*HEADER    TRANSFERASE                             16-FEB-04   1SE7              
*TITLE     SOLUTION STRUCTURE OF THE E. COLI BACTERIOPHAGE P1 ENCODED            
*TITLE    2 HOT PROTEIN: A HOMOLOGUE OF THE THETA SUBUNIT OF E. COLI             
*TITLE    3 DNA POLYMERASE III                                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HOMOLOGUE OF THE THETA SUBUNIT OF DNA POLYMERASE           
*COMPND   3 III;                                                                 
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 SYNONYM: HOT;                                                        
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACTERIOPHAGE P1;                               
*SOURCE   3 ORGANISM_COMMON: VIRUS;                                              
*SOURCE   4 GENE: HOT;                                                           
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BLR(DE3);                                  
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET30HOT                                  
*KEYWDS    E. COLI BACTERIOPHAGE P1, HOMOLOGUE OF THETA, HOT, E. COLI            
*KEYWDS   2 DNA POLYMERASE III                                                   
*EXPDTA    NMR, 7 STRUCTURES                                                     
*AUTHOR    E.F.DEROSE, T.W.KIRBY, G.A.MUELLER, A.K.CHIKOVA,                      
*AUTHOR   2 R.M.SCHAAPER, R.E.LONDON                                             
*REVDAT   1   14-DEC-04 1SE7    0                                                

! Talos Database predictions rerun by GM 030399
! Chemical shifts corrected for deuteration HVIL labeling
! Talos recompiled without mbp in database.

{* PHI restraints from Luginbuehl et al., JMR B 109(1995):229-233 *}
{* Helix: -120...-20 = -70.0 50.0 2 *}
{* Sheet: 160...180...-80 = -140.0 60.0 2 *}
{* PSI restraints --- see note above *}
{* Helix: -100...0 = -50.0 50.0 2 *}
{* Sheet: 40.0...180.0...-140.0 = 130.0 90.0 2 *}

!Talos predictions take precedance.

! Resdiue D 3 DATABASE
assign (resid 2 and name C  )(resid 3 and name N  )
       (resid 3 and name CA )(resid 3 and name C  ) 1.0 -81.23 32.88 2
assign (resid 3 and name N  )(resid 3 and name CA )
       (resid 3 and name C  )(resid 4 and name N  ) 1.0 133.07 37.40 2

! Resdiue Q 11 DATABASE
assign (resid 10 and name C  )(resid 11 and name N  )
       (resid 11 and name CA )(resid 11 and name C  ) 1.0 -64.00 20.00 2
assign (resid 11 and name N  )(resid 11 and name CA )
       (resid 11 and name C  )(resid 12 and name N  ) 1.0 -35.00 30.00 2

! Resdiue E 12 DATABASE
assign (resid 11 and name C  )(resid 12 and name N  )
       (resid 12 and name CA )(resid 12 and name C  ) 1.0 -66.00 20.00 2
assign (resid 12 and name N  )(resid 12 and name CA )
       (resid 12 and name C  )(resid 13 and name N  ) 1.0 -39.00 20.00 2

! Resdiue E 13 DATABASE
assign (resid 12 and name C  )(resid 13 and name N  )
       (resid 13 and name CA )(resid 13 and name C  ) 1.0 -63.00 20.00 2
assign (resid 13 and name N  )(resid 13 and name CA )
       (resid 13 and name C  )(resid 14 and name N  ) 1.0 -43.00 26.00 2

! Resdiue R 14 DATABASE
assign (resid 13 and name C  )(resid 14 and name N  )
       (resid 14 and name CA )(resid 14 and name C  ) 1.0 -65.00 20.00 2
assign (resid 14 and name N  )(resid 14 and name CA )
       (resid 14 and name C  )(resid 15 and name N  ) 1.0 -44.00 20.00 2

! Resdiue D 15 DATABASE
assign (resid 14 and name C  )(resid 15 and name N  )
       (resid 15 and name CA )(resid 15 and name C  ) 1.0 -62.00 20.00 2
assign (resid 15 and name N  )(resid 15 and name CA )
       (resid 15 and name C  )(resid 16 and name N  ) 1.0 -38.00 20.00 2

! Resdiue K 16 DATABASE
assign (resid 15 and name C  )(resid 16 and name N  )
       (resid 16 and name CA )(resid 16 and name C  ) 1.0 -65.00 20.00 2
assign (resid 16 and name N  )(resid 16 and name CA )
       (resid 16 and name C  )(resid 17 and name N  ) 1.0 -42.00 20.00 2

! Resdiue V 17 DATABASE
assign (resid 16 and name C  )(resid 17 and name N  )
       (resid 17 and name CA )(resid 17 and name C  ) 1.0 -63.00 26.00 2
assign (resid 17 and name N  )(resid 17 and name CA )
       (resid 17 and name C  )(resid 18 and name N  ) 1.0 -37.00 20.00 2

! Resdiue N 18 DATABASE
assign (resid 17 and name C  )(resid 18 and name N  )
       (resid 18 and name CA )(resid 18 and name C  ) 1.0 -65.13 20.00 2
assign (resid 18 and name N  )(resid 18 and name CA )
       (resid 18 and name C  )(resid 19 and name N  ) 1.0 -40.36 20.00 2

! Resdiue V 19 DATABASE
assign (resid 18 and name C  )(resid 19 and name N  )
       (resid 19 and name CA )(resid 19 and name C  ) 1.0 -70.74 20.00 2
assign (resid 19 and name N  )(resid 19 and name CA )
       (resid 19 and name C  )(resid 20 and name N  ) 1.0 -42.92 20.00 2

! Resdiue D 20 DATABASE
assign (resid 19 and name C  )(resid 20 and name N  )
       (resid 20 and name CA )(resid 20 and name C  ) 1.0 -64.27 20.00 2
assign (resid 20 and name N  )(resid 20 and name CA )
       (resid 20 and name C  )(resid 21 and name N  ) 1.0 -39.82 20.00 2

! Resdiue L 21 DATABASE
assign (resid 20 and name C  )(resid 21 and name N  )
       (resid 21 and name CA )(resid 21 and name C  ) 1.0 -66.81 20.00 2
assign (resid 21 and name N  )(resid 21 and name CA )
       (resid 21 and name C  )(resid 22 and name N  ) 1.0 -38.84 24.48 2

! Resdiue A 22 DATABASE
assign (resid 21 and name C  )(resid 22 and name N  )
       (resid 22 and name CA )(resid 22 and name C  ) 1.0 -67.18 20.00 2
assign (resid 22 and name N  )(resid 22 and name CA )
       (resid 22 and name C  )(resid 23 and name N  ) 1.0 -40.01 20.00 2

! Resdiue A 23 DATABASE
assign (resid 22 and name C  )(resid 23 and name N  )
       (resid 23 and name CA )(resid 23 and name C  ) 1.0 -63.73 20.00 2
assign (resid 23 and name N  )(resid 23 and name CA )
       (resid 23 and name C  )(resid 24 and name N  ) 1.0 -43.89 20.00 2

! Resdiue S 24 DATABASE
assign (resid 23 and name C  )(resid 24 and name N  )
       (resid 24 and name CA )(resid 24 and name C  ) 1.0 -64.33 20.00 2
assign (resid 24 and name N  )(resid 24 and name CA )
       (resid 24 and name C  )(resid 25 and name N  ) 1.0 -41.77 20.00 2

! Resdiue G 25 DATABASE
assign (resid 24 and name C  )(resid 25 and name N  )
       (resid 25 and name CA )(resid 25 and name C  ) 1.0 -68.00 20.00 2
assign (resid 25 and name N  )(resid 25 and name CA )
       (resid 25 and name C  )(resid 26 and name N  ) 1.0 -40.00 20.00 2

! Resdiue V 26 DATABASE
assign (resid 25 and name C  )(resid 26 and name N  )
       (resid 26 and name CA )(resid 26 and name C  ) 1.0 -60.00 22.00 2
assign (resid 26 and name N  )(resid 26 and name CA )
       (resid 26 and name C  )(resid 27 and name N  ) 1.0 -40.00 20.00 2

! Resdiue A 27 DATABASE
assign (resid 26 and name C  )(resid 27 and name N  )
       (resid 27 and name CA )(resid 27 and name C  ) 1.0 -67.00 20.00 2
assign (resid 27 and name N  )(resid 27 and name CA )
       (resid 27 and name C  )(resid 28 and name N  ) 1.0 -35.00 20.00 2

! Resdiue Y 28 DATABASE
assign (resid 27 and name C  )(resid 28 and name N  )
       (resid 28 and name CA )(resid 28 and name C  ) 1.0 -66.00 20.00 2
assign (resid 28 and name N  )(resid 28 and name CA )
       (resid 28 and name C  )(resid 29 and name N  ) 1.0 -44.00 20.00 2

! Resdiue K 29 DATABASE
assign (resid 28 and name C  )(resid 29 and name N  )
       (resid 29 and name CA )(resid 29 and name C  ) 1.0 -65.00 20.00 2
assign (resid 29 and name N  )(resid 29 and name CA )
       (resid 29 and name C  )(resid 30 and name N  ) 1.0 -40.00 20.00 2

! Resdiue I 34 DATABASE
assign (resid 33 and name C  )(resid 34 and name N  )
       (resid 34 and name CA )(resid 34 and name C  ) 1.0 -109.00 52.00 2
assign (resid 34 and name N  )(resid 34 and name CA )
       (resid 34 and name C  )(resid 35 and name N  ) 1.0 145.00 72.00 2

! Resdiue V 36 DATABASE
assign (resid 35 and name C  )(resid 36 and name N  )
       (resid 36 and name CA )(resid 36 and name C  ) 1.0 -112.00 68.00 2
assign (resid 36 and name N  )(resid 36 and name CA )
       (resid 36 and name C  )(resid 37 and name N  ) 1.0 120.00 42.00 2

! Resdiue I 37 DATABASE
assign (resid 36 and name C  )(resid 37 and name N  )
       (resid 37 and name CA )(resid 37 and name C  ) 1.0 -97.00 48.00 2
assign (resid 37 and name N  )(resid 37 and name CA )
       (resid 37 and name C  )(resid 38 and name N  ) 1.0 119.00 44.00 2

! Resdiue A 38 DATABASE
assign (resid 37 and name C  )(resid 38 and name N  )
       (resid 38 and name CA )(resid 38 and name C  ) 1.0 -62.00 20.00 2
assign (resid 38 and name N  )(resid 38 and name CA )
       (resid 38 and name C  )(resid 39 and name N  ) 1.0 -32.00 20.00 2

! Resdiue E 39 DATABASE
assign (resid 38 and name C  )(resid 39 and name N  )
       (resid 39 and name CA )(resid 39 and name C  ) 1.0 -64.00 20.00 2
assign (resid 39 and name N  )(resid 39 and name CA )
       (resid 39 and name C  )(resid 40 and name N  ) 1.0 -38.00 20.00 2

! Resdiue Q 40 DATABASE
assign (resid 39 and name C  )(resid 40 and name N  )
       (resid 40 and name CA )(resid 40 and name C  ) 1.0 -64.00 20.00 2
assign (resid 40 and name N  )(resid 40 and name CA )
       (resid 40 and name C  )(resid 41 and name N  ) 1.0 -47.00 20.00 2

! Resdiue V 41 DATABASE
assign (resid 40 and name C  )(resid 41 and name N  )
       (resid 41 and name CA )(resid 41 and name C  ) 1.0 -71.00 20.00 2
assign (resid 41 and name N  )(resid 41 and name CA )
       (resid 41 and name C  )(resid 42 and name N  ) 1.0 -39.00 20.00 2

! Resdiue A 42 DATABASE
assign (resid 41 and name C  )(resid 42 and name N  )
       (resid 42 and name CA )(resid 42 and name C  ) 1.0 -67.00 20.00 2
assign (resid 42 and name N  )(resid 42 and name CA )
       (resid 42 and name C  )(resid 43 and name N  ) 1.0 -36.00 20.00 2

! Resdiue R 43 DATABASE
assign (resid 42 and name C  )(resid 43 and name N  )
       (resid 43 and name CA )(resid 43 and name C  ) 1.0 -70.00 20.00 2
assign (resid 43 and name N  )(resid 43 and name CA )
       (resid 43 and name C  )(resid 44 and name N  ) 1.0 -27.00 20.00 2

! Resdiue E 44 DATABASE
assign (resid 43 and name C  )(resid 44 and name N  )
       (resid 44 and name CA )(resid 44 and name C  ) 1.0 -90.00 30.00 2
assign (resid 44 and name N  )(resid 44 and name CA )
       (resid 44 and name C  )(resid 45 and name N  ) 1.0 -24.00 44.00 2

! Resdiue E 47 DATABASE
assign (resid 46 and name C  )(resid 47 and name N  )
       (resid 47 and name CA )(resid 47 and name C  ) 1.0 -65.00 20.00 2
assign (resid 47 and name N  )(resid 47 and name CA )
       (resid 47 and name C  )(resid 48 and name N  ) 1.0 -32.00 20.00 2

! Resdiue R 50 DATABASE
assign (resid 49 and name C  )(resid 50 and name N  )
       (resid 50 and name CA )(resid 50 and name C  ) 1.0 -62.00 20.00 2
assign (resid 50 and name N  )(resid 50 and name CA )
       (resid 50 and name C  )(resid 51 and name N  ) 1.0 -39.00 20.00 2

! Resdiue T 51 DATABASE
assign (resid 50 and name C  )(resid 51 and name N  )
       (resid 51 and name CA )(resid 51 and name C  ) 1.0 -71.14 20.00 2
assign (resid 51 and name N  )(resid 51 and name CA )
       (resid 51 and name C  )(resid 52 and name N  ) 1.0 -36.01 20.00 2

! Resdiue Y 52 DATABASE
assign (resid 51 and name C  )(resid 52 and name N  )
       (resid 52 and name CA )(resid 52 and name C  ) 1.0 -67.30 20.00 2
assign (resid 52 and name N  )(resid 52 and name CA )
       (resid 52 and name C  )(resid 53 and name N  ) 1.0 -41.84 20.00 2

! Resdiue F 53 DATABASE
assign (resid 52 and name C  )(resid 53 and name N  )
       (resid 53 and name CA )(resid 53 and name C  ) 1.0 -66.59 20.00 2
assign (resid 53 and name N  )(resid 53 and name CA )
       (resid 53 and name C  )(resid 54 and name N  ) 1.0 -39.93 20.00 2

! Resdiue M 54 DATABASE
assign (resid 53 and name C  )(resid 54 and name N  )
       (resid 54 and name CA )(resid 54 and name C  ) 1.0 -62.04 20.00 2
assign (resid 54 and name N  )(resid 54 and name CA )
       (resid 54 and name C  )(resid 55 and name N  ) 1.0 -38.10 20.60 2

! Resdiue E 55 DATABASE
assign (resid 54 and name C  )(resid 55 and name N  )
       (resid 55 and name CA )(resid 55 and name C  ) 1.0 -64.34 20.00 2
assign (resid 55 and name N  )(resid 55 and name CA )
       (resid 55 and name C  )(resid 56 and name N  ) 1.0 -41.65 20.00 2

! Resdiue R 56 DATABASE
assign (resid 55 and name C  )(resid 56 and name N  )
       (resid 56 and name CA )(resid 56 and name C  ) 1.0 -67.00 20.00 2
assign (resid 56 and name N  )(resid 56 and name CA )
       (resid 56 and name C  )(resid 57 and name N  ) 1.0 -32.00 32.00 2

! Resdiue L 57 DATABASE
assign (resid 56 and name C  )(resid 57 and name N  )
       (resid 57 and name CA )(resid 57 and name C  ) 1.0 -66.00 20.00 2
assign (resid 57 and name N  )(resid 57 and name CA )
       (resid 57 and name C  )(resid 58 and name N  ) 1.0 -41.00 20.00 2

! Resdiue R 58 DATABASE
assign (resid 57 and name C  )(resid 58 and name N  )
       (resid 58 and name CA )(resid 58 and name C  ) 1.0 -64.62 20.00 2
assign (resid 58 and name N  )(resid 58 and name CA )
       (resid 58 and name C  )(resid 59 and name N  ) 1.0 -39.18 20.00 2

! Resdiue H 59 DATABASE
assign (resid 58 and name C  )(resid 59 and name N  )
       (resid 59 and name CA )(resid 59 and name C  ) 1.0 -65.12 20.00 2
assign (resid 59 and name N  )(resid 59 and name CA )
       (resid 59 and name C  )(resid 60 and name N  ) 1.0 -43.28 20.00 2

! Resdiue Y 60 DATABASE
assign (resid 59 and name C  )(resid 60 and name N  )
       (resid 60 and name CA )(resid 60 and name C  ) 1.0 -63.95 20.00 2
assign (resid 60 and name N  )(resid 60 and name CA )
       (resid 60 and name C  )(resid 61 and name N  ) 1.0 -36.50 20.00 2

! Resdiue R 61 DATABASE
assign (resid 60 and name C  )(resid 61 and name N  )
       (resid 61 and name CA )(resid 61 and name C  ) 1.0 -67.42 20.00 2
assign (resid 61 and name N  )(resid 61 and name CA )
       (resid 61 and name C  )(resid 62 and name N  ) 1.0 -38.98 20.00 2

! Resdiue Q 62 DATABASE
assign (resid 61 and name C  )(resid 62 and name N  )
       (resid 62 and name CA )(resid 62 and name C  ) 1.0 -67.83 20.00 2
assign (resid 62 and name N  )(resid 62 and name CA )
       (resid 62 and name C  )(resid 63 and name N  ) 1.0 -40.42 20.16 2

! Resdiue L 63 DATABASE
assign (resid 62 and name C  )(resid 63 and name N  )
       (resid 63 and name CA )(resid 63 and name C  ) 1.0 -67.00 20.00 2
assign (resid 63 and name N  )(resid 63 and name CA )
       (resid 63 and name C  )(resid 64 and name N  ) 1.0 -30.00 30.00 2

! Resdiue S 64 DATABASE
assign (resid 63 and name C  )(resid 64 and name N  )
       (resid 64 and name CA )(resid 64 and name C  ) 1.0 -67.00 20.00 2
assign (resid 64 and name N  )(resid 64 and name CA )
       (resid 64 and name C  )(resid 65 and name N  ) 1.0 -21.00 34.00 2

! Resdiue L 65 DATABASE
assign (resid 64 and name C  )(resid 65 and name N  )
       (resid 65 and name CA )(resid 65 and name C  ) 1.0 -80.00 32.00 2
assign (resid 65 and name N  )(resid 65 and name CA )
       (resid 65 and name C  )(resid 66 and name N  ) 1.0 -20.00 32.00 2

! Resdiue L 67 DATABASE
assign (resid 66 and name C  )(resid 67 and name N  )
       (resid 67 and name CA )(resid 67 and name C  ) 1.0 -94.00 50.00 2
assign (resid 67 and name N  )(resid 67 and name CA )
       (resid 67 and name C  )(resid 68 and name N  ) 1.0 131.00 72.00 2

! Resdiue Q 76 DATABASE
assign (resid 75 and name C  )(resid 76 and name N  )
       (resid 76 and name CA )(resid 76 and name C  ) 1.0 -88.00 32.00 2
assign (resid 76 and name N  )(resid 76 and name CA )
       (resid 76 and name C  )(resid 77 and name N  ) 1.0 139.00 46.00 2

! Resdiue K 77 DATABASE
assign (resid 76 and name C  )(resid 77 and name N  )
       (resid 77 and name CA )(resid 77 and name C  ) 1.0 -91.00 42.00 2
assign (resid 77 and name N  )(resid 77 and name CA )
       (resid 77 and name C  )(resid 78 and name N  ) 1.0 129.00 48.00 2

