYS  91  13.513   6.489   4.091
  698    H    ALA  92           H        ALA  92  11.445   1.984   3.822
  699    HA   ALA  92           HA       ALA  92  12.800   0.401   5.562
  700    HB1  ALA  92          1HB       ALA  92  13.443   0.551   2.628
  701    HB2  ALA  92          2HB       ALA  92  12.062  -0.299   3.323
  702    HB3  ALA  92          3HB       ALA  92  13.707  -0.818   3.712
  703    HA   PRO  93           HA       PRO  93  16.493   2.318   6.673
  704    HB2  PRO  93          2HB       PRO  93  17.848   0.200   7.639
  705    HB3  PRO  93          1HB       PRO  93  16.399   0.826   8.423
  706    HG2  PRO  93          2HG       PRO  93  16.668  -1.495   6.544
  707    HG3  PRO  93          1HG       PRO  93  15.797  -1.410   8.088
  708    HD2  PRO  93          2HD       PRO  93  14.541  -1.159   5.707
  709    HD3  PRO  93          1HD       PRO  93  14.014  -0.277   7.159
  710    H    GLU  94           H        GLU  94  16.444   0.397   3.948
  711    HA   GLU  94           HA       GLU  94  19.269  -0.029   3.673
  712    HB2  GLU  94          2HB       GLU  94  17.385  -1.467   2.693
  713    HB3  GLU  94          1HB       GLU  94  17.253  -0.229   1.451
  714    HG2  GLU  94          2HG       GLU  94  19.563  -0.607   0.802
  715    HG3  GLU  94          1HG       GLU  94  19.733  -1.817   2.074
  716    H    GLU  95           H        GLU  95  17.267   2.570   3.261
  717    HA   GLU  95           HA       GLU  95  18.561   3.837   1.024
  718    HB2  GLU  95          2HB       GLU  95  17.212   5.821   1.735
  719    HB3  GLU  95          1HB       GLU  95  16.253   4.371   1.467
  720    HG2  GLU  95          2HG       GLU  95  15.804   4.073   3.664
  721    HG3  GLU  95          1HG       GLU  95  17.220   4.972   4.205
  722    H    GLU  96           H        GLU  96  20.297   3.015   3.223
  723    HA   GLU  96           HA       GLU  96  20.957   5.188   4.899
  724    HB2  GLU  96          2HB       GLU  96  21.540   2.719   5.201
  725    HB3  GLU  96          1HB       GLU  96  22.857   3.000   4.071
  726    HG2  GLU  96          2HG       GLU  96  23.676   3.135   6.327
  727    HG3  GLU  96          1HG       GLU  96  23.751   4.727   5.571
  728    H    LYS  97           H        LYS  97  22.044   4.202   1.714
  729    HA   LYS  97           HA       LYS  97  23.343   6.812   1.485
  730    HB2  LYS  97          2HB       LYS  97  24.503   4.191   0.542
  731    HB3  LYS  97          1HB       LYS  97  25.050   5.746  -0.059
  732    HG2  LYS  97          2HG       LYS  97  25.642   6.390   2.249
  733    HG3  LYS  97          1HG       LYS  97  25.173   4.776   2.787
  734    HD2  LYS  97          2HD       LYS  97  26.872   3.783   1.359
  735    HD3  LYS  97          1HD       LYS  97  27.314   5.377   0.748
  736    HE2  LYS  97          2HE       LYS  97  28.909   4.705   2.419
  737    HE3  LYS  97          1HE       LYS  97  27.942   6.038   3.048
  738    HZ1  LYS  97          1HZ       LYS  97  27.541   3.163   3.672
  739    HZ2  LYS  97          2HZ       LYS  97  26.613   4.437   4.278
  740    HZ3  LYS  97          3HZ       LYS  97  28.244   4.307   4.700
  741    HA   PRO  98           HA       PRO  98  21.451   5.912  -2.701
  742    HB2  PRO  98          2HB       PRO  98  21.105   3.379  -3.581
  743    HB3  PRO  98          1HB       PRO  98  22.689   4.154  -3.520
  744    HG2  PRO  98          2HG       PRO  98  21.684   1.943  -1.924
  745    HG3  PRO  98          1HG       PRO  98  23.331   2.581  -2.017
  746    HD2  PRO  98          2HD       PRO  98  21.211   3.144  -0.044
  747    HD3  PRO  98          1HD       PRO  98  22.965   3.358   0.096
  748    HA   PRO  99           HA       PRO  99  17.151   4.954  -1.342
  749    HB2  PRO  99          2HB       PRO  99  16.175   7.434  -1.404
  750    HB3  PRO  99          1HB       PRO  99  17.083   6.844  -0.009
  751    HG2  PRO  99          2HG       PRO  99  17.916   8.718  -2.155