! Resdiue K 82 DATABASE
assign (resid 81 and name C  )(resid 82 and name N  )
       (resid 82 and name CA )(resid 82 and name C  ) 1.0 -97.00 50.00 2
assign (resid 82 and name N  )(resid 82 and name CA )
       (resid 82 and name C  )(resid 83 and name N  ) 1.0 110.00 40.00 2

set message=on echo=on end

! hbonds  7/2/01 RL, GM

! helices

!not sure of yet
assign (resid 16 and name o) (resid 20 and name hn) 2.0 0.7 0.5
assign (resid 16 and name o) (resid 20 and name n) 3.0 0.7 0.5
assign (resid 17 and name o) (resid 21 and name hn) 2.0 0.7 0.5
assign (resid 17 and name o) (resid 21 and name n) 3.0 0.7 0.5
assign (resid 18 and name o) (resid 22 and name hn) 2.0 0.7 0.5
assign (resid 18 and name o) (resid 22 and name n) 3.0 0.7 0.5
assign (resid 19 and name o) (resid 23 and name hn) 2.0 0.7 0.5
assign (resid 19 and name o) (resid 23 and name n) 3.0 0.7 0.5
assign (resid 20 and name o) (resid 24 and name hn) 2.0 0.7 0.5
assign (resid 20 and name o) (resid 24 and name n) 3.0 0.7 0.5
assign (resid 21 and name o) (resid 25 and name hn) 2.0 0.7 0.5
assign (resid 21 and name o) (resid 25 and name n) 3.0 0.7 0.5
assign (resid 22 and name o) (resid 26 and name hn) 2.0 0.7 0.5
assign (resid 22 and name o) (resid 26 and name n) 3.0 0.7 0.5
assign (resid 23 and name o) (resid 27 and name hn) 2.0 0.7 0.5
assign (resid 23 and name o) (resid 27 and name n) 3.0 0.7 0.5
assign (resid 24 and name o) (resid 28 and name hn) 2.0 0.7 0.5
assign (resid 24 and name o) (resid 28 and name n) 3.0 0.7 0.5
assign (resid 25 and name o) (resid 29 and name hn) 2.0 0.7 0.5
assign (resid 25 and name o) (resid 29 and name n) 3.0 0.7 0.5

assign (resid 38 and name o) (resid 42 and name hn) 2.0 0.7 0.5
assign (resid 38 and name o) (resid 42 and name n) 3.0 0.7 0.5

assign (resid 51 and name o) (resid 55 and name hn) 2.0 0.7 0.5
assign (resid 51 and name o) (resid 55 and name n) 3.0 0.7 0.5
assign (resid 52 and name o) (resid 56 and name hn) 2.0 0.7 0.5
assign (resid 52 and name o) (resid 56 and name n) 3.0 0.7 0.5
assign (resid 53 and name o) (resid 57 and name hn) 2.0 0.7 0.5
assign (resid 53 and name o) (resid 57 and name n) 3.0 0.7 0.5
assign (resid 54 and name o) (resid 58 and name hn) 2.0 0.7 0.5
assign (resid 54 and name o) (resid 58 and name n) 3.0 0.7 0.5
assign (resid 55 and name o) (resid 59 and name hn) 2.0 0.7 0.5
assign (resid 55 and name o) (resid 59 and name n) 3.0 0.7 0.5
assign (resid 56 and name o) (resid 60 and name hn) 2.0 0.7 0.5
assign (resid 56 and name o) (resid 60 and name n) 3.0 0.7 0.5
assign (resid 57 and name o) (resid 61 and name hn) 2.0 0.7 0.5
assign (resid 57 and name o) (resid 61 and name n) 3.0 0.7 0.5
assign (resid 58 and name o) (resid 62 and name hn) 2.0 0.7 0.5
assign (resid 58 and name o) (resid 62 and name n) 3.0 0.7 0.5
assign (resid 59 and name o) (resid 63 and name hn) 2.0 0.7 0.5
assign (resid 59 and name o) (resid 63 and name n) 3.0 0.7 0.5
assign (resid 60 and name o) (resid 64 and name hn) 2.0 0.7 0.5
assign (resid 60 and name o) (resid 64 and name n) 3.0 0.7 0.5
assign (resid 61 and name o) (resid 65 and name hn) 2.0 0.7 0.5
assign (resid 61 and name o) (resid 65 and name n) 3.0 0.7 0.5
assign (resid 62 and name o) (resid 66 and name hn) 2.0 0.7 0.5
assign (resid 62 and name o) (resid 66 and name n) 3.0 0.7 0.5

set message=off echo=off end
assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid   4  and name N   )
       ( resid   4  and name HN  )  -2.6100 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid   5  and name N   )
       ( resid   5  and name HN  )   1.6400 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid   6  and name N   )
       ( resid   6  and name HN  )   0.9700 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid   7  and name N   )
       ( resid   7  and name HN  )   0.7300 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid   9  and name N   )
       ( resid   9  and name HN  )  -0.9100 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  10  and name N   )
       ( resid  10  and name HN  )  12.7600 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  11  and name N   )
       ( resid  11  and name HN  )  21.1000 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  12  and name N   )
       ( resid  12  and name HN  )  14.2200 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  14  and name N   )
       ( resid  14  and name HN  )  30.7000 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  15  and name N   )
       ( resid  15  and name HN  )  19.8700 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  17  and name N   )
       ( resid  17  and name HN  )  23.1600 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  19  and name N   )
       ( resid  19  and name HN  )  10.8200 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  20  and name N   )
       ( resid  20  and name HN  )  13.1900 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  21  and name N   )
       ( resid  21  and name HN  )  30.9400 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  23  and name N   )
       ( resid  23  and name HN  )  14.5300 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  25  and name N   )
       ( resid  25  and name HN  )  31.0500 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  30  and name N   )
       ( resid  30  and name HN  )  18.1800 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  32  and name N   )
       ( resid  32  and name HN  )  27.5900 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  34  and name N   )
       ( resid  34  and name HN  )  -4.6200 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  36  and name N   )
       ( resid  36  and name HN  )  -3.8300 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  37  and name N   )
       ( resid  37  and name HN  )   5.7100 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  39  and name N   )
       ( resid  39  and name HN  )  16.4700 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  40  and name N   )
       ( resid  40  and name HN  )  31.1200 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  41  and name N   )
       ( resid  41  and name HN  )  30.4500 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  44  and name N   )
       ( resid  44  and name HN  )  37.6800 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  45  and name N   )
       ( resid  45  and name HN  ) -15.8600 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  47  and name N   )
       ( resid  47  and name HN  )  16.4100 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  48  and name N   )
       ( resid  48  and name HN  )  -2.8500 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  49  and name N   )
       ( resid  49  and name HN  )   5.9600 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  50  and name N   )
       ( resid  50  and name HN  )  24.0100 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  51  and name N   )
       ( resid  51  and name HN  )  32.2800 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  53  and name N   )
       ( resid  53  and name HN  )  33.7300 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  54  and name N   )
       ( resid  54  and name HN  )  24.9200 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  55  and name N   )
       ( resid  55  and name HN  )  36.5900 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  56  and name N   )
       ( resid  56  and name HN  )  33.5500 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  57  and name N   )
       ( resid  57  and name HN  )  28.0800 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  59  and name N   )
       ( resid  59  and name HN  )  38.4100 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  60  and name N   )
       ( resid  60  and name HN  )  31.1800 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  61  and name N   )
       ( resid  61  and name HN  )  16.0500 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  62  and name N   )
       ( resid  62  and name HN  )  30.6300 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  65  and name N   )
       ( resid  65  and name HN  )   7.4800 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  66  and name N   )
       ( resid  66  and name HN  )  16.7700 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  67  and name N   )
       ( resid  67  and name HN  )  -2.4900 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  69  and name N   )
       ( resid  69  and name HN  )   1.5800 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  70  and name N   )
       ( resid  70  and name HN  )   6.9900 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  71  and name N   )
       ( resid  71  and name HN  )  -6.2600 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  72  and name N   )
       ( resid  72  and name HN  )  -2.9200 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  75  and name N   )
       ( resid  75  and name HN  )  -0.5400 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  77  and name N   )
       ( resid  77  and name HN  )  -0.7900 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  78  and name N   )
       ( resid  78  and name HN  )  -1.4600 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  79  and name N   )
       ( resid  79  and name HN  )  -1.7600 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  80  and name N   )
       ( resid  80  and name HN  )   0.0600 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  81  and name N   )
       ( resid  81  and name HN  )  -0.6700 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  82  and name N   )
       ( resid  82  and name HN  )  -1.7000 0.9

assign ( resid 999  and name OO  )
       ( resid 999  and name Z   )
       ( resid 999  and name X   )
       ( resid 999  and name Y   )
       ( resid  83  and name N   )
       ( resid  83  and name HN  )  -0.4200 0.9

 do (store1 =    57.801) (resid 2 and name CA)
 do (store1 =     4.402) (resid 2 and name HA)
 do (store1 =    38.430) (resid 2 and name CB)
 do (store1 =     2.726) (resid 2 and name HB1)
 do (store1 =   133.082) (resid 2 and name CD1)
 do (store1 =     6.901) (resid 2 and name HD1)
 do (store1 =   118.065) (resid 2 and name CE1)
 do (store1 =     6.696) (resid 2 and name HE1)
 do (store1 =   174.904) (resid 2 and name C)
 do (store1 =   122.767) (resid 3 and name N)
 do (store1 =     8.163) (resid 3 and name HN)
 do (store1 =    53.803) (resid 3 and name CA)
 do (store1 =     4.509) (resid 3 and name HA)
 do (store1 =    41.130) (resid 3 and name CB)
 do (store1 =     2.635) (resid 3 and name HB2)
 do (store1 =     2.483) (resid 3 and name HB1)
 do (store1 =   175.838) (resid 3 and name C)
 do (store1 =   121.732) (resid 4 and name N)
 do (store1 =     7.899) (resid 4 and name HN)
 do (store1 =    57.774) (resid 4 and name CA)
 do (store1 =     4.507) (resid 4 and name HA)
 do (store1 =    29.143) (resid 4 and name CB)
 do (store1 =     3.323) (resid 4 and name HB2)
 do (store1 =     3.262) (resid 4 and name HB1)
 do (store1 =   127.204) (resid 4 and name CD1)
 do (store1 =     7.277) (resid 4 and name HD1)
 do (store1 =   129.636) (resid 4 and name NE1)
 do (store1 =    10.168) (resid 4 and name HE1)
 do (store1 =   114.632) (resid 4 and name CZ2)
 do (store1 =     7.385) (resid 4 and name HZ2)
 do (store1 =   124.640) (resid 4 and name CH2)
 do (store1 =     7.146) (resid 4 and name HH2)
 do (store1 =   122.034) (resid 4 and name CZ3)
 do (store1 =     7.121) (resid 4 and name HZ3)
 do (store1 =   120.816) (resid 4 and name CE3)
 do (store1 =     7.614) (resid 4 and name HE3)
 do (store1 =   176.293) (resid 4 and name C)
 do (store1 =   119.463) (resid 5 and name N)
 do (store1 =     8.191) (resid 5 and name HN)
 do (store1 =    53.692) (resid 5 and name CA)
 do (store1 =     4.567) (resid 5 and name HA)
 do (store1 =    38.465) (resid 5 and name CB)
 do (store1 =     2.689) (resid 5 and name HB2)
 do (store1 =     2.536) (resid 5 and name HB1)
 do (store1 =   112.886) (resid 5 and name ND2)
 do (store1 =     6.813) (resid 5 and name HD21)
 do (store1 =     7.602) (resid 5 and name HD22)
 do (store1 =   175.564) (resid 5 and name C)
 do (store1 =   120.403) (resid 6 and name N)
 do (store1 =     7.775) (resid 6 and name HN)
 do (store1 =    61.847) (resid 6 and name CA)
 do (store1 =     3.994) (resid 6 and name HA)
 do (store1 =    38.461) (resid 6 and name CB)
 do (store1 =     1.853) (resid 6 and name HB)
 do (store1 =    27.523) (resid 6 and name CG1)
 do (store1 =     1.427) (resid 6 and name HG12)
 do (store1 =     1.155) (resid 6 and name HG11)
 do (store1 =    13.051) (resid 6 and name CD1)
 do (store1 =     0.838) (resid 6 and name HD11)
 do (store1 =    17.483) (resid 6 and name CG2)
 do (store1 =     0.875) (resid 6 and name HG21)
 do (store1 =   176.391) (resid 6 and name C)
 do (store1 =   125.991) (resid 7 and name N)
 do (store1 =     8.129) (resid 7 and name HN)
 do (store1 =    53.038) (resid 7 and name CA)
 do (store1 =     4.235) (resid 7 and name HA)
 do (store1 =    18.976) (resid 7 and name CB)
 do (store1 =     1.399) (resid 7 and name HB1)
 do (store1 =   177.981) (resid 7 and name C)
 do (store1 =   122.400) (resid 8 and name N)
 do (store1 =     8.058) (resid 8 and name HN)
 do (store1 =    53.047) (resid 8 and name CA)
 do (store1 =     4.245) (resid 8 and name HA)
 do (store1 =    19.009) (resid 8 and name CB)
 do (store1 =     1.375) (resid 8 and name HB1)
 do (store1 =   178.439) (resid 8 and name C)
 do (store1 =   119.951) (resid 9 and name N)
 do (store1 =     8.143) (resid 9 and name HN)
 do (store1 =    56.706) (resid 9 and name CA)
 do (store1 =     4.322) (resid 9 and name HA)
 do (store1 =    33.095) (resid 9 and name CB)
 do (store1 =     1.836) (resid 9 and name HB2)
 do (store1 =     1.753) (resid 9 and name HB1)
 do (store1 =    24.908) (resid 9 and name CG)
 do (store1 =     1.466) (resid 9 and name HG1)
 do (store1 =    29.062) (resid 9 and name CD)
 do (store1 =     1.626) (resid 9 and name HD1)
 do (store1 =    42.149) (resid 9 and name CE)
 do (store1 =     2.942) (resid 9 and name HE1)
 do (store1 =   177.096) (resid 9 and name C)
 do (store1 =   116.402) (resid 10 and name N)
 do (store1 =     8.319) (resid 10 and name HN)
 do (store1 =    58.493) (resid 10 and name CA)
 do (store1 =     4.415) (resid 10 and name HA)
 do (store1 =    64.135) (resid 10 and name CB)
 do (store1 =     4.151) (resid 10 and name HB2)
 do (store1 =     3.967) (resid 10 and name HB1)
 do (store1 =   175.306) (resid 10 and name C)
 do (store1 =   122.821) (resid 11 and name N)
 do (store1 =     8.675) (resid 11 and name HN)
 do (store1 =    58.253) (resid 11 and name CA)
 do (store1 =     3.925) (resid 11 and name HA)
 do (store1 =    28.419) (resid 11 and name CB)
 do (store1 =     2.194) (resid 11 and name HB2)
 do (store1 =     2.081) (resid 11 and name HB1)
 do (store1 =    33.343) (resid 11 and name CG)
 do (store1 =     2.413) (resid 11 and name HG1)
 do (store1 =   115.646) (resid 11 and name NE2)
 do (store1 =     7.422) (resid 11 and name HE21)
 do (store1 =   177.008) (resid 11 and name C)
 do (store1 =   119.006) (resid 12 and name N)
 do (store1 =     8.429) (resid 12 and name HN)
 do (store1 =    59.587) (resid 12 and name CA)
 do (store1 =     4.142) (resid 12 and name HA)
 do (store1 =    29.684) (resid 12 and name CB)
 do (store1 =     2.038) (resid 12 and name HB1)
 do (store1 =    36.901) (resid 12 and name CG)
 do (store1 =     2.242) (resid 12 and name HG1)
 do (store1 =   178.548) (resid 12 and name C)
 do (store1 =   118.465) (resid 13 and name N)
 do (store1 =     7.815) (resid 13 and name HN)
 do (store1 =    58.980) (resid 13 and name CA)
 do (store1 =     3.988) (resid 13 and name HA)
 do (store1 =    29.641) (resid 13 and name CB)
 do (store1 =     2.078) (resid 13 and name HB1)
 do (store1 =    36.601) (resid 13 and name CG)
 do (store1 =     2.348) (resid 13 and name HG2)
 do (store1 =     2.274) (resid 13 and name HG1)
 do (store1 =   178.979) (resid 13 and name C)
 do (store1 =   120.637) (resid 14 and name N)
 do (store1 =     8.032) (resid 14 and name HN)
 do (store1 =    57.305) (resid 14 and name CA)
 do (store1 =    30.150) (resid 14 and name CB)
 do (store1 =     1.927) (resid 14 and name HB1)
 do (store1 =    27.656) (resid 14 and name CG)
 do (store1 =     1.761) (resid 14 and name HG2)
 do (store1 =     1.591) (resid 14 and name HG1)
 do (store1 =    43.591) (resid 14 and name CD)
 do (store1 =     3.191) (resid 14 and name HD1)
 do (store1 =   178.741) (resid 14 and name C)
 do (store1 =   119.852) (resid 15 and name N)
 do (store1 =     8.740) (resid 15 and name HN)
 do (store1 =    57.490) (resid 15 and name CA)
 do (store1 =     4.538) (resid 15 and name HA)
 do (store1 =    40.330) (resid 15 and name CB)
 do (store1 =     2.815) (resid 15 and name HB2)
 do (store1 =     2.519) (resid 15 and name HB1)
 do (store1 =   178.723) (resid 15 and name C)
 do (store1 =   119.283) (resid 16 and name N)
 do (store1 =     7.968) (resid 16 and name HN)
 do (store1 =    61.170) (resid 16 and name CA)
 do (store1 =     3.848) (resid 16 and name HA)
 do (store1 =    32.556) (resid 16 and name CB)
 do (store1 =     1.821) (resid 16 and name HB1)
 do (store1 =    27.133) (resid 16 and name CG)
 do (store1 =     0.745) (resid 16 and name HG1)
 do (store1 =    29.409) (resid 16 and name CD)
 do (store1 =     1.345) (resid 16 and name HD2)
 do (store1 =     1.235) (resid 16 and name HD1)
 do (store1 =    41.307) (resid 16 and name CE)
 do (store1 =     2.306) (resid 16 and name HE1)
 do (store1 =   178.642) (resid 16 and name C)
 do (store1 =   119.717) (resid 17 and name N)
 do (store1 =     7.730) (resid 17 and name HN)
 do (store1 =    66.308) (resid 17 and name CA)
 do (store1 =     3.885) (resid 17 and name HA)
 do (store1 =    31.795) (resid 17 and name CB)
 do (store1 =     2.295) (resid 17 and name HB)
 do (store1 =    22.638) (resid 17 and name CG2)
 do (store1 =     1.116) (resid 17 and name HG21)
 do (store1 =    21.068) (resid 17 and name CG1)
 do (store1 =     0.990) (resid 17 and name HG11)
 do (store1 =   179.474) (resid 17 and name C)
 do (store1 =   119.374) (resid 18 and name N)
 do (store1 =     7.923) (resid 18 and name HN)
 do (store1 =    56.261) (resid 18 and name CA)
 do (store1 =     4.665) (resid 18 and name HA)
 do (store1 =    37.939) (resid 18 and name CB)
 do (store1 =     3.062) (resid 18 and name HB2)
 do (store1 =     2.955) (resid 18 and name HB1)
 do (store1 =   112.899) (resid 18 and name ND2)
 do (store1 =     6.948) (resid 18 and name HD21)
 do (store1 =     7.851) (resid 18 and name HD22)
 do (store1 =   178.530) (resid 18 and name C)
 do (store1 =   123.808) (resid 19 and name N)
 do (store1 =     8.617) (resid 19 and name HN)
 do (store1 =    66.427) (resid 19 and name CA)
 do (store1 =     4.071) (resid 19 and name HA)
 do (store1 =    32.000) (resid 19 and name CB)
 do (store1 =     2.462) (resid 19 and name HB)
 do (store1 =    23.888) (resid 19 and name CG1)
 do (store1 =     1.524) (resid 19 and name HG11)
 do (store1 =   177.844) (resid 19 and name C)
 do (store1 =   120.148) (resid 20 and name N)
 do (store1 =     8.622) (resid 20 and name HN)
 do (store1 =    58.566) (resid 20 and name CA)
 do (store1 =     4.302) (resid 20 and name HA)
 do (store1 =    42.849) (resid 20 and name CB)
 do (store1 =     3.258) (resid 20 and name HB2)
 do (store1 =     3.030) (resid 20 and name HB1)
 do (store1 =   177.789) (resid 20 and name C)
 do (store1 =   118.297) (resid 21 and name N)
 do (store1 =     7.985) (resid 21 and name HN)
 do (store1 =    58.035) (resid 21 and name CA)
 do (store1 =     3.988) (resid 21 and name HA)
 do (store1 =    42.048) (resid 21 and name CB)
 do (store1 =     1.798) (resid 21 and name HB2)
 do (store1 =     2.022) (resid 21 and name HB1)
 do (store1 =    27.670) (resid 21 and name CG)
 do (store1 =     1.910) (resid 21 and name HG)
 do (store1 =    25.030) (resid 21 and name CD1)
 do (store1 =     0.967) (resid 21 and name HD11)
 do (store1 =   122.551) (resid 22 and name N)
 do (store1 =     8.162) (resid 22 and name HN)
 do (store1 =    55.478) (resid 22 and name CA)
 do (store1 =     4.031) (resid 22 and name HA)
 do (store1 =    17.623) (resid 22 and name CB)
 do (store1 =     1.657) (resid 22 and name HB1)
 do (store1 =   179.254) (resid 22 and name C)
 do (store1 =   120.136) (resid 23 and name N)
 do (store1 =     8.328) (resid 23 and name HN)
 do (store1 =    55.568) (resid 23 and name CA)
 do (store1 =     3.743) (resid 23 and name HA)
 do (store1 =    18.034) (resid 23 and name CB)
 do (store1 =     1.228) (resid 23 and name HB1)
 do (store1 =   178.977) (resid 23 and name C)
 do (store1 =   113.365) (resid 24 and name N)
 do (store1 =     7.981) (resid 24 and name HN)
 do (store1 =    61.578) (resid 24 and name CA)
 do (store1 =    61.726) (resid 24 and name CB)
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 do (store1 =     0.915) (resid 65 and name HD11)
 do (store1 =    25.166) (resid 65 and name CD2)
 do (store1 =     0.965) (resid 65 and name HD21)
 do (store1 =   177.383) (resid 65 and name C)
 do (store1 =   117.813) (resid 66 and name N)
 do (store1 =     7.918) (resid 66 and name HN)
 do (store1 =    55.778) (resid 66 and name CA)
 do (store1 =     4.318) (resid 66 and name HA)
 do (store1 =    29.461) (resid 66 and name CB)
 do (store1 =     2.178) (resid 66 and name HB2)
 do (store1 =     2.025) (resid 66 and name HB1)
 do (store1 =    33.869) (resid 66 and name CG)
 do (store1 =     2.386) (resid 66 and name HG1)
 do (store1 =   111.997) (resid 66 and name NE2)
 do (store1 =     6.911) (resid 66 and name HE21)
 do (store1 =     7.512) (resid 66 and name HE22)
 do (store1 =   175.767) (resid 66 and name C)
 do (store1 =   123.176) (resid 67 and name N)
 do (store1 =     8.055) (resid 67 and name HN)
 do (store1 =    52.794) (resid 67 and name CA)
 do (store1 =     4.641) (resid 67 and name HA)
 do (store1 =    41.741) (resid 67 and name CB)
 do (store1 =     1.815) (resid 67 and name HB1)
 do (store1 =    23.399) (resid 67 and name CD1)
 do (store1 =     0.889) (resid 67 and name HD11)
 do (store1 =    25.688) (resid 67 and name CD2)
 do (store1 =     0.968) (resid 67 and name HD21)
 do (store1 =    62.907) (resid 68 and name CA)
 do (store1 =     4.432) (resid 68 and name HA)
 do (store1 =    32.189) (resid 68 and name CB)
 do (store1 =     2.310) (resid 68 and name HB2)
 do (store1 =     1.888) (resid 68 and name HB1)
 do (store1 =    27.584) (resid 68 and name CG)
 do (store1 =     2.037) (resid 68 and name HG1)
 do (store1 =    50.521) (resid 68 and name CD)
 do (store1 =     3.882) (resid 68 and name HD2)
 do (store1 =     3.587) (resid 68 and name HD1)
 do (store1 =   176.447) (resid 68 and name C)
 do (store1 =   121.700) (resid 69 and name N)
 do (store1 =     8.431) (resid 69 and name HN)
 do (store1 =    56.379) (resid 69 and name CA)
 do (store1 =     4.259) (resid 69 and name HA)
 do (store1 =    33.307) (resid 69 and name CB)
 do (store1 =     1.826) (resid 69 and name HB2)
 do (store1 =     1.738) (resid 69 and name HB1)
 do (store1 =    24.824) (resid 69 and name CG)
 do (store1 =     1.501) (resid 69 and name HG1)
 do (store1 =    29.343) (resid 69 and name CD)
 do (store1 =     1.738) (resid 69 and name HD1)
 do (store1 =    42.216) (resid 69 and name CE)
 do (store1 =     3.031) (resid 69 and name HE1)
 do (store1 =   177.454) (resid 69 and name C)
 do (store1 =   110.242) (resid 70 and name N)
 do (store1 =     8.469) (resid 70 and name HN)
 do (store1 =    45.150) (resid 70 and name CA)
 do (store1 =     3.961) (resid 70 and name HA1)
 do (store1 =   173.699) (resid 70 and name C)
 do (store1 =   114.789) (resid 71 and name N)
 do (store1 =     8.172) (resid 71 and name HN)
 do (store1 =    58.084) (resid 71 and name CA)
 do (store1 =     4.489) (resid 71 and name HA)
 do (store1 =    64.002) (resid 71 and name CB)
 do (store1 =     3.844) (resid 71 and name HB1)
 do (store1 =   173.874) (resid 71 and name C)
 do (store1 =   123.748) (resid 72 and name N)
 do (store1 =     8.357) (resid 72 and name HN)
 do (store1 =    52.465) (resid 72 and name CA)
 do (store1 =     4.885) (resid 72 and name HA)
 do (store1 =    41.510) (resid 72 and name CB)
 do (store1 =     2.780) (resid 72 and name HB2)
 do (store1 =     2.562) (resid 72 and name HB1)
 do (store1 =    63.706) (resid 73 and name CA)
 do (store1 =     4.380) (resid 73 and name HA)
 do (store1 =    32.062) (resid 73 and name CB)
 do (store1 =     2.285) (resid 73 and name HB2)
 do (store1 =     1.884) (resid 73 and name HB1)
 do (store1 =    27.236) (resid 73 and name CG)
 do (store1 =     2.012) (resid 73 and name HG1)
 do (store1 =    50.927) (resid 73 and name CD)
 do (store1 =     3.908) (resid 73 and name HD2)
 do (store1 =     3.808) (resid 73 and name HD1)
 do (store1 =   176.923) (resid 73 and name C)
 do (store1 =   122.590) (resid 74 and name N)
 do (store1 =     8.453) (resid 74 and name HN)
 do (store1 =    52.803) (resid 74 and name CA)
 do (store1 =     4.223) (resid 74 and name HA)
 do (store1 =    18.809) (resid 74 and name CB)
 do (store1 =     1.282) (resid 74 and name HB1)
 do (store1 =   177.744) (resid 74 and name C)
 do (store1 =   118.403) (resid 75 and name N)
 do (store1 =     7.855) (resid 75 and name HN)
 do (store1 =    57.924) (resid 75 and name CA)
 do (store1 =     4.530) (resid 75 and name HA)
 do (store1 =    38.701) (resid 75 and name CB)
 do (store1 =     3.092) (resid 75 and name HB2)
 do (store1 =     2.977) (resid 75 and name HB1)
 do (store1 =   133.202) (resid 75 and name CD1)
 do (store1 =     7.116) (resid 75 and name HD1)
 do (store1 =   118.172) (resid 75 and name CE1)
 do (store1 =     6.815) (resid 75 and name HE1)
 do (store1 =   175.592) (resid 75 and name C)
 do (store1 =   122.265) (resid 76 and name N)
 do (store1 =     8.057) (resid 76 and name HN)
 do (store1 =    55.518) (resid 76 and name CA)
 do (store1 =     4.294) (resid 76 and name HA)
 do (store1 =    29.566) (resid 76 and name CB)
 do (store1 =     2.067) (resid 76 and name HB2)
 do (store1 =     1.930) (resid 76 and name HB1)
 do (store1 =    33.635) (resid 76 and name CG)
 do (store1 =     2.282) (resid 76 and name HG1)
 do (store1 =   112.429) (resid 76 and name NE2)
 do (store1 =     6.829) (resid 76 and name HE21)
 do (store1 =     7.531) (resid 76 and name HE22)
 do (store1 =   175.338) (resid 76 and name C)
 do (store1 =   122.786) (resid 77 and name N)
 do (store1 =     8.208) (resid 77 and name HN)
 do (store1 =    56.379) (resid 77 and name CA)
 do (store1 =     4.259) (resid 77 and name HA)
 do (store1 =    33.194) (resid 77 and name CB)
 do (store1 =     1.828) (resid 77 and name HB1)
 do (store1 =    24.626) (resid 77 and name CG)
 do (store1 =     1.433) (resid 77 and name HG1)
 do (store1 =    29.208) (resid 77 and name CD)
 do (store1 =     1.736) (resid 77 and name HD1)
 do (store1 =    42.177) (resid 77 and name CE)
 do (store1 =     3.021) (resid 77 and name HE1)
 do (store1 =   176.245) (resid 77 and name C)
 do (store1 =   121.804) (resid 78 and name N)
 do (store1 =     8.382) (resid 78 and name HN)
 do (store1 =    54.347) (resid 78 and name CA)
 do (store1 =     4.601) (resid 78 and name HA)
 do (store1 =    41.282) (resid 78 and name CB)
 do (store1 =     2.729) (resid 78 and name HB2)
 do (store1 =     2.623) (resid 78 and name HB1)
 do (store1 =   176.040) (resid 78 and name C)
 do (store1 =   121.156) (resid 79 and name N)
 do (store1 =     8.276) (resid 79 and name HN)
 do (store1 =    54.311) (resid 79 and name CA)
 do (store1 =     4.554) (resid 79 and name HA)
 do (store1 =    41.112) (resid 79 and name CB)
 do (store1 =     2.644) (resid 79 and name HB1)
 do (store1 =   176.139) (resid 79 and name C)
 do (store1 =   123.518) (resid 80 and name N)
 do (store1 =     8.145) (resid 80 and name HN)
 do (store1 =    52.831) (resid 80 and name CA)
 do (store1 =     2.852) (resid 80 and name HA)
 do (store1 =    19.341) (resid 80 and name CB)
 do (store1 =   177.787) (resid 80 and name C)
 do (store1 =   119.061) (resid 81 and name N)
 do (store1 =     7.949) (resid 81 and name HN)
 do (store1 =    62.320) (resid 81 and name CA)
 do (store1 =     4.040) (resid 81 and name HA)
 do (store1 =    32.547) (resid 81 and name CB)
 do (store1 =     2.067) (resid 81 and name HB)
 do (store1 =    21.042) (resid 81 and name CG1)
 do (store1 =     0.945) (resid 81 and name HG11)
 do (store1 =   175.979) (resid 81 and name C)
 do (store1 =   126.314) (resid 82 and name N)
 do (store1 =     8.312) (resid 82 and name HN)
 do (store1 =    56.221) (resid 82 and name CA)
 do (store1 =     4.351) (resid 82 and name HA)
 do (store1 =    32.960) (resid 82 and name CB)
 do (store1 =     1.841) (resid 82 and name HB1)
 do (store1 =    24.680) (resid 82 and name CG)
 do (store1 =     1.447) (resid 82 and name HG1)
 do (store1 =    29.110) (resid 82 and name CD)
 do (store1 =     1.722) (resid 82 and name HD1)
 do (store1 =    42.264) (resid 82 and name CE)
 do (store1 =     3.015) (resid 82 and name HE1)
 do (store1 =   175.432) (resid 82 and name C)
 do (store1 =   128.907) (resid 83 and name N)
 do (store1 =     7.993) (resid 83 and name HN)
 do (store1 =    57.681) (resid 83 and name CA)
 do (store1 =    33.748) (resid 83 and name CB)
! ############### hot_mothernoesy_072403.2 folded -
assi (attr store1 < 4.722 and attr store1 > 4.522 )
     ((attr store1 < 4.666 and attr store1 > 4.566 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 2 volume 26.4227 ppm1 4.616 ppm2 4.622
 
! ############### hot_mothernoesy_072403.7 folded -
assi (attr store1 < 4.682 and attr store1 > 4.482 )
     ((attr store1 < 4.629 and attr store1 > 4.529 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 7 volume 47.3096 ppm1 4.579 ppm2 4.582
 
! ############### hot_mothernoesy_072403.12 folded +
assi (attr store1 < 4.619 and attr store1 > 4.419 )
     ((attr store1 < 4.578 and attr store1 > 4.478 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 12 volume 70.89360 ppm1 4.528 ppm2 4.519
 
! ############### hot_mothernoesy_072403.13 folded +
assi (attr store1 < 4.365 and attr store1 > 4.165 )
     ((attr store1 < 4.41 and attr store1 > 4.31 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 13 volume 16.55140 ppm1 4.360 ppm2 4.265
 
! ############### hot_mothernoesy_072403.15 folded +
assi (attr store1 < 4.36 and attr store1 > 4.16 )
     ((attr store1 < 4.327 and attr store1 > 4.227 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 15 volume 135.92140 ppm1 4.277 ppm2 4.260
 
! ############### hot_mothernoesy_072403.16 folded +
assi (attr store1 < 4.281 and attr store1 > 4.081 )
     ((attr store1 < 4.325 and attr store1 > 4.225 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 16 volume 4.75100 ppm1 4.275 ppm2 4.181
 
! ############### hot_mothernoesy_072403.17 folded +
assi (attr store1 < 4.228 and attr store1 > 4.028 )
     ((attr store1 < 4.325 and attr store1 > 4.225 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 17 volume 3.48270 ppm1 4.275 ppm2 4.128
 
! ############### hot_mothernoesy_072403.18 folded +
assi (attr store1 < 4.461 and attr store1 > 4.261 )
     ((attr store1 < 4.314 and attr store1 > 4.214 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 18 volume 15.44560 ppm1 4.264 ppm2 4.361
 
! ############### hot_mothernoesy_072403.19 folded +
assi (attr store1 < 4.372 and attr store1 > 4.172 )
     ((attr store1 < 4.289 and attr store1 > 4.189 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 19 volume 18.51650 ppm1 4.239 ppm2 4.272
 
! ############### hot_mothernoesy_072403.21 folded +
assi (attr store1 < 4.308 and attr store1 > 4.108 )
     ((attr store1 < 4.274 and attr store1 > 4.174 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 21 volume 72.26940 ppm1 4.224 ppm2 4.208
 
! ############### hot_mothernoesy_072403.22 folded +
assi (attr store1 < 4.414 and attr store1 > 4.214 )
     ((attr store1 < 4.262 and attr store1 > 4.162 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 22 volume 5.70490 ppm1 4.212 ppm2 4.314
 
! ############### hot_mothernoesy_072403.23 folded +
assi (attr store1 < 4.376 and attr store1 > 4.176 )
     ((attr store1 < 4.246 and attr store1 > 4.146 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 23 volume 8.65480 ppm1 4.196 ppm2 4.276
 
! ############### hot_mothernoesy_072403.24 folded +
assi (attr store1 < 4.281 and attr store1 > 4.081 )
     ((attr store1 < 4.222 and attr store1 > 4.122 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 24 volume 60.39440 ppm1 4.172 ppm2 4.181
 
! ############### hot_mothernoesy_072403.26 folded +
assi (attr store1 < 4.104 and attr store1 > 3.904 )
     ((attr store1 < 4.042 and attr store1 > 3.942 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 26 volume 20.24260 ppm1 3.992 ppm2 4.004
 
! ############### hot_mothernoesy_072403.32 folded -
assi (attr store1 < 2.762 and attr store1 > 2.562 )
     ((attr store1 < 2.71 and attr store1 > 2.61 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 32 volume 142.65041 ppm1 2.660 ppm2 2.662
 
! ############### hot_mothernoesy_072403.34 folded +
assi (attr store1 < 2.189 and attr store1 > 1.989 )
     ((attr store1 < 2.428 and attr store1 > 2.328 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 34 volume 3.06290 ppm1 2.378 ppm2 2.089
 
! ############### hot_mothernoesy_072403.35 folded +
assi (attr store1 < 2.225 and attr store1 > 2.025 )
     ((attr store1 < 2.402 and attr store1 > 2.302 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 35 volume 21.56690 ppm1 2.352 ppm2 2.125
 
! ############### hot_mothernoesy_072403.36 folded -
assi (attr store1 < 2.036 and attr store1 > 1.836 )
     ((attr store1 < 2.392 and attr store1 > 2.292 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 36 volume 5.0905 ppm1 2.342 ppm2 1.936
 
! ############### hot_mothernoesy_072403.37 folded -
assi (attr store1 < 2.432 and attr store1 > 2.232 )
     ((attr store1 < 2.377 and attr store1 > 2.277 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 37 volume 17.3373 ppm1 2.327 ppm2 2.332
 
! ############### hot_mothernoesy_072403.38 folded -
assi (attr store1 < 2.158 and attr store1 > 1.958 )
     ((attr store1 < 2.372 and attr store1 > 2.272 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 38 volume 15.8125 ppm1 2.322 ppm2 2.058
 
! ############### hot_mothernoesy_072403.39 folded -
assi (attr store1 < 1.983 and attr store1 > 1.783 )
     ((attr store1 < 2.347 and attr store1 > 2.247 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 39 volume 5.8736 ppm1 2.297 ppm2 1.883
 
! ############### hot_mothernoesy_072403.40 folded -
assi (attr store1 < 1.242 and attr store1 > 1.042 )
     ((attr store1 < 2.352 and attr store1 > 2.252 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 40 volume 8.9079 ppm1 2.302 ppm2 1.142
 
! ############### hot_mothernoesy_072403.41 folded -
assi (attr store1 < 1.487 and attr store1 > 1.287 )
     ((attr store1 < 2.333 and attr store1 > 2.233 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 41 volume 6.7837 ppm1 2.283 ppm2 1.387
 
! ############### hot_mothernoesy_072403.42 folded -
assi (attr store1 < 1.054 and attr store1 > 0.854 )
     ((attr store1 < 2.337 and attr store1 > 2.237 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 42 volume 10.7644 ppm1 2.287 ppm2 0.954
 
! ############### hot_mothernoesy_072403.43 folded -
assi (attr store1 < 2.414 and attr store1 > 2.214 )
     ((attr store1 < 2.323 and attr store1 > 2.223 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 43 volume 59.5525 ppm1 2.273 ppm2 2.314
 
! ############### hot_mothernoesy_072403.44 folded +
assi (attr store1 < 2.18 and attr store1 > 1.98 )
     ((attr store1 < 2.321 and attr store1 > 2.221 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 44 volume 11.41680 ppm1 2.271 ppm2 2.080
 
! ############### hot_mothernoesy_072403.45 folded +
assi (attr store1 < 2.28 and attr store1 > 2.08 )
     ((attr store1 < 2.225 and attr store1 > 2.125 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 45 volume 18.15260 ppm1 2.175 ppm2 2.180
 
! ############### hot_mothernoesy_072403.46 folded -
assi (attr store1 < 1.058 and attr store1 > 0.858 )
     ((attr store1 < 2.172 and attr store1 > 2.072 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 46 volume 3.5778 ppm1 2.122 ppm2 0.958
 
! ############### hot_mothernoesy_072403.47 folded +
assi (attr store1 < 2.233 and attr store1 > 2.033 )
     ((attr store1 < 2.169 and attr store1 > 2.069 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 47 volume 22.43550 ppm1 2.119 ppm2 2.133
 
! ############### hot_mothernoesy_072403.48 folded +
assi (attr store1 < 2.183 and attr store1 > 1.983 )
     ((attr store1 < 2.139 and attr store1 > 2.039 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 48 volume 386.50580 ppm1 2.089 ppm2 2.083
 
! ############### hot_mothernoesy_072403.49 folded -
assi (attr store1 < 1.065 and attr store1 > 0.865 )
     ((attr store1 < 2.108 and attr store1 > 2.008 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 49 volume 10.839 ppm1 2.058 ppm2 0.965
 
! ############### hot_mothernoesy_072403.50 folded -
assi (attr store1 < 0.828 and attr store1 > 0.628 )
     ((attr store1 < 2.117 and attr store1 > 2.017 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 50 volume 6.904 ppm1 2.067 ppm2 0.728
 
! ############### hot_mothernoesy_072403.52 folded -
assi (attr store1 < 2.105 and attr store1 > 1.905 )
     ((attr store1 < 2.053 and attr store1 > 1.953 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 52 volume 121.3848 ppm1 2.003 ppm2 2.005
 
! ############### hot_mothernoesy_072403.54 folded -
assi (attr store1 < 2.0 and attr store1 > 1.8 )
     ((attr store1 < 1.952 and attr store1 > 1.852 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 54 volume 51.0466 ppm1 1.902 ppm2 1.900
 
! ############### hot_mothernoesy_072403.56 folded -
assi (attr store1 < 2.144 and attr store1 > 1.944 )
     ((attr store1 < 1.946 and attr store1 > 1.846 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 56 volume 17.0513 ppm1 1.896 ppm2 2.044
 
! ############### hot_mothernoesy_072403.57 folded -
assi (attr store1 < 2.434 and attr store1 > 2.234 )
     ((attr store1 < 1.928 and attr store1 > 1.828 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 57 volume 8.5076 ppm1 1.878 ppm2 2.334
 
! ############### hot_mothernoesy_072403.58 folded -
assi (attr store1 < 1.878 and attr store1 > 1.678 )
     ((attr store1 < 1.929 and attr store1 > 1.829 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 58 volume 38.5699 ppm1 1.879 ppm2 1.778
 
! ############### hot_mothernoesy_072403.59 folded +
assi (attr store1 < 1.956 and attr store1 > 1.756 )
     ((attr store1 < 1.918 and attr store1 > 1.818 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 59 volume 90.27820 ppm1 1.868 ppm2 1.856
 
! ############### hot_mothernoesy_072403.62 folded +
assi (attr store1 < 1.725 and attr store1 > 1.525 )
     ((attr store1 < 1.899 and attr store1 > 1.799 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 62 volume 4.14010 ppm1 1.849 ppm2 1.625
 
! ############### hot_mothernoesy_072403.63 folded -
assi (attr store1 < 1.64 and attr store1 > 1.44 )
     ((attr store1 < 1.909 and attr store1 > 1.809 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 63 volume 8.5672 ppm1 1.859 ppm2 1.540
 
! ############### hot_mothernoesy_072403.66 folded -
assi (attr store1 < 1.87 and attr store1 > 1.67 )
     ((attr store1 < 1.834 and attr store1 > 1.734 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 66 volume 92.4992 ppm1 1.784 ppm2 1.770
 
! ############### hot_mothernoesy_072403.67 folded -
assi (attr store1 < 1.955 and attr store1 > 1.755 )
     ((attr store1 < 1.809 and attr store1 > 1.709 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 67 volume 62.8894 ppm1 1.759 ppm2 1.855
 
! ############### hot_mothernoesy_072403.68 folded -
assi (attr store1 < 1.94 and attr store1 > 1.74 )
     ((attr store1 < 1.756 and attr store1 > 1.656 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 68 volume 43.0677 ppm1 1.706 ppm2 1.840
 
! ############### hot_mothernoesy_072403.70 folded +
assi (attr store1 < 1.859 and attr store1 > 1.659 )
     ((attr store1 < 1.703 and attr store1 > 1.603 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 70 volume 16.42180 ppm1 1.653 ppm2 1.759
 
! ############### hot_mothernoesy_072403.71 folded +
assi (attr store1 < 1.834 and attr store1 > 1.634 )
     ((attr store1 < 1.677 and attr store1 > 1.577 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 71 volume 8.79110 ppm1 1.627 ppm2 1.734
 
! ############### hot_mothernoesy_072403.80 folded +
assi (attr store1 < 2.418 and attr store1 > 2.218 )
     ((attr store1 < 1.528 and attr store1 > 1.428 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 80 volume 3.13460 ppm1 1.478 ppm2 2.318
 
! ############### hot_mothernoesy_072403.91 folded +
assi (attr store1 < 4.478 and attr store1 > 4.278 )
     ((attr store1 < 4.408 and attr store1 > 4.308 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 91 volume 52.71540 ppm1 4.358 ppm2 4.378
 
! ############### hot_mothernoesy_072403.92 folded -
assi (attr store1 < 4.329 and attr store1 > 4.129 )
     ((attr store1 < 4.382 and attr store1 > 4.282 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 92 volume 17.7403 ppm1 4.332 ppm2 4.229
 
! ############### hot_mothernoesy_072403.94 folded +
assi (attr store1 < 4.411 and attr store1 > 4.211 )
     ((attr store1 < 4.351 and attr store1 > 4.251 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 94 volume 76.13510 ppm1 4.301 ppm2 4.311
 
! ############### hot_mothernoesy_072403.99 folded -
assi (attr store1 < 4.102 and attr store1 > 3.902 )
     ((attr store1 < 4.133 and attr store1 > 4.033 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 99 volume 64.0913 ppm1 4.083 ppm2 4.002
 
! ############### hot_mothernoesy_072403.100 folded +
assi (attr store1 < 1.781 and attr store1 > 1.581 )
     ((attr store1 < 4.109 and attr store1 > 4.009 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 100 volume 4.34200 ppm1 4.059 ppm2 1.681
 
! ############### hot_mothernoesy_072403.101 folded -
assi (attr store1 < 4.121 and attr store1 > 3.921 )
     ((attr store1 < 4.071 and attr store1 > 3.971 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 101 volume 7.9523 ppm1 4.021 ppm2 4.021
 
! ############### hot_mothernoesy_072403.102 folded +
assi (attr store1 < 4.875 and attr store1 > 4.675 )
     ((attr store1 < 3.965 and attr store1 > 3.865 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 102 volume 10.53360 ppm1 3.915 ppm2 4.775
 
! ############### hot_mothernoesy_072403.104 folded +
assi (attr store1 < 4.018 and attr store1 > 3.818 )
     ((attr store1 < 3.966 and attr store1 > 3.866 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 104 volume 296.70520 ppm1 3.916 ppm2 3.918
 