  752    HG3  PRO  99          1HG       PRO  99  18.426   8.649  -0.463
  753    HD2  PRO  99          2HD       PRO  99  19.833   7.644  -2.694
  754    HD3  PRO  99          1HD       PRO  99  20.205   7.349  -0.986
  755    H    GLU 100           H        GLU 100  17.472   4.033  -3.582
  756    HA   GLU 100           HA       GLU 100  16.998   5.770  -5.824
  757    HB2  GLU 100          2HB       GLU 100  18.597   3.894  -5.951
  758    HB3  GLU 100          1HB       GLU 100  17.271   2.768  -5.745
  759    HG2  GLU 100          2HG       GLU 100  16.292   3.491  -7.826
  760    HG3  GLU 100          1HG       GLU 100  17.588   4.663  -8.050
  761    H    ILE 101           H        ILE 101  15.446   2.598  -5.557
  762    HA   ILE 101           HA       ILE 101  12.826   3.854  -5.497
  763    HB   ILE 101           HB       ILE 101  11.988   2.564  -7.425
  764   HG12  ILE 101          2HG1      ILE 101  14.893   2.008  -8.051
  765   HG13  ILE 101          1HG1      ILE 101  13.760   0.830  -7.413
  766   HG21  ILE 101          1HG2      ILE 101  12.959   3.963  -9.194
  767   HG22  ILE 101          2HG2      ILE 101  14.232   4.463  -8.076
  768   HG23  ILE 101          3HG2      ILE 101  12.550   4.885  -7.749
  769   HD11  ILE 101          1HD1      ILE 101  14.031   0.545  -9.757
  770   HD12  ILE 101          2HD1      ILE 101  13.533   2.211 -10.048
  771   HD13  ILE 101          3HD1      ILE 101  12.391   1.048  -9.376
  772    H    ASP 102           H        ASP 102  13.995   2.418  -3.499
  773    HA   ASP 102           HA       ASP 102  13.395  -0.313  -3.349
  774    HB2  ASP 102          2HB       ASP 102  13.336   1.822  -1.207
  775    HB3  ASP 102          1HB       ASP 102  13.164   0.115  -0.868
  776    H    ALA 103           H        ALA 103  11.467   2.466  -3.360
  777    HA   ALA 103           HA       ALA 103   9.023   1.408  -2.399
  778    HB1  ALA 103          1HB       ALA 103   9.457   3.681  -4.334
  779    HB2  ALA 103          2HB       ALA 103   9.621   3.833  -2.584
  780    HB3  ALA 103          3HB       ALA 103   8.052   3.417  -3.293
  781    H    LEU 104           H        LEU 104  10.324   1.912  -5.670
  782    HA   LEU 104           HA       LEU 104   7.813   1.092  -6.818
  783    HB2  LEU 104          2HB       LEU 104  10.351   1.806  -8.270
  784    HB3  LEU 104          1HB       LEU 104   8.723   1.782  -8.921
  785    HG   LEU 104           HG       LEU 104   9.836   3.729  -6.901
  786   HD11  LEU 104          1HD1      LEU 104   9.343   5.391  -8.615
  787   HD12  LEU 104          2HD1      LEU 104   8.802   4.111  -9.701
  788   HD13  LEU 104          3HD1      LEU 104  10.490   4.184  -9.193
  789   HD21  LEU 104          1HD2      LEU 104   7.541   3.175  -6.303
  790   HD22  LEU 104          2HD2      LEU 104   7.019   3.510  -7.953
  791   HD23  LEU 104          3HD2      LEU 104   7.646   4.813  -6.947
  792    H    GLU 105           H        GLU 105  11.033  -0.288  -6.444
  793    HA   GLU 105           HA       GLU 105  10.059  -2.680  -7.845
  794    HB2  GLU 105          2HB       GLU 105  12.325  -3.458  -7.971
  795    HB3  GLU 105          1HB       GLU 105  12.267  -1.810  -8.586
  796    HG2  GLU 105          2HG       GLU 105  13.177  -0.980  -6.491
  797    HG3  GLU 105          1HG       GLU 105  13.187  -2.617  -5.835
  798    H    LEU 106           H        LEU 106  11.031  -4.748  -6.806
  799    HA   LEU 106           HA       LEU 106  10.381  -4.632  -3.942
  800    HB2  LEU 106          2HB       LEU 106   9.500  -6.393  -6.130
  801    HB3  LEU 106          1HB       LEU 106   9.884  -7.209  -4.624
  802    HG   LEU 106           HG       LEU 106   7.500  -6.724  -4.776
  803   HD11  LEU 106          1HD1      LEU 106   7.218  -5.591  -2.642
  804   HD12  LEU 106          2HD1      LEU 106   8.882  -5.017  -2.715
  805   HD13  LEU 106          3HD1      LEU 106   8.551  -6.744  -2.580
  806   HD21  LEU 106          1HD2      LEU 106   7.584  -4.761  -6.212