! ############### hot_mothernoesy_072403.106 folded +
assi (attr store1 < 4.023 and attr store1 > 3.823 )
     ((attr store1 < 3.9 and attr store1 > 3.8 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 106 volume 4.25250 ppm1 3.850 ppm2 3.923
 
! ############### hot_mothernoesy_072403.114 folded -
assi (attr store1 < 3.165 and attr store1 > 2.965 )
     ((attr store1 < 3.074 and attr store1 > 2.974 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 114 volume 16.4603 ppm1 3.024 ppm2 3.065
 
! ############### hot_mothernoesy_072403.115 folded -
assi (attr store1 < 3.085 and attr store1 > 2.885 )
     ((attr store1 < 3.078 and attr store1 > 2.978 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 115 volume 6.2457 ppm1 3.028 ppm2 2.985
 
! ############### hot_mothernoesy_072403.116 folded -
assi (attr store1 < 3.125 and attr store1 > 2.925 )
     ((attr store1 < 3.049 and attr store1 > 2.949 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 116 volume 18.4007 ppm1 2.999 ppm2 3.025
 
! ############### hot_mothernoesy_072403.117 folded -
assi (attr store1 < 3.083 and attr store1 > 2.883 )
     ((attr store1 < 3.033 and attr store1 > 2.933 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 117 volume 28.5232 ppm1 2.983 ppm2 2.983
 
! ############### hot_mothernoesy_072403.118 folded -
assi (attr store1 < 3.037 and attr store1 > 2.837 )
     ((attr store1 < 2.986 and attr store1 > 2.886 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 118 volume 21.9857 ppm1 2.936 ppm2 2.937
 
! ############### hot_mothernoesy_072403.119 folded +
assi (attr store1 < 2.995 and attr store1 > 2.795 )
     ((attr store1 < 2.972 and attr store1 > 2.872 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 119 volume 4.36620 ppm1 2.922 ppm2 2.895
 
! ############### hot_mothernoesy_072403.120 folded +
assi (attr store1 < 1.569 and attr store1 > 1.369 )
     ((attr store1 < 2.97 and attr store1 > 2.87 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 120 volume 7.81900 ppm1 2.920 ppm2 1.469
 
! ############### hot_mothernoesy_072403.122 folded -
assi (attr store1 < 2.864 and attr store1 > 2.664 )
     ((attr store1 < 2.826 and attr store1 > 2.726 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 122 volume 5.6582 ppm1 2.776 ppm2 2.764
 
! ############### hot_mothernoesy_072403.123 folded -
assi (attr store1 < 2.856 and attr store1 > 2.656 )
     ((attr store1 < 2.805 and attr store1 > 2.705 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 123 volume 6.3549 ppm1 2.755 ppm2 2.756
 
! ############### hot_mothernoesy_072403.124 folded -
assi (attr store1 < 2.09 and attr store1 > 1.89 )
     ((attr store1 < 2.497 and attr store1 > 2.397 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 124 volume 6.3434 ppm1 2.447 ppm2 1.990
 
! ############### hot_mothernoesy_072403.125 folded -
assi (attr store1 < 2.261 and attr store1 > 2.061 )
     ((attr store1 < 2.472 and attr store1 > 2.372 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 125 volume 32.6727 ppm1 2.422 ppm2 2.161
 
! ############### hot_mothernoesy_072403.126 folded -
assi (attr store1 < 2.326 and attr store1 > 2.126 )
     ((attr store1 < 2.451 and attr store1 > 2.351 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 126 volume 29.7387 ppm1 2.401 ppm2 2.226
 
! ############### hot_mothernoesy_072403.127 folded -
assi (attr store1 < 2.205 and attr store1 > 2.005 )
     ((attr store1 < 2.347 and attr store1 > 2.247 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 127 volume 52.3111 ppm1 2.297 ppm2 2.105
 
! ############### hot_mothernoesy_072403.128 folded -
assi (attr store1 < 2.075 and attr store1 > 1.875 )
     ((attr store1 < 2.353 and attr store1 > 2.253 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 128 volume 46.5884 ppm1 2.303 ppm2 1.975
 
! ############### hot_mothernoesy_072403.129 folded -
assi (attr store1 < 2.525 and attr store1 > 2.325 )
     ((attr store1 < 2.334 and attr store1 > 2.234 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 129 volume 56.9943 ppm1 2.284 ppm2 2.425
 
! ############### hot_mothernoesy_072403.135 folded -
assi (attr store1 < 2.219 and attr store1 > 2.019 )
     ((attr store1 < 2.113 and attr store1 > 2.013 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 135 volume 11.9195 ppm1 2.063 ppm2 2.119
 
! ############### hot_mothernoesy_072403.139 folded +
assi (attr store1 < 4.017 and attr store1 > 3.817 )
     ((attr store1 < 2.045 and attr store1 > 1.945 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 139 volume 12.78650 ppm1 1.995 ppm2 3.917
 
! ############### hot_mothernoesy_072403.149 folded -
assi (attr store1 < 2.4 and attr store1 > 2.2 )
     ((attr store1 < 1.991 and attr store1 > 1.891 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 149 volume 7.4626 ppm1 1.941 ppm2 2.300
 
! ############### hot_mothernoesy_072403.153 folded -
assi (attr store1 < 1.905 and attr store1 > 1.705 )
     ((attr store1 < 1.944 and attr store1 > 1.844 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 153 volume 67.4891 ppm1 1.894 ppm2 1.805
 
! ############### hot_mothernoesy_072403.154 folded -
assi (attr store1 < 1.848 and attr store1 > 1.648 )
     ((attr store1 < 1.931 and attr store1 > 1.831 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 154 volume 67.1654 ppm1 1.881 ppm2 1.748
 
! ############### hot_mothernoesy_072403.155 folded -
assi (attr store1 < 2.347 and attr store1 > 2.147 )
     ((attr store1 < 1.914 and attr store1 > 1.814 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 155 volume 6.7019 ppm1 1.864 ppm2 2.247
 
! ############### hot_mothernoesy_072403.156 folded -
assi (attr store1 < 2.314 and attr store1 > 2.114 )
     ((attr store1 < 1.868 and attr store1 > 1.768 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 156 volume 3.131 ppm1 1.818 ppm2 2.214
 
! ############### hot_mothernoesy_072403.158 folded -
assi (attr store1 < 1.62 and attr store1 > 1.42 )
     ((attr store1 < 1.787 and attr store1 > 1.687 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 158 volume 5.6895 ppm1 1.737 ppm2 1.520
 
! ############### hot_mothernoesy_072403.160 folded -
assi (attr store1 < 1.925 and attr store1 > 1.725 )
     ((attr store1 < 1.779 and attr store1 > 1.679 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 160 volume 69.4452 ppm1 1.729 ppm2 1.825
 
! ############### hot_mothernoesy_072403.161 folded -
assi (attr store1 < 1.892 and attr store1 > 1.692 )
     ((attr store1 < 1.759 and attr store1 > 1.659 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 161 volume 25.4483 ppm1 1.709 ppm2 1.792
 
! ############### hot_mothernoesy_072403.162 folded +
assi (attr store1 < 1.73 and attr store1 > 1.53 )
     ((attr store1 < 1.72 and attr store1 > 1.62 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 162 volume 3.50770 ppm1 1.670 ppm2 1.630
 
! ############### hot_mothernoesy_072403.164 folded -
assi (attr store1 < 1.593 and attr store1 > 1.393 )
     ((attr store1 < 1.554 and attr store1 > 1.454 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 164 volume 5.8435 ppm1 1.504 ppm2 1.493
 
! ############### hot_mothernoesy_072403.165 folded -
assi (attr store1 < 1.593 and attr store1 > 1.393 )
     ((attr store1 < 1.528 and attr store1 > 1.428 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 165 volume 4.9534 ppm1 1.478 ppm2 1.493
 
! ############### hot_mothernoesy_072403.167 folded -
assi (attr store1 < 1.532 and attr store1 > 1.332 )
     ((attr store1 < 1.481 and attr store1 > 1.381 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 167 volume 18.3885 ppm1 1.431 ppm2 1.432
 
! ############### hot_mothernoesy_072403.170 folded -
assi (attr store1 < 1.516 and attr store1 > 1.316 )
     ((attr store1 < 1.467 and attr store1 > 1.367 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 170 volume 26.1527 ppm1 1.417 ppm2 1.416
 
! ############### hot_mothernoesy_072403.172 folded +
assi (attr store1 < 1.481 and attr store1 > 1.281 )
     ((attr store1 < 1.437 and attr store1 > 1.337 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 172 volume 7.10190 ppm1 1.387 ppm2 1.381
 
! ############### hot_mothernoesy_072403.173 folded +
assi (attr store1 < 1.429 and attr store1 > 1.229 )
     ((attr store1 < 1.38 and attr store1 > 1.28 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 173 volume 4.62140 ppm1 1.330 ppm2 1.329
 
! ############### hot_mothernoesy_072403.174 folded -
assi (attr store1 < 1.372 and attr store1 > 1.172 )
     ((attr store1 < 1.344 and attr store1 > 1.244 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 174 volume 3.0475 ppm1 1.294 ppm2 1.272
 
! ############### hot_mothernoesy_072403.178 folded -
assi (attr store1 < 1.08 and attr store1 > 0.88 )
     ((attr store1 < 1.03 and attr store1 > 0.93 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 178 volume 8.6418 ppm1 0.980 ppm2 0.980
 
! ############### hot_mothernoesy_072403.179 folded -
assi (attr store1 < 1.05 and attr store1 > 0.85 )
     ((attr store1 < 0.995 and attr store1 > 0.895 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 179 volume 8.729 ppm1 0.945 ppm2 0.950
 
! ############### hot_mothernoesy_072403.180 folded +
assi (attr store1 < 0.996 and attr store1 > 0.796 )
     ((attr store1 < 0.953 and attr store1 > 0.853 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 180 volume 29.31230 ppm1 0.903 ppm2 0.896
 
! ############### hot_mothernoesy_072403.181 folded -
assi (attr store1 < 0.903 and attr store1 > 0.703 )
     ((attr store1 < 0.855 and attr store1 > 0.755 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 181 volume 10.0625 ppm1 0.805 ppm2 0.803
 
! ############### hot_mothernoesy_072403.182 folded -
assi (attr store1 < 1.452 and attr store1 > 1.252 )
     ((attr store1 < 4.022 and attr store1 > 3.922 ) and 
      (bondedto (attr store1 < 151.007810435  and attr store1 > 149.807810435 ) or 
       bondedto (attr store1 < 55.5280631883  and attr store1 > 54.3280631883 ))) 
6 0.1 0.1 peak 182 volume 12.1326 ppm1 3.972 ppm2 1.352
 
! ############### hot_mothernoesy_072403.183 folded -
assi (attr store1 < 4.072 and attr store1 > 3.872 )
     ((attr store1 < 4.018 and attr store1 > 3.918 ) and 
      (bondedto (attr store1 < 151.034810435  and attr store1 > 149.834810435 ) or 
       bondedto (attr store1 < 55.5550631883  and attr store1 > 54.3550631883 ))) 
6 0.1 0.1 peak 183 volume 24.597 ppm1 3.968 ppm2 3.972
 
! ############### hot_mothernoesy_072403.184 folded -
assi (attr store1 < 1.047 and attr store1 > 0.847 )
     ((attr store1 < 4.021 and attr store1 > 3.921 ) and 
      (bondedto (attr store1 < 151.019810435  and attr store1 > 149.819810435 ) or 
       bondedto (attr store1 < 55.5400631883  and attr store1 > 54.3400631883 ))) 
6 0.1 0.1 peak 184 volume 7.0379 ppm1 3.971 ppm2 0.947
 
! ############### hot_mothernoesy_072403.185 folded -
assi (attr store1 < 1.974 and attr store1 > 1.774 )
     ((attr store1 < 4.024 and attr store1 > 3.924 ) and 
      (bondedto (attr store1 < 150.983810435  and attr store1 > 149.783810435 ) or 
       bondedto (attr store1 < 55.5040631883  and attr store1 > 54.3040631883 ))) 
6 0.1 0.1 peak 185 volume 4.429 ppm1 3.974 ppm2 1.874
 
! ############### hot_mothernoesy_072403.186 folded -
assi (attr store1 < 3.286 and attr store1 > 3.086 )
     ((attr store1 < 4.366 and attr store1 > 4.266 ) and 
      (bondedto (attr store1 < 150.661810435  and attr store1 > 149.461810435 ) or 
       bondedto (attr store1 < 55.1820631883  and attr store1 > 53.9820631883 ))) 
6 0.1 0.1 peak 186 volume 11.2725 ppm1 4.316 ppm2 3.186
 
! ############### hot_mothernoesy_072403.187 folded -
assi (attr store1 < 2.921 and attr store1 > 2.721 )
     ((attr store1 < 4.368 and attr store1 > 4.268 ) and 
      (bondedto (attr store1 < 150.635810435  and attr store1 > 149.435810435 ) or 
       bondedto (attr store1 < 55.1560631883  and attr store1 > 53.9560631883 ))) 
6 0.1 0.1 peak 187 volume 9.6944 ppm1 4.318 ppm2 2.821
 
! ############### hot_mothernoesy_072403.188 folded -
assi (attr store1 < 4.073 and attr store1 > 3.873 )
     ((attr store1 < 1.997 and attr store1 > 1.897 ) and 
      (bondedto (attr store1 < 150.676810435  and attr store1 > 149.476810435 ) or 
       bondedto (attr store1 < 55.1970631883  and attr store1 > 53.9970631883 ))) 
6 0.1 0.1 peak 188 volume 5.203 ppm1 1.947 ppm2 3.973
 
! ############### hot_mothernoesy_072403.189 folded -
assi (attr store1 < 3.31 and attr store1 > 3.11 )
     ((attr store1 < 1.999 and attr store1 > 1.899 ) and 
      (bondedto (attr store1 < 150.715810435  and attr store1 > 149.515810435 ) or 
       bondedto (attr store1 < 55.2360631883  and attr store1 > 54.0360631883 ))) 
6 0.1 0.1 peak 189 volume 11.1812 ppm1 1.949 ppm2 3.210
 
! ############### hot_mothernoesy_072403.190 folded -
assi (attr store1 < 4.729 and attr store1 > 4.529 )
     ((attr store1 < 4.666 and attr store1 > 4.566 ) and 
      (bondedto (attr store1 < 150.558810435  and attr store1 > 149.358810435 ) or 
       bondedto (attr store1 < 55.0790631883  and attr store1 > 53.8790631883 ))) 
6 0.1 0.1 peak 190 volume 497.7485 ppm1 4.616 ppm2 4.629
 
! ############### hot_mothernoesy_072403.191 folded -
assi (attr store1 < 4.283 and attr store1 > 4.083 )
     ((attr store1 < 4.233 and attr store1 > 4.133 ) and 
      (bondedto (attr store1 < 150.560810435  and attr store1 > 149.360810435 ) or 
       bondedto (attr store1 < 55.0810631883  and attr store1 > 53.8810631883 ))) 
6 0.1 0.1 peak 191 volume 21.2027 ppm1 4.183 ppm2 4.183
 
! ############### hot_mothernoesy_072403.193 folded -
assi (attr store1 < 1.527 and attr store1 > 1.327 )
     ((attr store1 < 4.221 and attr store1 > 4.121 ) and 
      (bondedto (attr store1 < 150.582810435  and attr store1 > 149.382810435 ) or 
       bondedto (attr store1 < 55.1030631883  and attr store1 > 53.9030631883 ))) 
6 0.1 0.1 peak 193 volume 3.5197 ppm1 4.171 ppm2 1.427
 
! ############### hot_mothernoesy_072403.195 folded -
assi (attr store1 < 4.27 and attr store1 > 4.07 )
     ((attr store1 < 4.213 and attr store1 > 4.113 ) and 
      (bondedto (attr store1 < 150.603810435  and attr store1 > 149.403810435 ) or 
       bondedto (attr store1 < 55.1240631883  and attr store1 > 53.9240631883 ))) 
6 0.1 0.1 peak 195 volume 22.1545 ppm1 4.163 ppm2 4.170
 
! ############### hot_mothernoesy_072403.197 folded -
assi (attr store1 < 2.044 and attr store1 > 1.844 )
     ((attr store1 < 1.994 and attr store1 > 1.894 ) and 
      (bondedto (attr store1 < 150.603810435  and attr store1 > 149.403810435 ) or 
       bondedto (attr store1 < 55.1240631883  and attr store1 > 53.9240631883 ))) 
6 0.1 0.1 peak 197 volume 53.5784 ppm1 1.944 ppm2 1.944
 
! ############### hot_mothernoesy_072403.198 folded +
assi (attr store1 < 1.118 and attr store1 > 0.918 )
     ((attr store1 < 1.574 and attr store1 > 1.474 ) and 
      (bondedto (attr store1 < 126.609873623  and attr store1 > 125.409873623 ) or 
       bondedto (attr store1 < 78.87  and attr store1 > 77.67 ) or 
       bondedto (attr store1 < 31.1301263766  and attr store1 > 29.9301263766 ))) 
6 0.1 0.1 peak 198 volume 6.98920 ppm1 1.524 ppm2 1.018
 
! ############### hot_mothernoesy_072403.199 folded +
assi (attr store1 < 1.625 and attr store1 > 1.425 )
     ((attr store1 < 1.559 and attr store1 > 1.459 ) and 
      (bondedto (attr store1 < 126.586873623  and attr store1 > 125.386873623 ) or 
       bondedto (attr store1 < 78.847  and attr store1 > 77.647 ) or 
       bondedto (attr store1 < 31.1071263766  and attr store1 > 29.9071263766 ))) 
6 0.1 0.1 peak 199 volume 13.81740 ppm1 1.509 ppm2 1.525
 
! ############### hot_mothernoesy_072403.200 folded +
assi (attr store1 < 1.121 and attr store1 > 0.921 )
     ((attr store1 < 1.533 and attr store1 > 1.433 ) and 
      (bondedto (attr store1 < 126.619873623  and attr store1 > 125.419873623 ) or 
       bondedto (attr store1 < 78.88  and attr store1 > 77.68 ) or 
       bondedto (attr store1 < 31.1401263766  and attr store1 > 29.9401263766 ))) 
6 0.1 0.1 peak 200 volume 7.63920 ppm1 1.483 ppm2 1.021
 
! ############### hot_mothernoesy_072403.201 folded +
assi (attr store1 < 1.118 and attr store1 > 0.918 )
     ((attr store1 < 1.511 and attr store1 > 1.411 ) and 
      (bondedto (attr store1 < 126.601873623  and attr store1 > 125.401873623 ) or 
       bondedto (attr store1 < 78.862  and attr store1 > 77.662 ) or 
       bondedto (attr store1 < 31.1221263766  and attr store1 > 29.9221263766 ))) 
6 0.1 0.1 peak 201 volume 8.96870 ppm1 1.461 ppm2 1.018
 
! ############### hot_mothernoesy_072403.202 folded +
assi (attr store1 < 1.104 and attr store1 > 0.904 )
     ((attr store1 < 1.494 and attr store1 > 1.394 ) and 
      (bondedto (attr store1 < 126.598873623  and attr store1 > 125.398873623 ) or 
       bondedto (attr store1 < 78.859  and attr store1 > 77.659 ) or 
       bondedto (attr store1 < 31.1191263766  and attr store1 > 29.9191263766 ))) 
6 0.1 0.1 peak 202 volume 8.62110 ppm1 1.444 ppm2 1.004
 
! ############### hot_mothernoesy_072403.203 folded -
assi (attr store1 < 4.681 and attr store1 > 4.481 )
     ((attr store1 < 4.63 and attr store1 > 4.53 ) and 
      (bondedto (attr store1 < 150.516810435  and attr store1 > 149.316810435 ) or 
       bondedto (attr store1 < 55.0370631883  and attr store1 > 53.8370631883 ))) 
6 0.1 0.1 peak 203 volume 851.70172 ppm1 4.580 ppm2 4.581
 
! ############### hot_mothernoesy_072403.204 folded -
assi (attr store1 < 2.774 and attr store1 > 2.574 )
     ((attr store1 < 4.63 and attr store1 > 4.53 ) and 
      (bondedto (attr store1 < 150.522810435  and attr store1 > 149.322810435 ) or 
       bondedto (attr store1 < 55.0430631883  and attr store1 > 53.8430631883 ))) 
6 0.1 0.1 peak 204 volume 20.5965 ppm1 4.580 ppm2 2.674
 
! ############### hot_mothernoesy_072403.205 folded -
assi (attr store1 < 4.876 and attr store1 > 4.676 )
     ((attr store1 < 2.082 and attr store1 > 1.982 ) and 
      (bondedto (attr store1 < 150.511810435  and attr store1 > 149.311810435 ) or 
       bondedto (attr store1 < 55.0320631883  and attr store1 > 53.8320631883 ))) 
6 0.1 0.1 peak 205 volume 4.1507 ppm1 2.032 ppm2 4.776
 
! ############### hot_mothernoesy_072403.206 folded -
assi (attr store1 < 2.409 and attr store1 > 2.209 )
     ((attr store1 < 2.125 and attr store1 > 2.025 ) and 
      (bondedto (attr store1 < 150.421810435  and attr store1 > 149.221810435 ) or 
       bondedto (attr store1 < 54.9420631883  and attr store1 > 53.7420631883 ))) 
6 0.1 0.1 peak 206 volume 20.7694 ppm1 2.075 ppm2 2.309
 
! ############### hot_mothernoesy_072403.207 folded -
assi (attr store1 < 2.412 and attr store1 > 2.212 )
     ((attr store1 < 2.105 and attr store1 > 2.005 ) and 
      (bondedto (attr store1 < 150.440810435  and attr store1 > 149.240810435 ) or 
       bondedto (attr store1 < 54.9610631883  and attr store1 > 53.7610631883 ))) 
6 0.1 0.1 peak 207 volume 19.1095 ppm1 2.055 ppm2 2.312
 
! ############### hot_mothernoesy_072403.208 folded -
assi (attr store1 < 2.146 and attr store1 > 1.946 )
     ((attr store1 < 2.093 and attr store1 > 1.993 ) and 
      (bondedto (attr store1 < 150.370810435  and attr store1 > 149.170810435 ) or 
       bondedto (attr store1 < 54.8910631883  and attr store1 > 53.6910631883 ))) 
6 0.1 0.1 peak 208 volume 97.0153 ppm1 2.043 ppm2 2.046
 
! ############### hot_mothernoesy_072403.209 folded -
assi (attr store1 < 2.402 and attr store1 > 2.202 )
     ((attr store1 < 1.991 and attr store1 > 1.891 ) and 
      (bondedto (attr store1 < 150.387810435  and attr store1 > 149.187810435 ) or 
       bondedto (attr store1 < 54.9080631883  and attr store1 > 53.7080631883 ))) 
6 0.1 0.1 peak 209 volume 26.5129 ppm1 1.941 ppm2 2.302
 
! ############### hot_mothernoesy_072403.210 folded -
assi (attr store1 < 2.055 and attr store1 > 1.855 )
     ((attr store1 < 2.134 and attr store1 > 2.034 ) and 
      (bondedto (attr store1 < 150.274810435  and attr store1 > 149.074810435 ) or 
       bondedto (attr store1 < 54.7950631883  and attr store1 > 53.5950631883 ))) 
6 0.1 0.1 peak 210 volume 36.3345 ppm1 2.084 ppm2 1.955
 
! ############### hot_mothernoesy_072403.211 folded -
assi (attr store1 < 2.184 and attr store1 > 1.984 )
     ((attr store1 < 2.122 and attr store1 > 2.022 ) and 
      (bondedto (attr store1 < 150.286810435  and attr store1 > 149.086810435 ) or 
       bondedto (attr store1 < 54.8070631883  and attr store1 > 53.6070631883 ))) 
6 0.1 0.1 peak 211 volume 109.1764 ppm1 2.072 ppm2 2.084
 
! ############### hot_mothernoesy_072403.212 folded -
assi (attr store1 < 2.182 and attr store1 > 1.982 )
     ((attr store1 < 1.996 and attr store1 > 1.896 ) and 
      (bondedto (attr store1 < 150.309810435  and attr store1 > 149.109810435 ) or 
       bondedto (attr store1 < 54.8300631883  and attr store1 > 53.6300631883 ))) 
6 0.1 0.1 peak 212 volume 32.9967 ppm1 1.946 ppm2 2.082
 
! ############### hot_mothernoesy_072403.213 folded -
assi (attr store1 < 3.431 and attr store1 > 3.231 )
     ((attr store1 < 4.666 and attr store1 > 4.566 ) and 
      (bondedto (attr store1 < 150.088810435  and attr store1 > 148.888810435 ) or 
       bondedto (attr store1 < 54.6090631883  and attr store1 > 53.4090631883 ))) 
6 0.1 0.1 peak 213 volume 3.8396 ppm1 4.616 ppm2 3.331
 
! ############### hot_mothernoesy_072403.214 folded -
assi (attr store1 < 3.433 and attr store1 > 3.233 )
     ((attr store1 < 4.587 and attr store1 > 4.487 ) and 
      (bondedto (attr store1 < 150.073810435  and attr store1 > 148.873810435 ) or 
       bondedto (attr store1 < 54.5940631883  and attr store1 > 53.3940631883 ))) 
6 0.1 0.1 peak 214 volume 3.44 ppm1 4.537 ppm2 3.333
 
! ############### hot_mothernoesy_072403.215 folded -
assi (attr store1 < 2.523 and attr store1 > 2.323 )
     ((attr store1 < 2.086 and attr store1 > 1.986 ) and 
      (bondedto (attr store1 < 150.120810435  and attr store1 > 148.920810435 ) or 
       bondedto (attr store1 < 54.6410631883  and attr store1 > 53.4410631883 ))) 
6 0.1 0.1 peak 215 volume 8.9366 ppm1 2.036 ppm2 2.423
 
! ############### hot_mothernoesy_072403.216 folded -
assi (attr store1 < 1.356 and attr store1 > 1.156 )
     ((attr store1 < 1.418 and attr store1 > 1.318 ) and 
      (bondedto (attr store1 < 150.135810435  and attr store1 > 148.935810435 ) or 
       bondedto (attr store1 < 54.6560631883  and attr store1 > 53.4560631883 ))) 
6 0.1 0.1 peak 216 volume 9.7405 ppm1 1.368 ppm2 1.256
 
! ############### hot_mothernoesy_072403.217 folded -
assi (attr store1 < 1.465 and attr store1 > 1.265 )
     ((attr store1 < 1.412 and attr store1 > 1.312 ) and 
      (bondedto (attr store1 < 150.133810435  and attr store1 > 148.933810435 ) or 
       bondedto (attr store1 < 54.6540631883  and attr store1 > 53.4540631883 ))) 
6 0.1 0.1 peak 217 volume 5.8219 ppm1 1.362 ppm2 1.365
 
! ############### hot_mothernoesy_072403.218 folded -
assi (attr store1 < 1.467 and attr store1 > 1.267 )
     ((attr store1 < 1.307 and attr store1 > 1.207 ) and 
      (bondedto (attr store1 < 150.131810435  and attr store1 > 148.931810435 ) or 
       bondedto (attr store1 < 54.6520631883  and attr store1 > 53.4520631883 ))) 
6 0.1 0.1 peak 218 volume 10.3493 ppm1 1.257 ppm2 1.367
 
! ############### hot_mothernoesy_072403.219 folded -
assi (attr store1 < 1.347 and attr store1 > 1.147 )
     ((attr store1 < 1.31 and attr store1 > 1.21 ) and 
      (bondedto (attr store1 < 150.092810435  and attr store1 > 148.892810435 ) or 
       bondedto (attr store1 < 54.6130631883  and attr store1 > 53.4130631883 ))) 
6 0.1 0.1 peak 219 volume 10.0265 ppm1 1.260 ppm2 1.247
 
! ############### hot_mothernoesy_072403.220 folded +
assi (attr store1 < 1.838 and attr store1 > 1.638 )
     ((attr store1 < 2.016 and attr store1 > 1.916 ) and 
      (bondedto (attr store1 < 126.139873623  and attr store1 > 124.939873623 ) or 
       bondedto (attr store1 < 78.4  and attr store1 > 77.2 ) or 
       bondedto (attr store1 < 30.6601263766  and attr store1 > 29.4601263766 ))) 
6 0.1 0.1 peak 220 volume 13.24630 ppm1 1.966 ppm2 1.738
 
! ############### hot_mothernoesy_072403.221 folded -
assi (attr store1 < 4.638 and attr store1 > 4.438 )
     ((attr store1 < 4.587 and attr store1 > 4.487 ) and 
      (bondedto (attr store1 < 150.028810435  and attr store1 > 148.828810435 ) or 
       bondedto (attr store1 < 54.5490631883  and attr store1 > 53.3490631883 ))) 
6 0.1 0.1 peak 221 volume 362.3735 ppm1 4.537 ppm2 4.538
 
! ############### hot_mothernoesy_072403.222 folded -
assi (attr store1 < 2.749 and attr store1 > 2.549 )
     ((attr store1 < 4.59 and attr store1 > 4.49 ) and 
      (bondedto (attr store1 < 150.024810435  and attr store1 > 148.824810435 ) or 
       bondedto (attr store1 < 54.5450631883  and attr store1 > 53.3450631883 ))) 
6 0.1 0.1 peak 222 volume 15.6362 ppm1 4.540 ppm2 2.649
 
! ############### hot_mothernoesy_072403.223 folded -
assi (attr store1 < 2.61 and attr store1 > 2.41 )
     ((attr store1 < 4.586 and attr store1 > 4.486 ) and 
      (bondedto (attr store1 < 150.029810435  and attr store1 > 148.829810435 ) or 
       bondedto (attr store1 < 54.5500631883  and attr store1 > 53.3500631883 ))) 
6 0.1 0.1 peak 223 volume 15.7861 ppm1 4.536 ppm2 2.510
 
! ############### hot_mothernoesy_072403.224 folded +
assi (attr store1 < 4.285 and attr store1 > 4.085 )
     ((attr store1 < 4.324 and attr store1 > 4.224 ) and 
      (bondedto (attr store1 < 126.085873623  and attr store1 > 124.885873623 ) or 
       bondedto (attr store1 < 78.346  and attr store1 > 77.146 ) or 
       bondedto (attr store1 < 30.6061263766  and attr store1 > 29.4061263766 ))) 
6 0.1 0.1 peak 224 volume 7.26840 ppm1 4.274 ppm2 4.185
 
! ############### hot_mothernoesy_072403.225 folded +
assi (attr store1 < 3.776 and attr store1 > 3.576 )
     ((attr store1 < 2.195 and attr store1 > 2.095 ) and 
      (bondedto (attr store1 < 126.021873623  and attr store1 > 124.821873623 ) or 
       bondedto (attr store1 < 78.282  and attr store1 > 77.082 ) or 
       bondedto (attr store1 < 30.5421263766  and attr store1 > 29.3421263766 ))) 
6 0.1 0.1 peak 225 volume 6.46900 ppm1 2.145 ppm2 3.676
 
! ############### hot_mothernoesy_072403.226 folded +
assi (attr store1 < 3.313 and attr store1 > 3.113 )
     ((attr store1 < 2.009 and attr store1 > 1.909 ) and 
      (bondedto (attr store1 < 126.063873623  and attr store1 > 124.863873623 ) or 
       bondedto (attr store1 < 78.324  and attr store1 > 77.124 ) or 
       bondedto (attr store1 < 30.5841263766  and attr store1 > 29.3841263766 ))) 
6 0.1 0.1 peak 226 volume 11.13500 ppm1 1.959 ppm2 3.213
 
! ############### hot_mothernoesy_072403.227 folded +
assi (attr store1 < 4.004 and attr store1 > 3.804 )
     ((attr store1 < 2.0 and attr store1 > 1.9 ) and 
      (bondedto (attr store1 < 126.060873623  and attr store1 > 124.860873623 ) or 
       bondedto (attr store1 < 78.321  and attr store1 > 77.121 ) or 
       bondedto (attr store1 < 30.5811263766  and attr store1 > 29.3811263766 ))) 
6 0.1 0.1 peak 227 volume 12.62400 ppm1 1.950 ppm2 3.904
 
! ############### hot_mothernoesy_072403.228 folded +
assi (attr store1 < 4.068 and attr store1 > 3.868 )
     ((attr store1 < 1.986 and attr store1 > 1.886 ) and 
      (bondedto (attr store1 < 126.090873623  and attr store1 > 124.890873623 ) or 
       bondedto (attr store1 < 78.351  and attr store1 > 77.151 ) or 
       bondedto (attr store1 < 30.6111263766  and attr store1 > 29.4111263766 ))) 
6 0.1 0.1 peak 228 volume 17.58480 ppm1 1.936 ppm2 3.968
 
! ############### hot_mothernoesy_072403.229 folded +
assi (attr store1 < 3.314 and attr store1 > 3.114 )
     ((attr store1 < 1.981 and attr store1 > 1.881 ) and 
      (bondedto (attr store1 < 126.059873623  and attr store1 > 124.859873623 ) or 
       bondedto (attr store1 < 78.32  and attr store1 > 77.12 ) or 
       bondedto (attr store1 < 30.5801263766  and attr store1 > 29.3801263766 ))) 
6 0.1 0.1 peak 229 volume 13.80540 ppm1 1.931 ppm2 3.214
 
! ############### hot_mothernoesy_072403.230 folded +
assi (attr store1 < 1.699 and attr store1 > 1.499 )
     ((attr store1 < 1.988 and attr store1 > 1.888 ) and 
      (bondedto (attr store1 < 126.084873623  and attr store1 > 124.884873623 ) or 
       bondedto (attr store1 < 78.345  and attr store1 > 77.145 ) or 
       bondedto (attr store1 < 30.6051263766  and attr store1 > 29.4051263766 ))) 
6 0.1 0.1 peak 230 volume 14.17800 ppm1 1.938 ppm2 1.599
 
! ############### hot_mothernoesy_072403.231 folded +
assi (attr store1 < 1.491 and attr store1 > 1.291 )
     ((attr store1 < 4.335 and attr store1 > 4.235 ) and 
      (bondedto (attr store1 < 125.989873623  and attr store1 > 124.789873623 ) or 
       bondedto (attr store1 < 78.25  and attr store1 > 77.05 ) or 
       bondedto (attr store1 < 30.5101263766  and attr store1 > 29.3101263766 ))) 
6 0.1 0.1 peak 231 volume 6.47570 ppm1 4.285 ppm2 1.391
 
! ############### hot_mothernoesy_072403.232 folded +
assi (attr store1 < 4.363 and attr store1 > 4.163 )
     ((attr store1 < 4.328 and attr store1 > 4.228 ) and 
      (bondedto (attr store1 < 125.959873623  and attr store1 > 124.759873623 ) or 
       bondedto (attr store1 < 78.22  and attr store1 > 77.02 ) or 
       bondedto (attr store1 < 30.4801263766  and attr store1 > 29.2801263766 ))) 
6 0.1 0.1 peak 232 volume 70.81830 ppm1 4.278 ppm2 4.263
 
! ############### hot_mothernoesy_072403.233 folded +
assi (attr store1 < 3.775 and attr store1 > 3.575 )
     ((attr store1 < 2.112 and attr store1 > 2.012 ) and 
      (bondedto (attr store1 < 125.999873623  and attr store1 > 124.799873623 ) or 
       bondedto (attr store1 < 78.26  and attr store1 > 77.06 ) or 
       bondedto (attr store1 < 30.5201263766  and attr store1 > 29.3201263766 ))) 
6 0.1 0.1 peak 233 volume 6.41110 ppm1 2.062 ppm2 3.675
 
! ############### hot_mothernoesy_072403.234 folded -
assi (attr store1 < 4.7 and attr store1 > 4.5 )
     ((attr store1 < 4.649 and attr store1 > 4.549 ) and 
      (bondedto (attr store1 < 149.830810435  and attr store1 > 148.630810435 ) or 
       bondedto (attr store1 < 54.3510631883  and attr store1 > 53.1510631883 ))) 
6 0.1 0.1 peak 234 volume 310.96509 ppm1 4.599 ppm2 4.600
 
! ############### hot_mothernoesy_072403.235 folded -
assi (attr store1 < 2.805 and attr store1 > 2.605 )
     ((attr store1 < 4.651 and attr store1 > 4.551 ) and 
      (bondedto (attr store1 < 149.832810435  and attr store1 > 148.632810435 ) or 
       bondedto (attr store1 < 54.3530631883  and attr store1 > 53.1530631883 ))) 
6 0.1 0.1 peak 235 volume 15.7996 ppm1 4.601 ppm2 2.705
 
! ############### hot_mothernoesy_072403.236 folded -
assi (attr store1 < 2.669 and attr store1 > 2.469 )
     ((attr store1 < 4.649 and attr store1 > 4.549 ) and 
      (bondedto (attr store1 < 149.842810435  and attr store1 > 148.642810435 ) or 
       bondedto (attr store1 < 54.3630631883  and attr store1 > 53.1630631883 ))) 
6 0.1 0.1 peak 236 volume 15.4754 ppm1 4.599 ppm2 2.569
 
! ############### hot_mothernoesy_072403.237 folded -
assi (attr store1 < 1.504 and attr store1 > 1.304 )
     ((attr store1 < 4.645 and attr store1 > 4.545 ) and 
      (bondedto (attr store1 < 149.838810435  and attr store1 > 148.638810435 ) or 
       bondedto (attr store1 < 54.3590631883  and attr store1 > 53.1590631883 ))) 
6 0.1 0.1 peak 237 volume 4.4038 ppm1 4.595 ppm2 1.404
 
! ############### hot_mothernoesy_072403.238 folded -
assi (attr store1 < 3.394 and attr store1 > 3.194 )
     ((attr store1 < 3.399 and attr store1 > 3.299 ) and 
      (bondedto (attr store1 < 149.825810435  and attr store1 > 148.625810435 ) or 
       bondedto (attr store1 < 54.3460631883  and attr store1 > 53.1460631883 ))) 
6 0.1 0.1 peak 238 volume 28.7504 ppm1 3.349 ppm2 3.294
 
! ############### hot_mothernoesy_072403.239 folded -
assi (attr store1 < 3.444 and attr store1 > 3.244 )
     ((attr store1 < 3.338 and attr store1 > 3.238 ) and 
      (bondedto (attr store1 < 149.797810435  and attr store1 > 148.597810435 ) or 
       bondedto (attr store1 < 54.3180631883  and attr store1 > 53.1180631883 ))) 
6 0.1 0.1 peak 239 volume 29.5826 ppm1 3.288 ppm2 3.344
 
! ############### hot_mothernoesy_072403.240 folded -
assi (attr store1 < 1.619 and attr store1 > 1.419 )
     ((attr store1 < 1.787 and attr store1 > 1.687 ) and 
      (bondedto (attr store1 < 149.822810435  and attr store1 > 148.622810435 ) or 
       bondedto (attr store1 < 54.3430631883  and attr store1 > 53.1430631883 ))) 
6 0.1 0.1 peak 240 volume 36.8275 ppm1 1.737 ppm2 1.519
 
! ############### hot_mothernoesy_072403.241 folded +
assi (attr store1 < 1.503 and attr store1 > 1.303 )
     ((attr store1 < 4.316 and attr store1 > 4.216 ) and 
      (bondedto (attr store1 < 125.919873623  and attr store1 > 124.719873623 ) or 
       bondedto (attr store1 < 78.18  and attr store1 > 76.98 ) or 
       bondedto (attr store1 < 30.4401263766  and attr store1 > 29.2401263766 ))) 
6 0.1 0.1 peak 241 volume 6.37420 ppm1 4.266 ppm2 1.403
 
! ############### hot_mothernoesy_072403.242 folded -
assi (attr store1 < 4.225 and attr store1 > 4.025 )
     ((attr store1 < 4.174 and attr store1 > 4.074 ) and 
      (bondedto (attr store1 < 149.756810435  and attr store1 > 148.556810435 ) or 
       bondedto (attr store1 < 54.2770631883  and attr store1 > 53.0770631883 ))) 
6 0.1 0.1 peak 242 volume 56.7211 ppm1 4.124 ppm2 4.125
 
! ############### hot_mothernoesy_072403.243 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 125.811873623  and attr store1 > 124.611873623 ) or 
       bondedto (attr store1 < 78.072  and attr store1 > 76.872 ) or 
       bondedto (attr store1 < 30.3321263766  and attr store1 > 29.1321263766 ))) 
6 0.1 0.1 peak 243 volume 5.60560 ppm1 2.126 ppm2 4.773
 
! ############### hot_mothernoesy_072403.244 folded -
assi (attr store1 < 1.809 and attr store1 > 1.609 )
     ((attr store1 < 1.758 and attr store1 > 1.658 ) and 
      (bondedto (attr store1 < 149.650810435  and attr store1 > 148.450810435 ) or 
       bondedto (attr store1 < 54.1710631883  and attr store1 > 52.9710631883 ))) 
6 0.1 0.1 peak 244 volume 901.18903 ppm1 1.708 ppm2 1.709
 
! ############### hot_mothernoesy_072403.245 folded -
assi (attr store1 < 1.561 and attr store1 > 1.361 )
     ((attr store1 < 1.76 and attr store1 > 1.66 ) and 
      (bondedto (attr store1 < 149.644810435  and attr store1 > 148.444810435 ) or 
       bondedto (attr store1 < 54.1650631883  and attr store1 > 52.9650631883 ))) 
6 0.1 0.1 peak 245 volume 52.2749 ppm1 1.710 ppm2 1.461
 
! ############### hot_mothernoesy_072403.246 folded +
assi (attr store1 < 4.416 and attr store1 > 4.216 )
     ((attr store1 < 4.366 and attr store1 > 4.266 ) and 
      (bondedto (attr store1 < 125.688873623  and attr store1 > 124.488873623 ) or 
       bondedto (attr store1 < 77.949  and attr store1 > 76.749 ) or 
       bondedto (attr store1 < 30.2091263766  and attr store1 > 29.0091263766 ))) 
6 0.1 0.1 peak 246 volume 95.17610 ppm1 4.316 ppm2 4.316
 
! ############### hot_mothernoesy_072403.247 folded +
assi (attr store1 < 4.254 and attr store1 > 4.054 )
     ((attr store1 < 2.163 and attr store1 > 2.063 ) and 
      (bondedto (attr store1 < 125.713873623  and attr store1 > 124.513873623 ) or 
       bondedto (attr store1 < 77.974  and attr store1 > 76.774 ) or 
       bondedto (attr store1 < 30.2341263766  and attr store1 > 29.0341263766 ))) 
6 0.1 0.1 peak 247 volume 11.92330 ppm1 2.113 ppm2 4.154
 
! ############### hot_mothernoesy_072403.248 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 2.137 and attr store1 > 2.037 ) and 
      (bondedto (attr store1 < 125.708873623  and attr store1 > 124.508873623 ) or 
       bondedto (attr store1 < 77.969  and attr store1 > 76.769 ) or 
       bondedto (attr store1 < 30.2291263766  and attr store1 > 29.0291263766 ))) 
6 0.1 0.1 peak 248 volume 5.46300 ppm1 2.087 ppm2 4.772
 
! ############### hot_mothernoesy_072403.249 folded +
assi (attr store1 < 2.405 and attr store1 > 2.205 )
     ((attr store1 < 2.133 and attr store1 > 2.033 ) and 
      (bondedto (attr store1 < 125.651873623  and attr store1 > 124.451873623 ) or 
       bondedto (attr store1 < 77.912  and attr store1 > 76.712 ) or 
       bondedto (attr store1 < 30.1721263766  and attr store1 > 28.9721263766 ))) 
6 0.1 0.1 peak 249 volume 68.68940 ppm1 2.083 ppm2 2.305
 
! ############### hot_mothernoesy_072403.250 folded +
assi (attr store1 < 2.182 and attr store1 > 1.982 )
     ((attr store1 < 2.138 and attr store1 > 2.038 ) and 
      (bondedto (attr store1 < 125.643873623  and attr store1 > 124.443873623 ) or 
       bondedto (attr store1 < 77.904  and attr store1 > 76.704 ) or 
       bondedto (attr store1 < 30.1641263766  and attr store1 > 28.9641263766 ))) 
6 0.1 0.1 peak 250 volume 269.11151 ppm1 2.088 ppm2 2.082
 