  807   HD22  LEU 106          2HD2      LEU 106   8.323  -3.825  -4.912
  808   HD23  LEU 106          3HD2      LEU 106   6.673  -4.424  -4.739
  809    H    LYS 107           H        LYS 107  11.774  -5.499  -2.543
  810    HA   LYS 107           HA       LYS 107  13.858  -7.302  -3.527
  811    HB2  LYS 107          2HB       LYS 107  14.321  -4.811  -1.883
  812    HB3  LYS 107          1HB       LYS 107  15.516  -6.087  -2.064
  813    HG2  LYS 107          2HG       LYS 107  15.543  -5.712  -4.485
  814    HG3  LYS 107          1HG       LYS 107  14.358  -4.420  -4.292
  815    HD2  LYS 107          2HD       LYS 107  17.094  -4.458  -3.026
  816    HD3  LYS 107          1HD       LYS 107  16.678  -3.590  -4.504
  817    HE2  LYS 107          2HE       LYS 107  15.049  -2.259  -3.273
  818    HE3  LYS 107          1HE       LYS 107  15.430  -3.143  -1.797
  819    HZ1  LYS 107          1HZ       LYS 107  17.686  -2.279  -1.898
  820    HZ2  LYS 107          2HZ       LYS 107  16.557  -1.014  -1.870
  821    HZ3  LYS 107          3HZ       LYS 107  17.321  -1.437  -3.323
  822    H    THR 108           H        THR 108  11.518  -7.960  -2.204
  823    HA   THR 108           HA       THR 108  11.805  -8.180   0.601
  824    HB   THR 108           HB       THR 108  10.169  -9.947  -1.233
  825    HG1  THR 108          1HG       THR 108   9.905  -7.296  -0.480
  826   HG21  THR 108          1HG2      THR 108  10.362 -10.786   1.063
  827   HG22  THR 108          2HG2      THR 108   8.723 -10.227   0.726
  828   HG23  THR 108          3HG2      THR 108   9.817  -9.226   1.681
  829    H    GLN 109           H        GLN 109  12.562 -10.328  -2.105
  830    HA   GLN 109           HA       GLN 109  13.970 -12.100  -0.238
  831    HB2  GLN 109          2HB       GLN 109  14.001 -13.744  -2.057
  832    HB3  GLN 109          1HB       GLN 109  12.365 -13.228  -1.686
  833    HG2  GLN 109          2HG       GLN 109  12.438 -11.712  -3.628
  834    HG3  GLN 109          1HG       GLN 109  14.039 -12.334  -4.019
  835   HE21  GLN 109          1HE2      GLN 109  13.290 -15.048  -3.150
  836   HE22  GLN 109          2HE2      GLN 109  12.308 -15.687  -4.419
  837    H    LYS 110           H        LYS 110  16.138 -12.416  -0.377
  838    HA   LYS 110           HA       LYS 110  17.587 -10.413  -1.905
  839    HB2  LYS 110          2HB       LYS 110  18.451 -12.306   0.280
  840    HB3  LYS 110          1HB       LYS 110  19.557 -11.231  -0.561
  841    HG2  LYS 110          2HG       LYS 110  17.204 -10.424   1.137
  842    HG3  LYS 110          1HG       LYS 110  18.911 -10.260   1.547
  843    HD2  LYS 110          2HD       LYS 110  17.479  -8.856  -0.711
  844    HD3  LYS 110          1HD       LYS 110  17.978  -8.128   0.814
  845    HE2  LYS 110          2HE       LYS 110  19.866  -9.354  -1.192
  846    HE3  LYS 110          1HE       LYS 110  19.503  -7.635  -1.086
  847    HZ1  LYS 110          1HZ       LYS 110  21.545  -8.172   0.066
  848    HZ2  LYS 110          2HZ       LYS 110  20.734  -9.275   1.061
  849    HZ3  LYS 110          3HZ       LYS 110  20.382  -7.624   1.162
  850    H    GLY 111           H        GLY 111  17.310 -11.321  -3.972
  851    HA2  GLY 111          2HA       GLY 111  18.467 -13.911  -4.554
  852    HA3  GLY 111          1HA       GLY 111  17.796 -12.776  -5.718
  853    H    PHE 112           H        PHE 112  20.522 -13.008  -3.451
  854    HA   PHE 112           HA       PHE 112  22.285 -12.024  -5.572
  855    HB2  PHE 112          2HB       PHE 112  21.550 -10.140  -4.027
  856    HB3  PHE 112          1HB       PHE 112  22.425 -10.968  -2.745
  857    HD1  PHE 112          1HD       PHE 112  24.562 -10.240  -2.317
  858    HD2  PHE 112          2HD       PHE 112  23.003  -9.847  -6.255
  859    HE1  PHE 112          1HE       PHE 112  26.633  -9.117  -3.022
  860    HE2  PHE 112          2HE       PHE 112  25.071  -8.724  -6.963
  861    HZ   PHE 112           HZ       PHE 112  26.889  -8.358  -5.349