! ############### hot_mothernoesy_072403.251 folded +
assi (attr store1 < 4.871 and attr store1 > 4.671 )
     ((attr store1 < 2.11 and attr store1 > 2.01 ) and 
      (bondedto (attr store1 < 125.709873623  and attr store1 > 124.509873623 ) or 
       bondedto (attr store1 < 77.97  and attr store1 > 76.77 ) or 
       bondedto (attr store1 < 30.2301263766  and attr store1 > 29.0301263766 ))) 
6 0.1 0.1 peak 251 volume 5.58410 ppm1 2.060 ppm2 4.771
 
! ############### hot_mothernoesy_072403.252 folded +
assi (attr store1 < 4.26 and attr store1 > 4.06 )
     ((attr store1 < 2.071 and attr store1 > 1.971 ) and 
      (bondedto (attr store1 < 125.651873623  and attr store1 > 124.451873623 ) or 
       bondedto (attr store1 < 77.912  and attr store1 > 76.712 ) or 
       bondedto (attr store1 < 30.1721263766  and attr store1 > 28.9721263766 ))) 
6 0.1 0.1 peak 252 volume 12.54670 ppm1 2.021 ppm2 4.160
 
! ############### hot_mothernoesy_072403.253 folded +
assi (attr store1 < 2.043 and attr store1 > 1.843 )
     ((attr store1 < 1.996 and attr store1 > 1.896 ) and 
      (bondedto (attr store1 < 125.657873623  and attr store1 > 124.457873623 ) or 
       bondedto (attr store1 < 77.918  and attr store1 > 76.718 ) or 
       bondedto (attr store1 < 30.1781263766  and attr store1 > 28.9781263766 ))) 
6 0.1 0.1 peak 253 volume 274.67911 ppm1 1.946 ppm2 1.943
 
! ############### hot_mothernoesy_072403.254 folded -
assi (attr store1 < 3.057 and attr store1 > 2.857 )
     ((attr store1 < 1.69 and attr store1 > 1.59 ) and 
      (bondedto (attr store1 < 149.580810435  and attr store1 > 148.380810435 ) or 
       bondedto (attr store1 < 54.1010631883  and attr store1 > 52.9010631883 ))) 
6 0.1 0.1 peak 254 volume 7.4325 ppm1 1.640 ppm2 2.957
 
! ############### hot_mothernoesy_072403.255 folded -
assi (attr store1 < 1.744 and attr store1 > 1.544 )
     ((attr store1 < 1.691 and attr store1 > 1.591 ) and 
      (bondedto (attr store1 < 149.554810435  and attr store1 > 148.354810435 ) or 
       bondedto (attr store1 < 54.0750631883  and attr store1 > 52.8750631883 ))) 
6 0.1 0.1 peak 255 volume 175.6866 ppm1 1.641 ppm2 1.644
 
! ############### hot_mothernoesy_072403.256 folded -
assi (attr store1 < 1.572 and attr store1 > 1.372 )
     ((attr store1 < 1.694 and attr store1 > 1.594 ) and 
      (bondedto (attr store1 < 149.544810435  and attr store1 > 148.344810435 ) or 
       bondedto (attr store1 < 54.0650631883  and attr store1 > 52.8650631883 ))) 
6 0.1 0.1 peak 256 volume 17.4558 ppm1 1.644 ppm2 1.472
 
! ############### hot_mothernoesy_072403.257 folded +
assi (attr store1 < 4.416 and attr store1 > 4.216 )
     ((attr store1 < 2.122 and attr store1 > 2.022 ) and 
      (bondedto (attr store1 < 125.608873623  and attr store1 > 124.408873623 ) or 
       bondedto (attr store1 < 77.869  and attr store1 > 76.669 ) or 
       bondedto (attr store1 < 30.1291263766  and attr store1 > 28.9291263766 ))) 
6 0.1 0.1 peak 257 volume 12.75330 ppm1 2.072 ppm2 4.316
 
! ############### hot_mothernoesy_072403.258 folded +
assi (attr store1 < 2.047 and attr store1 > 1.847 )
     ((attr store1 < 2.131 and attr store1 > 2.031 ) and 
      (bondedto (attr store1 < 125.628873623  and attr store1 > 124.428873623 ) or 
       bondedto (attr store1 < 77.889  and attr store1 > 76.689 ) or 
       bondedto (attr store1 < 30.1491263766  and attr store1 > 28.9491263766 ))) 
6 0.1 0.1 peak 258 volume 143.44479 ppm1 2.081 ppm2 1.947
 
! ############### hot_mothernoesy_072403.259 folded +
assi (attr store1 < 4.869 and attr store1 > 4.669 )
     ((attr store1 < 2.08 and attr store1 > 1.98 ) and 
      (bondedto (attr store1 < 125.608873623  and attr store1 > 124.408873623 ) or 
       bondedto (attr store1 < 77.869  and attr store1 > 76.669 ) or 
       bondedto (attr store1 < 30.1291263766  and attr store1 > 28.9291263766 ))) 
6 0.1 0.1 peak 259 volume 4.00740 ppm1 2.030 ppm2 4.769
 
! ############### hot_mothernoesy_072403.260 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 2.05 and attr store1 > 1.95 ) and 
      (bondedto (attr store1 < 125.637873623  and attr store1 > 124.437873623 ) or 
       bondedto (attr store1 < 77.898  and attr store1 > 76.698 ) or 
       bondedto (attr store1 < 30.1581263766  and attr store1 > 28.9581263766 ))) 
6 0.1 0.1 peak 260 volume 4.09630 ppm1 2.000 ppm2 4.772
 
! ############### hot_mothernoesy_072403.261 folded +
assi (attr store1 < 4.41 and attr store1 > 4.21 )
     ((attr store1 < 2.016 and attr store1 > 1.916 ) and 
      (bondedto (attr store1 < 125.578873623  and attr store1 > 124.378873623 ) or 
       bondedto (attr store1 < 77.839  and attr store1 > 76.639 ) or 
       bondedto (attr store1 < 30.0991263766  and attr store1 > 28.8991263766 ))) 
6 0.1 0.1 peak 261 volume 6.36920 ppm1 1.966 ppm2 4.310
 
! ############### hot_mothernoesy_072403.262 folded +
assi (attr store1 < 4.413 and attr store1 > 4.213 )
     ((attr store1 < 1.995 and attr store1 > 1.895 ) and 
      (bondedto (attr store1 < 125.595873623  and attr store1 > 124.395873623 ) or 
       bondedto (attr store1 < 77.856  and attr store1 > 76.656 ) or 
       bondedto (attr store1 < 30.1161263766  and attr store1 > 28.9161263766 ))) 
6 0.1 0.1 peak 262 volume 9.40070 ppm1 1.945 ppm2 4.313
 
! ############### hot_mothernoesy_072403.263 folded +
assi (attr store1 < 2.405 and attr store1 > 2.205 )
     ((attr store1 < 1.994 and attr store1 > 1.894 ) and 
      (bondedto (attr store1 < 125.599873623  and attr store1 > 124.399873623 ) or 
       bondedto (attr store1 < 77.86  and attr store1 > 76.66 ) or 
       bondedto (attr store1 < 30.1201263766  and attr store1 > 28.9201263766 ))) 
6 0.1 0.1 peak 263 volume 48.49300 ppm1 1.944 ppm2 2.305
 
! ############### hot_mothernoesy_072403.264 folded +
assi (attr store1 < 2.18 and attr store1 > 1.98 )
     ((attr store1 < 1.995 and attr store1 > 1.895 ) and 
      (bondedto (attr store1 < 125.607873623  and attr store1 > 124.407873623 ) or 
       bondedto (attr store1 < 77.868  and attr store1 > 76.668 ) or 
       bondedto (attr store1 < 30.1281263766  and attr store1 > 28.9281263766 ))) 
6 0.1 0.1 peak 264 volume 140.90140 ppm1 1.945 ppm2 2.080
 
! ############### hot_mothernoesy_072403.265 folded +
assi (attr store1 < 1.933 and attr store1 > 1.733 )
     ((attr store1 < 1.418 and attr store1 > 1.318 ) and 
      (bondedto (attr store1 < 125.603873623  and attr store1 > 124.403873623 ) or 
       bondedto (attr store1 < 77.864  and attr store1 > 76.664 ) or 
       bondedto (attr store1 < 30.1241263766  and attr store1 > 28.9241263766 ))) 
6 0.1 0.1 peak 265 volume 7.49790 ppm1 1.368 ppm2 1.833
 
! ############### hot_mothernoesy_072403.266 folded +
assi (attr store1 < 1.47 and attr store1 > 1.27 )
     ((attr store1 < 1.419 and attr store1 > 1.319 ) and 
      (bondedto (attr store1 < 125.592873623  and attr store1 > 124.392873623 ) or 
       bondedto (attr store1 < 77.853  and attr store1 > 76.653 ) or 
       bondedto (attr store1 < 30.1131263766  and attr store1 > 28.9131263766 ))) 
6 0.1 0.1 peak 266 volume 58.01090 ppm1 1.369 ppm2 1.370
 
! ############### hot_mothernoesy_072403.267 folded +
assi (attr store1 < 0.861 and attr store1 > 0.661 )
     ((attr store1 < 1.416 and attr store1 > 1.316 ) and 
      (bondedto (attr store1 < 125.597873623  and attr store1 > 124.397873623 ) or 
       bondedto (attr store1 < 77.858  and attr store1 > 76.658 ) or 
       bondedto (attr store1 < 30.1181263766  and attr store1 > 28.9181263766 ))) 
6 0.1 0.1 peak 267 volume 6.55070 ppm1 1.366 ppm2 0.761
 
! ############### hot_mothernoesy_072403.268 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 1.412 and attr store1 > 1.312 ) and 
      (bondedto (attr store1 < 125.575873623  and attr store1 > 124.375873623 ) or 
       bondedto (attr store1 < 77.836  and attr store1 > 76.636 ) or 
       bondedto (attr store1 < 30.0961263766  and attr store1 > 28.8961263766 ))) 
6 0.1 0.1 peak 268 volume 4.61720 ppm1 1.362 ppm2 4.773
 
! ############### hot_mothernoesy_072403.270 folded +
assi (attr store1 < 1.357 and attr store1 > 1.157 )
     ((attr store1 < 1.415 and attr store1 > 1.315 ) and 
      (bondedto (attr store1 < 125.583873623  and attr store1 > 124.383873623 ) or 
       bondedto (attr store1 < 77.844  and attr store1 > 76.644 ) or 
       bondedto (attr store1 < 30.1041263766  and attr store1 > 28.9041263766 ))) 
6 0.1 0.1 peak 270 volume 34.53530 ppm1 1.365 ppm2 1.257
 
! ############### hot_mothernoesy_072403.271 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 1.308 and attr store1 > 1.208 ) and 
      (bondedto (attr store1 < 125.577873623  and attr store1 > 124.377873623 ) or 
       bondedto (attr store1 < 77.838  and attr store1 > 76.638 ) or 
       bondedto (attr store1 < 30.0981263766  and attr store1 > 28.8981263766 ))) 
6 0.1 0.1 peak 271 volume 3.91840 ppm1 1.258 ppm2 4.773
 
! ############### hot_mothernoesy_072403.275 folded +
assi (attr store1 < 1.356 and attr store1 > 1.156 )
     ((attr store1 < 1.305 and attr store1 > 1.205 ) and 
      (bondedto (attr store1 < 125.588873623  and attr store1 > 124.388873623 ) or 
       bondedto (attr store1 < 77.849  and attr store1 > 76.649 ) or 
       bondedto (attr store1 < 30.1091263766  and attr store1 > 28.9091263766 ))) 
6 0.1 0.1 peak 275 volume 45.53970 ppm1 1.255 ppm2 1.256
 
! ############### hot_mothernoesy_072403.277 folded +
assi (attr store1 < 2.51 and attr store1 > 2.31 )
     ((attr store1 < 2.241 and attr store1 > 2.141 ) and 
      (bondedto (attr store1 < 125.515873623  and attr store1 > 124.315873623 ) or 
       bondedto (attr store1 < 77.776  and attr store1 > 76.576 ) or 
       bondedto (attr store1 < 30.0361263766  and attr store1 > 28.8361263766 ))) 
6 0.1 0.1 peak 277 volume 30.93220 ppm1 2.191 ppm2 2.410
 
! ############### hot_mothernoesy_072403.278 folded +
assi (attr store1 < 4.441 and attr store1 > 4.241 )
     ((attr store1 < 2.234 and attr store1 > 2.134 ) and 
      (bondedto (attr store1 < 125.507873623  and attr store1 > 124.307873623 ) or 
       bondedto (attr store1 < 77.768  and attr store1 > 76.568 ) or 
       bondedto (attr store1 < 30.0281263766  and attr store1 > 28.8281263766 ))) 
6 0.1 0.1 peak 278 volume 12.48160 ppm1 2.184 ppm2 4.341
 
! ############### hot_mothernoesy_072403.279 folded +
assi (attr store1 < 4.081 and attr store1 > 3.881 )
     ((attr store1 < 2.226 and attr store1 > 2.126 ) and 
      (bondedto (attr store1 < 125.517873623  and attr store1 > 124.317873623 ) or 
       bondedto (attr store1 < 77.778  and attr store1 > 76.578 ) or 
       bondedto (attr store1 < 30.0381263766  and attr store1 > 28.8381263766 ))) 
6 0.1 0.1 peak 279 volume 8.46550 ppm1 2.176 ppm2 3.981
 
! ############### hot_mothernoesy_072403.280 folded +
assi (attr store1 < 2.278 and attr store1 > 2.078 )
     ((attr store1 < 2.23 and attr store1 > 2.13 ) and 
      (bondedto (attr store1 < 125.504873623  and attr store1 > 124.304873623 ) or 
       bondedto (attr store1 < 77.765  and attr store1 > 76.565 ) or 
       bondedto (attr store1 < 30.0251263766  and attr store1 > 28.8251263766 ))) 
6 0.1 0.1 peak 280 volume 75.46930 ppm1 2.180 ppm2 2.178
 
! ############### hot_mothernoesy_072403.281 folded +
assi (attr store1 < 2.137 and attr store1 > 1.937 )
     ((attr store1 < 2.23 and attr store1 > 2.13 ) and 
      (bondedto (attr store1 < 125.512873623  and attr store1 > 124.312873623 ) or 
       bondedto (attr store1 < 77.773  and attr store1 > 76.573 ) or 
       bondedto (attr store1 < 30.0331263766  and attr store1 > 28.8331263766 ))) 
6 0.1 0.1 peak 281 volume 62.09940 ppm1 2.180 ppm2 2.037
 
! ############### hot_mothernoesy_072403.282 folded +
assi (attr store1 < 4.124 and attr store1 > 3.924 )
     ((attr store1 < 2.146 and attr store1 > 2.046 ) and 
      (bondedto (attr store1 < 125.517873623  and attr store1 > 124.317873623 ) or 
       bondedto (attr store1 < 77.778  and attr store1 > 76.578 ) or 
       bondedto (attr store1 < 30.0381263766  and attr store1 > 28.8381263766 ))) 
6 0.1 0.1 peak 282 volume 11.51460 ppm1 2.096 ppm2 4.024
 
! ############### hot_mothernoesy_072403.283 folded +
assi (attr store1 < 4.122 and attr store1 > 3.922 )
     ((attr store1 < 2.123 and attr store1 > 2.023 ) and 
      (bondedto (attr store1 < 125.476873623  and attr store1 > 124.276873623 ) or 
       bondedto (attr store1 < 77.737  and attr store1 > 76.537 ) or 
       bondedto (attr store1 < 29.9971263766  and attr store1 > 28.7971263766 ))) 
6 0.1 0.1 peak 283 volume 12.16960 ppm1 2.073 ppm2 4.022
 
! ############### hot_mothernoesy_072403.284 folded +
assi (attr store1 < 4.434 and attr store1 > 4.234 )
     ((attr store1 < 2.093 and attr store1 > 1.993 ) and 
      (bondedto (attr store1 < 125.515873623  and attr store1 > 124.315873623 ) or 
       bondedto (attr store1 < 77.776  and attr store1 > 76.576 ) or 
       bondedto (attr store1 < 30.0361263766  and attr store1 > 28.8361263766 ))) 
6 0.1 0.1 peak 284 volume 13.20030 ppm1 2.043 ppm2 4.334
 
! ############### hot_mothernoesy_072403.285 folded +
assi (attr store1 < 2.502 and attr store1 > 2.302 )
     ((attr store1 < 2.085 and attr store1 > 1.985 ) and 
      (bondedto (attr store1 < 125.507873623  and attr store1 > 124.307873623 ) or 
       bondedto (attr store1 < 77.768  and attr store1 > 76.568 ) or 
       bondedto (attr store1 < 30.0281263766  and attr store1 > 28.8281263766 ))) 
6 0.1 0.1 peak 285 volume 36.20850 ppm1 2.035 ppm2 2.402
 
! ############### hot_mothernoesy_072403.286 folded +
assi (attr store1 < 2.279 and attr store1 > 2.079 )
     ((attr store1 < 2.083 and attr store1 > 1.983 ) and 
      (bondedto (attr store1 < 125.503873623  and attr store1 > 124.303873623 ) or 
       bondedto (attr store1 < 77.764  and attr store1 > 76.564 ) or 
       bondedto (attr store1 < 30.0241263766  and attr store1 > 28.8241263766 ))) 
6 0.1 0.1 peak 286 volume 75.29350 ppm1 2.033 ppm2 2.179
 
! ############### hot_mothernoesy_072403.287 folded +
assi (attr store1 < 4.105 and attr store1 > 3.905 )
     ((attr store1 < 2.073 and attr store1 > 1.973 ) and 
      (bondedto (attr store1 < 125.513873623  and attr store1 > 124.313873623 ) or 
       bondedto (attr store1 < 77.774  and attr store1 > 76.574 ) or 
       bondedto (attr store1 < 30.0341263766  and attr store1 > 28.8341263766 ))) 
6 0.1 0.1 peak 287 volume 13.82910 ppm1 2.023 ppm2 4.005
 
! ############### hot_mothernoesy_072403.288 folded +
assi (attr store1 < 2.104 and attr store1 > 1.904 )
     ((attr store1 < 2.051 and attr store1 > 1.951 ) and 
      (bondedto (attr store1 < 125.453873623  and attr store1 > 124.253873623 ) or 
       bondedto (attr store1 < 77.714  and attr store1 > 76.514 ) or 
       bondedto (attr store1 < 29.9741263766  and attr store1 > 28.7741263766 ))) 
6 0.1 0.1 peak 288 volume 92.02300 ppm1 2.001 ppm2 2.004
 
! ############### hot_mothernoesy_072403.289 folded +
assi (attr store1 < 1.148 and attr store1 > 0.948 )
     ((attr store1 < 2.126 and attr store1 > 2.026 ) and 
      (bondedto (attr store1 < 125.335873623  and attr store1 > 124.135873623 ) or 
       bondedto (attr store1 < 77.596  and attr store1 > 76.396 ) or 
       bondedto (attr store1 < 29.8561263766  and attr store1 > 28.6561263766 ))) 
6 0.1 0.1 peak 289 volume 5.52670 ppm1 2.076 ppm2 1.048
 
! ############### hot_mothernoesy_072403.290 folded +
assi (attr store1 < 1.141 and attr store1 > 0.941 )
     ((attr store1 < 2.049 and attr store1 > 1.949 ) and 
      (bondedto (attr store1 < 125.342873623  and attr store1 > 124.142873623 ) or 
       bondedto (attr store1 < 77.603  and attr store1 > 76.403 ) or 
       bondedto (attr store1 < 29.8631263766  and attr store1 > 28.6631263766 ))) 
6 0.1 0.1 peak 290 volume 6.33800 ppm1 1.999 ppm2 1.041
 
! ############### hot_mothernoesy_072403.291 folded -
assi (attr store1 < 0.998 and attr store1 > 0.798 )
     ((attr store1 < 4.312 and attr store1 > 4.212 ) and 
      (bondedto (attr store1 < 149.162810435  and attr store1 > 147.962810435 ) or 
       bondedto (attr store1 < 53.6830631883  and attr store1 > 52.4830631883 ))) 
6 0.1 0.1 peak 291 volume 4.7004 ppm1 4.262 ppm2 0.898
 
! ############### hot_mothernoesy_072403.292 folded -
assi (attr store1 < 1.808 and attr store1 > 1.608 )
     ((attr store1 < 1.527 and attr store1 > 1.427 ) and 
      (bondedto (attr store1 < 149.181810435  and attr store1 > 147.981810435 ) or 
       bondedto (attr store1 < 53.7020631883  and attr store1 > 52.5020631883 ))) 
6 0.1 0.1 peak 292 volume 23.4632 ppm1 1.477 ppm2 1.708
 
! ############### hot_mothernoesy_072403.293 folded +
assi (attr store1 < 4.633 and attr store1 > 4.433 )
     ((attr store1 < 3.397 and attr store1 > 3.297 ) and 
      (bondedto (attr store1 < 125.222873623  and attr store1 > 124.022873623 ) or 
       bondedto (attr store1 < 77.483  and attr store1 > 76.283 ) or 
       bondedto (attr store1 < 29.7431263766  and attr store1 > 28.5431263766 ))) 
6 0.1 0.1 peak 293 volume 12.71260 ppm1 3.347 ppm2 4.533
 
! ############### hot_mothernoesy_072403.294 folded +
assi (attr store1 < 3.397 and attr store1 > 3.197 )
     ((attr store1 < 3.397 and attr store1 > 3.297 ) and 
      (bondedto (attr store1 < 125.194873623  and attr store1 > 123.994873623 ) or 
       bondedto (attr store1 < 77.455  and attr store1 > 76.255 ) or 
       bondedto (attr store1 < 29.7151263766  and attr store1 > 28.5151263766 ))) 
6 0.1 0.1 peak 294 volume 107.08700 ppm1 3.347 ppm2 3.297
 
! ############### hot_mothernoesy_072403.295 folded +
assi (attr store1 < 4.634 and attr store1 > 4.434 )
     ((attr store1 < 3.34 and attr store1 > 3.24 ) and 
      (bondedto (attr store1 < 125.198873623  and attr store1 > 123.998873623 ) or 
       bondedto (attr store1 < 77.459  and attr store1 > 76.259 ) or 
       bondedto (attr store1 < 29.7191263766  and attr store1 > 28.5191263766 ))) 
6 0.1 0.1 peak 295 volume 12.77800 ppm1 3.290 ppm2 4.534
 
! ############### hot_mothernoesy_072403.296 folded +
assi (attr store1 < 3.438 and attr store1 > 3.238 )
     ((attr store1 < 3.339 and attr store1 > 3.239 ) and 
      (bondedto (attr store1 < 125.185873623  and attr store1 > 123.985873623 ) or 
       bondedto (attr store1 < 77.446  and attr store1 > 76.246 ) or 
       bondedto (attr store1 < 29.7061263766  and attr store1 > 28.5061263766 ))) 
6 0.1 0.1 peak 296 volume 106.74870 ppm1 3.289 ppm2 3.338
 
! ############### hot_mothernoesy_072403.297 folded +
assi (attr store1 < 4.395 and attr store1 > 4.195 )
     ((attr store1 < 1.782 and attr store1 > 1.682 ) and 
      (bondedto (attr store1 < 125.253873623  and attr store1 > 124.053873623 ) or 
       bondedto (attr store1 < 77.514  and attr store1 > 76.314 ) or 
       bondedto (attr store1 < 29.7741263766  and attr store1 > 28.5741263766 ))) 
6 0.1 0.1 peak 297 volume 5.60110 ppm1 1.732 ppm2 4.295
 
! ############### hot_mothernoesy_072403.298 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 4.313 and attr store1 > 4.213 ) and 
      (bondedto (attr store1 < 149.097810435  and attr store1 > 147.897810435 ) or 
       bondedto (attr store1 < 53.6180631883  and attr store1 > 52.4180631883 ))) 
6 0.1 0.1 peak 298 volume 12.0188 ppm1 4.263 ppm2 4.773
 
! ############### hot_mothernoesy_072403.299 folded -
assi (attr store1 < 2.19 and attr store1 > 1.99 )
     ((attr store1 < 4.312 and attr store1 > 4.212 ) and 
      (bondedto (attr store1 < 149.113810435  and attr store1 > 147.913810435 ) or 
       bondedto (attr store1 < 53.6340631883  and attr store1 > 52.4340631883 ))) 
6 0.1 0.1 peak 299 volume 5.7336 ppm1 4.262 ppm2 2.090
 
! ############### hot_mothernoesy_072403.300 folded -
assi (attr store1 < 1.501 and attr store1 > 1.301 )
     ((attr store1 < 4.313 and attr store1 > 4.213 ) and 
      (bondedto (attr store1 < 149.092810435  and attr store1 > 147.892810435 ) or 
       bondedto (attr store1 < 53.6130631883  and attr store1 > 52.4130631883 ))) 
6 0.1 0.1 peak 300 volume 97.8599 ppm1 4.263 ppm2 1.401
 
! ############### hot_mothernoesy_072403.301 folded +
assi (attr store1 < 1.808 and attr store1 > 1.608 )
     ((attr store1 < 1.757 and attr store1 > 1.657 ) and 
      (bondedto (attr store1 < 125.134873623  and attr store1 > 123.934873623 ) or 
       bondedto (attr store1 < 77.395  and attr store1 > 76.195 ) or 
       bondedto (attr store1 < 29.6551263766  and attr store1 > 28.4551263766 ))) 
6 0.1 0.1 peak 301 volume 2881.44092 ppm1 1.707 ppm2 1.708
 
! ############### hot_mothernoesy_072403.302 folded +
assi (attr store1 < 1.562 and attr store1 > 1.362 )
     ((attr store1 < 1.76 and attr store1 > 1.66 ) and 
      (bondedto (attr store1 < 125.092873623  and attr store1 > 123.892873623 ) or 
       bondedto (attr store1 < 77.353  and attr store1 > 76.153 ) or 
       bondedto (attr store1 < 29.6131263766  and attr store1 > 28.4131263766 ))) 
6 0.1 0.1 peak 302 volume 192.37241 ppm1 1.710 ppm2 1.462
 
! ############### hot_mothernoesy_072403.303 folded -
assi (attr store1 < 4.352 and attr store1 > 4.152 )
     ((attr store1 < 4.302 and attr store1 > 4.202 ) and 
      (bondedto (attr store1 < 148.974810435  and attr store1 > 147.774810435 ) or 
       bondedto (attr store1 < 53.4950631883  and attr store1 > 52.2950631883 ))) 
6 0.1 0.1 peak 303 volume 801.67902 ppm1 4.252 ppm2 4.252
 
! ############### hot_mothernoesy_072403.304 folded +
assi (attr store1 < 4.436 and attr store1 > 4.236 )
     ((attr store1 < 1.69 and attr store1 > 1.59 ) and 
      (bondedto (attr store1 < 125.036873623  and attr store1 > 123.836873623 ) or 
       bondedto (attr store1 < 77.297  and attr store1 > 76.097 ) or 
       bondedto (attr store1 < 29.5571263766  and attr store1 > 28.3571263766 ))) 
6 0.1 0.1 peak 304 volume 7.35230 ppm1 1.640 ppm2 4.336
 
! ############### hot_mothernoesy_072403.305 folded +
assi (attr store1 < 3.056 and attr store1 > 2.856 )
     ((attr store1 < 1.69 and attr store1 > 1.59 ) and 
      (bondedto (attr store1 < 125.039873623  and attr store1 > 123.839873623 ) or 
       bondedto (attr store1 < 77.3  and attr store1 > 76.1 ) or 
       bondedto (attr store1 < 29.5601263766  and attr store1 > 28.3601263766 ))) 
6 0.1 0.1 peak 305 volume 24.80920 ppm1 1.640 ppm2 2.956
 
! ############### hot_mothernoesy_072403.306 folded +
assi (attr store1 < 1.892 and attr store1 > 1.692 )
     ((attr store1 < 1.695 and attr store1 > 1.595 ) and 
      (bondedto (attr store1 < 125.050873623  and attr store1 > 123.850873623 ) or 
       bondedto (attr store1 < 77.311  and attr store1 > 76.111 ) or 
       bondedto (attr store1 < 29.5711263766  and attr store1 > 28.3711263766 ))) 
6 0.1 0.1 peak 306 volume 14.79010 ppm1 1.645 ppm2 1.792
 
! ############### hot_mothernoesy_072403.307 folded +
assi (attr store1 < 1.742 and attr store1 > 1.542 )
     ((attr store1 < 1.692 and attr store1 > 1.592 ) and 
      (bondedto (attr store1 < 125.044873623  and attr store1 > 123.844873623 ) or 
       bondedto (attr store1 < 77.305  and attr store1 > 76.105 ) or 
       bondedto (attr store1 < 29.5651263766  and attr store1 > 28.3651263766 ))) 
6 0.1 0.1 peak 307 volume 572.59949 ppm1 1.642 ppm2 1.642
 
! ############### hot_mothernoesy_072403.308 folded +
assi (attr store1 < 1.969 and attr store1 > 1.769 )
     ((attr store1 < 1.689 and attr store1 > 1.589 ) and 
      (bondedto (attr store1 < 125.043873623  and attr store1 > 123.843873623 ) or 
       bondedto (attr store1 < 77.304  and attr store1 > 76.104 ) or 
       bondedto (attr store1 < 29.5641263766  and attr store1 > 28.3641263766 ))) 
6 0.1 0.1 peak 308 volume 11.35810 ppm1 1.639 ppm2 1.869
 
! ############### hot_mothernoesy_072403.309 folded +
assi (attr store1 < 1.571 and attr store1 > 1.371 )
     ((attr store1 < 1.688 and attr store1 > 1.588 ) and 
      (bondedto (attr store1 < 125.037873623  and attr store1 > 123.837873623 ) or 
       bondedto (attr store1 < 77.298  and attr store1 > 76.098 ) or 
       bondedto (attr store1 < 29.5581263766  and attr store1 > 28.3581263766 ))) 
6 0.1 0.1 peak 309 volume 55.87330 ppm1 1.638 ppm2 1.471
 
! ############### hot_mothernoesy_072403.310 folded -
assi (attr store1 < 4.41 and attr store1 > 4.21 )
     ((attr store1 < 4.36 and attr store1 > 4.26 ) and 
      (bondedto (attr store1 < 148.864810435  and attr store1 > 147.664810435 ) or 
       bondedto (attr store1 < 53.3850631883  and attr store1 > 52.1850631883 ))) 
6 0.1 0.1 peak 310 volume 925.07373 ppm1 4.310 ppm2 4.310
 
! ############### hot_mothernoesy_072403.311 folded -
assi (attr store1 < 1.41 and attr store1 > 1.21 )
     ((attr store1 < 4.293 and attr store1 > 4.193 ) and 
      (bondedto (attr store1 < 148.892810435  and attr store1 > 147.692810435 ) or 
       bondedto (attr store1 < 53.4130631883  and attr store1 > 52.2130631883 ))) 
6 0.1 0.1 peak 311 volume 43.9777 ppm1 4.243 ppm2 1.310
 
! ############### hot_mothernoesy_072403.312 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 1.759 and attr store1 > 1.659 ) and 
      (bondedto (attr store1 < 148.952810435  and attr store1 > 147.752810435 ) or 
       bondedto (attr store1 < 53.4730631883  and attr store1 > 52.2730631883 ))) 
6 0.1 0.1 peak 312 volume 5.5385 ppm1 1.709 ppm2 4.773
 
! ############### hot_mothernoesy_072403.313 folded -
assi (attr store1 < 2.321 and attr store1 > 2.121 )
     ((attr store1 < 2.288 and attr store1 > 2.188 ) and 
      (bondedto (attr store1 < 148.820810435  and attr store1 > 147.620810435 ) or 
       bondedto (attr store1 < 53.3410631883  and attr store1 > 52.1410631883 ))) 
6 0.1 0.1 peak 313 volume 11.7063 ppm1 2.238 ppm2 2.221
 
! ############### hot_mothernoesy_072403.314 folded -
assi (attr store1 < 2.0 and attr store1 > 1.8 )
     ((attr store1 < 1.632 and attr store1 > 1.532 ) and 
      (bondedto (attr store1 < 148.410810435  and attr store1 > 147.210810435 ) or 
       bondedto (attr store1 < 52.9310631883  and attr store1 > 51.7310631883 ))) 
6 0.1 0.1 peak 314 volume 7.1573 ppm1 1.582 ppm2 1.900
 
! ############### hot_mothernoesy_072403.315 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 2.251 and attr store1 > 2.151 ) and 
      (bondedto (attr store1 < 124.441873623  and attr store1 > 123.241873623 ) or 
       bondedto (attr store1 < 76.702  and attr store1 > 75.502 ) or 
       bondedto (attr store1 < 28.9621263766  and attr store1 > 27.7621263766 ))) 
6 0.1 0.1 peak 315 volume 3.61130 ppm1 2.201 ppm2 4.774
 
! ############### hot_mothernoesy_072403.316 folded -
assi (attr store1 < 4.568 and attr store1 > 4.368 )
     ((attr store1 < 4.518 and attr store1 > 4.418 ) and 
      (bondedto (attr store1 < 148.309810435  and attr store1 > 147.109810435 ) or 
       bondedto (attr store1 < 52.8300631883  and attr store1 > 51.6300631883 ))) 
6 0.1 0.1 peak 316 volume 19.8361 ppm1 4.468 ppm2 4.468
 
! ############### hot_mothernoesy_072403.317 folded -
assi (attr store1 < 1.841 and attr store1 > 1.641 )
     ((attr store1 < 4.519 and attr store1 > 4.419 ) and 
      (bondedto (attr store1 < 148.334810435  and attr store1 > 147.134810435 ) or 
       bondedto (attr store1 < 52.8550631883  and attr store1 > 51.6550631883 ))) 
6 0.1 0.1 peak 317 volume 3.3918 ppm1 4.469 ppm2 1.741
 
! ############### hot_mothernoesy_072403.318 folded -
assi (attr store1 < 3.979 and attr store1 > 3.779 )
     ((attr store1 < 4.514 and attr store1 > 4.414 ) and 
      (bondedto (attr store1 < 148.313810435  and attr store1 > 147.113810435 ) or 
       bondedto (attr store1 < 52.8340631883  and attr store1 > 51.6340631883 ))) 
6 0.1 0.1 peak 318 volume 8.3241 ppm1 4.464 ppm2 3.879
 
! ############### hot_mothernoesy_072403.319 folded -
assi (attr store1 < 1.63 and attr store1 > 1.43 )
     ((attr store1 < 4.51 and attr store1 > 4.41 ) and 
      (bondedto (attr store1 < 148.308810435  and attr store1 > 147.108810435 ) or 
       bondedto (attr store1 < 52.8290631883  and attr store1 > 51.6290631883 ))) 
6 0.1 0.1 peak 319 volume 5.008 ppm1 4.460 ppm2 1.530
 
! ############### hot_mothernoesy_072403.320 folded -
assi (attr store1 < 3.309 and attr store1 > 3.109 )
     ((attr store1 < 1.65 and attr store1 > 1.55 ) and 
      (bondedto (attr store1 < 148.359810435  and attr store1 > 147.159810435 ) or 
       bondedto (attr store1 < 52.8800631883  and attr store1 > 51.6800631883 ))) 
6 0.1 0.1 peak 320 volume 4.503 ppm1 1.600 ppm2 3.209
 
! ############### hot_mothernoesy_072403.321 folded -
assi (attr store1 < 1.686 and attr store1 > 1.486 )
     ((attr store1 < 1.644 and attr store1 > 1.544 ) and 
      (bondedto (attr store1 < 148.358810435  and attr store1 > 147.158810435 ) or 
       bondedto (attr store1 < 52.8790631883  and attr store1 > 51.6790631883 ))) 
6 0.1 0.1 peak 321 volume 25.0572 ppm1 1.594 ppm2 1.586
 
! ############### hot_mothernoesy_072403.322 folded +
assi (attr store1 < 4.458 and attr store1 > 4.258 )
     ((attr store1 < 4.407 and attr store1 > 4.307 ) and 
      (bondedto (attr store1 < 124.373873623  and attr store1 > 123.173873623 ) or 
       bondedto (attr store1 < 76.634  and attr store1 > 75.434 ) or 
       bondedto (attr store1 < 28.8941263766  and attr store1 > 27.6941263766 ))) 
6 0.1 0.1 peak 322 volume 3.52810 ppm1 4.357 ppm2 4.358
 
! ############### hot_mothernoesy_072403.323 folded +
assi (attr store1 < 4.064 and attr store1 > 3.864 )
     ((attr store1 < 2.251 and attr store1 > 2.151 ) and 
      (bondedto (attr store1 < 124.415873623  and attr store1 > 123.215873623 ) or 
       bondedto (attr store1 < 76.676  and attr store1 > 75.476 ) or 
       bondedto (attr store1 < 28.9361263766  and attr store1 > 27.7361263766 ))) 
6 0.1 0.1 peak 323 volume 7.04210 ppm1 2.201 ppm2 3.964
 
! ############### hot_mothernoesy_072403.324 folded +
assi (attr store1 < 2.204 and attr store1 > 2.004 )
     ((attr store1 < 2.247 and attr store1 > 2.147 ) and 
      (bondedto (attr store1 < 124.391873623  and attr store1 > 123.191873623 ) or 
       bondedto (attr store1 < 76.652  and attr store1 > 75.452 ) or 
       bondedto (attr store1 < 28.9121263766  and attr store1 > 27.7121263766 ))) 
6 0.1 0.1 peak 324 volume 27.02410 ppm1 2.197 ppm2 2.104
 
! ############### hot_mothernoesy_072403.325 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 2.141 and attr store1 > 2.041 ) and 
      (bondedto (attr store1 < 124.411873623  and attr store1 > 123.211873623 ) or 
       bondedto (attr store1 < 76.672  and attr store1 > 75.472 ) or 
       bondedto (attr store1 < 28.9321263766  and attr store1 > 27.7321263766 ))) 
6 0.1 0.1 peak 325 volume 4.06180 ppm1 2.091 ppm2 4.773
 
! ############### hot_mothernoesy_072403.326 folded +
assi (attr store1 < 2.535 and attr store1 > 2.335 )
     ((attr store1 < 2.138 and attr store1 > 2.038 ) and 
      (bondedto (attr store1 < 124.405873623  and attr store1 > 123.205873623 ) or 
       bondedto (attr store1 < 76.666  and attr store1 > 75.466 ) or 
       bondedto (attr store1 < 28.9261263766  and attr store1 > 27.7261263766 ))) 
6 0.1 0.1 peak 326 volume 24.88580 ppm1 2.088 ppm2 2.435
 
! ############### hot_mothernoesy_072403.327 folded -
assi (attr store1 < 2.208 and attr store1 > 2.008 )
     ((attr store1 < 4.523 and attr store1 > 4.423 ) and 
      (bondedto (attr store1 < 148.258810435  and attr store1 > 147.058810435 ) or 
       bondedto (attr store1 < 52.7790631883  and attr store1 > 51.5790631883 ))) 
6 0.1 0.1 peak 327 volume 5.28 ppm1 4.473 ppm2 2.108
 
! ############### hot_mothernoesy_072403.328 folded -
assi (attr store1 < 3.468 and attr store1 > 3.268 )
     ((attr store1 < 4.511 and attr store1 > 4.411 ) and 
      (bondedto (attr store1 < 148.294810435  and attr store1 > 147.094810435 ) or 
       bondedto (attr store1 < 52.8150631883  and attr store1 > 51.6150631883 ))) 
6 0.1 0.1 peak 328 volume 5.7394 ppm1 4.461 ppm2 3.368
 
! ############### hot_mothernoesy_072403.329 folded -
assi (attr store1 < 1.76 and attr store1 > 1.56 )
     ((attr store1 < 4.516 and attr store1 > 4.416 ) and 
      (bondedto (attr store1 < 148.284810435  and attr store1 > 147.084810435 ) or 
       bondedto (attr store1 < 52.8050631883  and attr store1 > 51.6050631883 ))) 
6 0.1 0.1 peak 329 volume 6.7453 ppm1 4.466 ppm2 1.660
 
! ############### hot_mothernoesy_072403.330 folded -
assi (attr store1 < 1.707 and attr store1 > 1.507 )
     ((attr store1 < 1.823 and attr store1 > 1.723 ) and 
      (bondedto (attr store1 < 148.240810435  and attr store1 > 147.040810435 ) or 
       bondedto (attr store1 < 52.7610631883  and attr store1 > 51.5610631883 ))) 
6 0.1 0.1 peak 330 volume 7.8931 ppm1 1.773 ppm2 1.607
 
! ############### hot_mothernoesy_072403.331 folded -
assi (attr store1 < 1.868 and attr store1 > 1.668 )
     ((attr store1 < 1.65 and attr store1 > 1.55 ) and 
      (bondedto (attr store1 < 148.259810435  and attr store1 > 147.059810435 ) or 
       bondedto (attr store1 < 52.7800631883  and attr store1 > 51.5800631883 ))) 
6 0.1 0.1 peak 331 volume 8.9584 ppm1 1.600 ppm2 1.768
 
! ############### hot_mothernoesy_072403.332 folded +
assi (attr store1 < 4.13 and attr store1 > 3.93 )
     ((attr store1 < 2.317 and attr store1 > 2.217 ) and 
      (bondedto (attr store1 < 124.268873623  and attr store1 > 123.068873623 ) or 
       bondedto (attr store1 < 76.529  and attr store1 > 75.329 ) or 
       bondedto (attr store1 < 28.7891263766  and attr store1 > 27.5891263766 ))) 
6 0.1 0.1 peak 332 volume 6.06330 ppm1 2.267 ppm2 4.030
 
! ############### hot_mothernoesy_072403.333 folded +
assi (attr store1 < 2.169 and attr store1 > 1.969 )
     ((attr store1 < 2.318 and attr store1 > 2.218 ) and 
      (bondedto (attr store1 < 124.268873623  and attr store1 > 123.068873623 ) or 
       bondedto (attr store1 < 76.529  and attr store1 > 75.329 ) or 
       bondedto (attr store1 < 28.7891263766  and attr store1 > 27.5891263766 ))) 
6 0.1 0.1 peak 333 volume 19.82950 ppm1 2.268 ppm2 2.069
 
! ############### hot_mothernoesy_072403.334 folded +
assi (attr store1 < 1.141 and attr store1 > 0.941 )
     ((attr store1 < 2.323 and attr store1 > 2.223 ) and 
      (bondedto (attr store1 < 124.254873623  and attr store1 > 123.054873623 ) or 
       bondedto (attr store1 < 76.515  and attr store1 > 75.315 ) or 
       bondedto (attr store1 < 28.7751263766  and attr store1 > 27.5751263766 ))) 
6 0.1 0.1 peak 334 volume 5.44160 ppm1 2.273 ppm2 1.041
 
! ############### hot_mothernoesy_072403.335 folded +
assi (attr store1 < 2.523 and attr store1 > 2.323 )
     ((attr store1 < 2.249 and attr store1 > 2.149 ) and 
      (bondedto (attr store1 < 124.302873623  and attr store1 > 123.102873623 ) or 
       bondedto (attr store1 < 76.563  and attr store1 > 75.363 ) or 
       bondedto (attr store1 < 28.8231263766  and attr store1 > 27.6231263766 ))) 
6 0.1 0.1 peak 335 volume 28.66780 ppm1 2.199 ppm2 2.423
 
! ############### hot_mothernoesy_072403.336 folded +
assi (attr store1 < 4.122 and attr store1 > 3.922 )
     ((attr store1 < 2.12 and attr store1 > 2.02 ) and 
      (bondedto (attr store1 < 124.329873623  and attr store1 > 123.129873623 ) or 
       bondedto (attr store1 < 76.59  and attr store1 > 75.39 ) or 
       bondedto (attr store1 < 28.8501263766  and attr store1 > 27.6501263766 ))) 
6 0.1 0.1 peak 336 volume 6.82100 ppm1 2.070 ppm2 4.022
 
! ############### hot_mothernoesy_072403.337 folded +
assi (attr store1 < 1.04 and attr store1 > 0.84 )
     ((attr store1 < 2.127 and attr store1 > 2.027 ) and 
      (bondedto (attr store1 < 124.297873623  and attr store1 > 123.097873623 ) or 
       bondedto (attr store1 < 76.558  and attr store1 > 75.358 ) or 
       bondedto (attr store1 < 28.8181263766  and attr store1 > 27.6181263766 ))) 
6 0.1 0.1 peak 337 volume 4.22940 ppm1 2.077 ppm2 0.940
 
! ############### hot_mothernoesy_072403.338 folded +
assi (attr store1 < 1.142 and attr store1 > 0.942 )
     ((attr store1 < 2.116 and attr store1 > 2.016 ) and 
      (bondedto (attr store1 < 124.251873623  and attr store1 > 123.051873623 ) or 
       bondedto (attr store1 < 76.512  and attr store1 > 75.312 ) or 
       bondedto (attr store1 < 28.7721263766  and attr store1 > 27.5721263766 ))) 
6 0.1 0.1 peak 338 volume 6.21770 ppm1 2.066 ppm2 1.042
 
! ############### hot_mothernoesy_072403.339 folded -
assi (attr store1 < 2.069 and attr store1 > 1.869 )
     ((attr store1 < 4.524 and attr store1 > 4.424 ) and 
      (bondedto (attr store1 < 148.190810435  and attr store1 > 146.990810435 ) or 
       bondedto (attr store1 < 52.7110631883  and attr store1 > 51.5110631883 ))) 
6 0.1 0.1 peak 339 volume 3.2494 ppm1 4.474 ppm2 1.969
 
! ############### hot_mothernoesy_072403.340 folded -
assi (attr store1 < 1.552 and attr store1 > 1.352 )
     ((attr store1 < 0.915 and attr store1 > 0.815 ) and 
      (bondedto (attr store1 < 148.130810435  and attr store1 > 146.930810435 ) or 
       bondedto (attr store1 < 52.6510631883  and attr store1 > 51.4510631883 ))) 
6 0.1 0.1 peak 340 volume 7.7154 ppm1 0.865 ppm2 1.452
 
! ############### hot_mothernoesy_072403.341 folded +
assi (attr store1 < 4.368 and attr store1 > 4.168 )
     ((attr store1 < 2.25 and attr store1 > 2.15 ) and 
      (bondedto (attr store1 < 124.243873623  and attr store1 > 123.043873623 ) or 
       bondedto (attr store1 < 76.504  and attr store1 > 75.304 ) or 
       bondedto (attr store1 < 28.7641263766  and attr store1 > 27.5641263766 ))) 
6 0.1 0.1 peak 341 volume 3.96150 ppm1 2.200 ppm2 4.268
 
! ############### hot_mothernoesy_072403.342 folded +
assi (attr store1 < 2.304 and attr store1 > 2.104 )
     ((attr store1 < 2.25 and attr store1 > 2.15 ) and 
      (bondedto (attr store1 < 124.230873623  and attr store1 > 123.030873623 ) or 
       bondedto (attr store1 < 76.491  and attr store1 > 75.291 ) or 
       bondedto (attr store1 < 28.7511263766  and attr store1 > 27.5511263766 ))) 
6 0.1 0.1 peak 342 volume 59.96100 ppm1 2.200 ppm2 2.204
 
! ############### hot_mothernoesy_072403.343 folded +
assi (attr store1 < 4.234 and attr store1 > 4.034 )
     ((attr store1 < 2.246 and attr store1 > 2.146 ) and 
      (bondedto (attr store1 < 124.194873623  and attr store1 > 122.994873623 ) or 
       bondedto (attr store1 < 76.455  and attr store1 > 75.255 ) or 
       bondedto (attr store1 < 28.7151263766  and attr store1 > 27.5151263766 ))) 
6 0.1 0.1 peak 343 volume 10.84920 ppm1 2.196 ppm2 4.134
 
! ############### hot_mothernoesy_072403.344 folded +
assi (attr store1 < 2.646 and attr store1 > 2.446 )
     ((attr store1 < 2.245 and attr store1 > 2.145 ) and 
      (bondedto (attr store1 < 124.209873623  and attr store1 > 123.009873623 ) or 
       bondedto (attr store1 < 76.47  and attr store1 > 75.27 ) or 
       bondedto (attr store1 < 28.7301263766  and attr store1 > 27.5301263766 ))) 
6 0.1 0.1 peak 344 volume 9.77030 ppm1 2.195 ppm2 2.546
 
! ############### hot_mothernoesy_072403.345 folded -
assi (attr store1 < 1.554 and attr store1 > 1.354 )
     ((attr store1 < 1.504 and attr store1 > 1.404 ) and 
      (bondedto (attr store1 < 148.082810435  and attr store1 > 146.882810435 ) or 
       bondedto (attr store1 < 52.6030631883  and attr store1 > 51.4030631883 ))) 
6 0.1 0.1 peak 345 volume 96.0652 ppm1 1.454 ppm2 1.454
 
! ############### hot_mothernoesy_072403.346 folded -
assi (attr store1 < 1.282 and attr store1 > 1.082 )
     ((attr store1 < 1.501 and attr store1 > 1.401 ) and 
      (bondedto (attr store1 < 148.062810435  and attr store1 > 146.862810435 ) or 
       bondedto (attr store1 < 52.5830631883  and attr store1 > 51.3830631883 ))) 
6 0.1 0.1 peak 346 volume 27.0629 ppm1 1.451 ppm2 1.182
 
! ############### hot_mothernoesy_072403.347 folded -
assi (attr store1 < 0.975 and attr store1 > 0.775 )
     ((attr store1 < 1.503 and attr store1 > 1.403 ) and 
      (bondedto (attr store1 < 148.088810435  and attr store1 > 146.888810435 ) or 
       bondedto (attr store1 < 52.6090631883  and attr store1 > 51.4090631883 ))) 
6 0.1 0.1 peak 347 volume 9.25 ppm1 1.453 ppm2 0.875
 
! ############### hot_mothernoesy_072403.348 folded -
assi (attr store1 < 1.553 and attr store1 > 1.353 )
     ((attr store1 < 1.231 and attr store1 > 1.131 ) and 
      (bondedto (attr store1 < 148.053810435  and attr store1 > 146.853810435 ) or 
       bondedto (attr store1 < 52.5740631883  and attr store1 > 51.3740631883 ))) 
6 0.1 0.1 peak 348 volume 22.7736 ppm1 1.181 ppm2 1.453
 
! ############### hot_mothernoesy_072403.349 folded -
assi (attr store1 < 1.276 and attr store1 > 1.076 )
     ((attr store1 < 1.227 and attr store1 > 1.127 ) and 
      (bondedto (attr store1 < 148.075810435  and attr store1 > 146.875810435 ) or 
       bondedto (attr store1 < 52.5960631883  and attr store1 > 51.3960631883 ))) 
6 0.1 0.1 peak 349 volume 45.4635 ppm1 1.177 ppm2 1.176
 
! ############### hot_mothernoesy_072403.350 folded -
assi (attr store1 < 0.978 and attr store1 > 0.778 )
     ((attr store1 < 1.233 and attr store1 > 1.133 ) and 
      (bondedto (attr store1 < 148.042810435  and attr store1 > 146.842810435 ) or 
       bondedto (attr store1 < 52.5630631883  and attr store1 > 51.3630631883 ))) 
6 0.1 0.1 peak 350 volume 9.5616 ppm1 1.183 ppm2 0.878
 
! ############### hot_mothernoesy_072403.351 folded -
assi (attr store1 < 1.284 and attr store1 > 1.084 )
     ((attr store1 < 0.917 and attr store1 > 0.817 ) and 
      (bondedto (attr store1 < 148.038810435  and attr store1 > 146.838810435 ) or 
       bondedto (attr store1 < 52.5590631883  and attr store1 > 51.3590631883 ))) 
6 0.1 0.1 peak 351 volume 8.3567 ppm1 0.867 ppm2 1.184
 
! ############### hot_mothernoesy_072403.352 folded +
assi (attr store1 < 1.817 and attr store1 > 1.617 )
     ((attr store1 < 1.941 and attr store1 > 1.841 ) and 
      (bondedto (attr store1 < 124.102873623  and attr store1 > 122.902873623 ) or 
       bondedto (attr store1 < 76.363  and attr store1 > 75.163 ) or 
       bondedto (attr store1 < 28.6231263766  and attr store1 > 27.4231263766 ))) 
6 0.1 0.1 peak 352 volume 27.15400 ppm1 1.891 ppm2 1.717
 
! ############### hot_mothernoesy_072403.353 folded +
assi (attr store1 < 3.985 and attr store1 > 3.785 )
     ((attr store1 < 1.768 and attr store1 > 1.668 ) and 
      (bondedto (attr store1 < 124.105873623  and attr store1 > 122.905873623 ) or 
       bondedto (attr store1 < 76.366  and attr store1 > 75.166 ) or 
       bondedto (attr store1 < 28.6261263766  and attr store1 > 27.4261263766 ))) 
6 0.1 0.1 peak 353 volume 4.35850 ppm1 1.718 ppm2 3.885
 
! ############### hot_mothernoesy_072403.354 folded +
assi (attr store1 < 2.002 and attr store1 > 1.802 )
     ((attr store1 < 1.768 and attr store1 > 1.668 ) and 
      (bondedto (attr store1 < 124.099873623  and attr store1 > 122.899873623 ) or 
       bondedto (attr store1 < 76.36  and attr store1 > 75.16 ) or 
       bondedto (attr store1 < 28.6201263766  and attr store1 > 27.4201263766 ))) 
6 0.1 0.1 peak 354 volume 33.13360 ppm1 1.718 ppm2 1.902
 
! ############### hot_mothernoesy_072403.355 folded +
assi (attr store1 < 3.311 and attr store1 > 3.111 )
     ((attr store1 < 1.765 and attr store1 > 1.665 ) and 
      (bondedto (attr store1 < 124.082873623  and attr store1 > 122.882873623 ) or 
       bondedto (attr store1 < 76.343  and attr store1 > 75.143 ) or 
       bondedto (attr store1 < 28.6031263766  and attr store1 > 27.4031263766 ))) 
6 0.1 0.1 peak 355 volume 11.17260 ppm1 1.715 ppm2 3.211
 
! ############### hot_mothernoesy_072403.356 folded +
assi (attr store1 < 3.317 and attr store1 > 3.117 )
     ((attr store1 < 1.932 and attr store1 > 1.832 ) and 
      (bondedto (attr store1 < 123.991873623  and attr store1 > 122.791873623 ) or 
       bondedto (attr store1 < 76.252  and attr store1 > 75.052 ) or 
       bondedto (attr store1 < 28.5121263766  and attr store1 > 27.3121263766 ))) 
6 0.1 0.1 peak 356 volume 12.77880 ppm1 1.882 ppm2 3.217
 
! ############### hot_mothernoesy_072403.357 folded -
assi (attr store1 < 2.406 and attr store1 > 2.206 )
     ((attr store1 < 2.078 and attr store1 > 1.978 ) and 
      (bondedto (attr store1 < 147.918810435  and attr store1 > 146.718810435 ) or 
       bondedto (attr store1 < 52.4390631883  and attr store1 > 51.2390631883 ))) 
6 0.1 0.1 peak 357 volume 6.0671 ppm1 2.028 ppm2 2.306
 
! ############### hot_mothernoesy_072403.358 folded +
assi (attr store1 < 1.997 and attr store1 > 1.797 )
     ((attr store1 < 1.937 and attr store1 > 1.837 ) and 
      (bondedto (attr store1 < 123.937873623  and attr store1 > 122.737873623 ) or 
       bondedto (attr store1 < 76.198  and attr store1 > 74.998 ) or 
       bondedto (attr store1 < 28.4581263766  and attr store1 > 27.2581263766 ))) 
6 0.1 0.1 peak 358 volume 53.76800 ppm1 1.887 ppm2 1.897
 
! ############### hot_mothernoesy_072403.359 folded +
assi (attr store1 < 3.991 and attr store1 > 3.791 )
     ((attr store1 < 1.93 and attr store1 > 1.83 ) and 
      (bondedto (attr store1 < 123.886873623  and attr store1 > 122.686873623 ) or 
       bondedto (attr store1 < 76.147  and attr store1 > 74.947 ) or 
       bondedto (attr store1 < 28.4071263766  and attr store1 > 27.2071263766 ))) 
6 0.1 0.1 peak 359 volume 5.77640 ppm1 1.880 ppm2 3.891
 
! ############### hot_mothernoesy_072403.360 folded +
assi (attr store1 < 1.685 and attr store1 > 1.485 )
     ((attr store1 < 1.908 and attr store1 > 1.808 ) and 
      (bondedto (attr store1 < 123.859873623  and attr store1 > 122.659873623 ) or 
       bondedto (attr store1 < 76.12  and attr store1 > 74.92 ) or 
       bondedto (attr store1 < 28.3801263766  and attr store1 > 27.1801263766 ))) 
6 0.1 0.1 peak 360 volume 22.08490 ppm1 1.858 ppm2 1.585
 
! ############### hot_mothernoesy_072403.361 folded +
assi (attr store1 < 3.993 and attr store1 > 3.793 )
     ((attr store1 < 1.634 and attr store1 > 1.534 ) and 
      (bondedto (attr store1 < 123.815873623  and attr store1 > 122.615873623 ) or 
       bondedto (attr store1 < 76.076  and attr store1 > 74.876 ) or 
       bondedto (attr store1 < 28.3361263766  and attr store1 > 27.1361263766 ))) 
6 0.1 0.1 peak 361 volume 4.24130 ppm1 1.584 ppm2 3.893
 
! ############### hot_mothernoesy_072403.362 folded +
assi (attr store1 < 1.97 and attr store1 > 1.77 )
     ((attr store1 < 1.635 and attr store1 > 1.535 ) and 
      (bondedto (attr store1 < 123.827873623  and attr store1 > 122.627873623 ) or 
       bondedto (attr store1 < 76.088  and attr store1 > 74.888 ) or 
       bondedto (attr store1 < 28.3481263766  and attr store1 > 27.1481263766 ))) 
6 0.1 0.1 peak 362 volume 30.66930 ppm1 1.585 ppm2 1.870
 
! ############### hot_mothernoesy_072403.363 folded +
assi (attr store1 < 4.025 and attr store1 > 3.825 )
     ((attr store1 < 3.978 and attr store1 > 3.878 ) and 
      (bondedto (attr store1 < 123.753873623  and attr store1 > 122.553873623 ) or 
       bondedto (attr store1 < 76.014  and attr store1 > 74.814 ) or 
       bondedto (attr store1 < 28.2741263766  and attr store1 > 27.0741263766 ))) 
6 0.1 0.1 peak 363 volume 16.84030 ppm1 3.928 ppm2 3.925
 
! ############### hot_mothernoesy_072403.364 folded +
assi (attr store1 < 3.93 and attr store1 > 3.73 )
     ((attr store1 < 3.978 and attr store1 > 3.878 ) and 
      (bondedto (attr store1 < 123.740873623  and attr store1 > 122.540873623 ) or 
       bondedto (attr store1 < 76.001  and attr store1 > 74.801 ) or 
       bondedto (attr store1 < 28.2611263766  and attr store1 > 27.0611263766 ))) 
6 0.1 0.1 peak 364 volume 16.32440 ppm1 3.928 ppm2 3.830
 
! ############### hot_mothernoesy_072403.365 folded +
assi (attr store1 < 2.142 and attr store1 > 1.942 )
     ((attr store1 < 3.952 and attr store1 > 3.852 ) and 
      (bondedto (attr store1 < 123.754873623  and attr store1 > 122.554873623 ) or 
       bondedto (attr store1 < 76.015  and attr store1 > 74.815 ) or 
       bondedto (attr store1 < 28.2751263766  and attr store1 > 27.0751263766 ))) 
6 0.1 0.1 peak 365 volume 3.96950 ppm1 3.902 ppm2 2.042
 
! ############### hot_mothernoesy_072403.366 folded +
assi (attr store1 < 4.028 and attr store1 > 3.828 )
     ((attr store1 < 3.879 and attr store1 > 3.779 ) and 
      (bondedto (attr store1 < 123.729873623  and attr store1 > 122.529873623 ) or 
       bondedto (attr store1 < 75.99  and attr store1 > 74.79 ) or 
       bondedto (attr store1 < 28.2501263766  and attr store1 > 27.0501263766 ))) 
6 0.1 0.1 peak 366 volume 15.97280 ppm1 3.829 ppm2 3.928
 
! ############### hot_mothernoesy_072403.367 folded +
assi (attr store1 < 4.29 and attr store1 > 4.09 )
     ((attr store1 < 2.142 and attr store1 > 2.042 ) and 
      (bondedto (attr store1 < 123.739873623  and attr store1 > 122.539873623 ) or 
       bondedto (attr store1 < 76.0  and attr store1 > 74.8 ) or 
       bondedto (attr store1 < 28.2601263766  and attr store1 > 27.0601263766 ))) 
6 0.1 0.1 peak 367 volume 4.56420 ppm1 2.092 ppm2 4.190
 
! ############### hot_mothernoesy_072403.368 folded +
assi (attr store1 < 2.29 and attr store1 > 2.09 )
     ((attr store1 < 2.14 and attr store1 > 2.04 ) and 
      (bondedto (attr store1 < 123.735873623  and attr store1 > 122.535873623 ) or 
       bondedto (attr store1 < 75.996  and attr store1 > 74.796 ) or 
       bondedto (attr store1 < 28.2561263766  and attr store1 > 27.0561263766 ))) 
6 0.1 0.1 peak 368 volume 19.30940 ppm1 2.090 ppm2 2.190
 
! ############### hot_mothernoesy_072403.369 folded +
assi (attr store1 < 4.299 and attr store1 > 4.099 )
     ((attr store1 < 2.005 and attr store1 > 1.905 ) and 
      (bondedto (attr store1 < 123.713873623  and attr store1 > 122.513873623 ) or 
       bondedto (attr store1 < 75.974  and attr store1 > 74.774 ) or 
       bondedto (attr store1 < 28.2341263766  and attr store1 > 27.0341263766 ))) 
6 0.1 0.1 peak 369 volume 3.61060 ppm1 1.955 ppm2 4.199
 
! ############### hot_mothernoesy_072403.370 folded +
assi (attr store1 < 4.059 and attr store1 > 3.859 )
     ((attr store1 < 2.004 and attr store1 > 1.904 ) and 
      (bondedto (attr store1 < 123.713873623  and attr store1 > 122.513873623 ) or 
       bondedto (attr store1 < 75.974  and attr store1 > 74.774 ) or 
       bondedto (attr store1 < 28.2341263766  and attr store1 > 27.0341263766 ))) 
6 0.1 0.1 peak 370 volume 5.89790 ppm1 1.954 ppm2 3.959
 
! ############### hot_mothernoesy_072403.371 folded +
assi (attr store1 < 2.304 and attr store1 > 2.104 )
     ((attr store1 < 2.008 and attr store1 > 1.908 ) and 
      (bondedto (attr store1 < 123.713873623  and attr store1 > 122.513873623 ) or 
       bondedto (attr store1 < 75.974  and attr store1 > 74.774 ) or 
       bondedto (attr store1 < 28.2341263766  and attr store1 > 27.0341263766 ))) 
6 0.1 0.1 peak 371 volume 10.62880 ppm1 1.958 ppm2 2.204
 
! ############### hot_mothernoesy_072403.372 folded +
assi (attr store1 < 3.72 and attr store1 > 3.52 )
     ((attr store1 < 2.001 and attr store1 > 1.901 ) and 
      (bondedto (attr store1 < 123.710873623  and attr store1 > 122.510873623 ) or 
       bondedto (attr store1 < 75.971  and attr store1 > 74.771 ) or 
       bondedto (attr store1 < 28.2311263766  and attr store1 > 27.0311263766 ))) 
6 0.1 0.1 peak 372 volume 4.69260 ppm1 1.951 ppm2 3.620
 
! ############### hot_mothernoesy_072403.373 folded +
assi (attr store1 < 2.032 and attr store1 > 1.832 )
     ((attr store1 < 1.817 and attr store1 > 1.717 ) and 
      (bondedto (attr store1 < 123.689873623  and attr store1 > 122.489873623 ) or 
       bondedto (attr store1 < 75.95  and attr store1 > 74.75 ) or 
       bondedto (attr store1 < 28.2101263766  and attr store1 > 27.0101263766 ))) 
6 0.1 0.1 peak 373 volume 18.40970 ppm1 1.767 ppm2 1.932
 
! ############### hot_mothernoesy_072403.374 folded +
assi (attr store1 < 1.863 and attr store1 > 1.663 )
     ((attr store1 < 1.817 and attr store1 > 1.717 ) and 
      (bondedto (attr store1 < 123.690873623  and attr store1 > 122.490873623 ) or 
       bondedto (attr store1 < 75.951  and attr store1 > 74.751 ) or 
       bondedto (attr store1 < 28.2111263766  and attr store1 > 27.0111263766 ))) 
6 0.1 0.1 peak 374 volume 47.69700 ppm1 1.767 ppm2 1.763
 
! ############### hot_mothernoesy_072403.375 folded +
assi (attr store1 < 3.313 and attr store1 > 3.113 )
     ((attr store1 < 1.646 and attr store1 > 1.546 ) and 
      (bondedto (attr store1 < 123.733873623  and attr store1 > 122.533873623 ) or 
       bondedto (attr store1 < 75.994  and attr store1 > 74.794 ) or 
       bondedto (attr store1 < 28.2541263766  and attr store1 > 27.0541263766 ))) 
6 0.1 0.1 peak 375 volume 21.52960 ppm1 1.596 ppm2 3.213
 
! ############### hot_mothernoesy_072403.376 folded +
assi (attr store1 < 1.698 and attr store1 > 1.498 )
     ((attr store1 < 1.648 and attr store1 > 1.548 ) and 
      (bondedto (attr store1 < 123.723873623  and attr store1 > 122.523873623 ) or 
       bondedto (attr store1 < 75.984  and attr store1 > 74.784 ) or 
       bondedto (attr store1 < 28.2441263766  and attr store1 > 27.0441263766 ))) 
6 0.1 0.1 peak 376 volume 71.40810 ppm1 1.598 ppm2 1.598
 
! ############### hot_mothernoesy_072403.377 folded +
assi (attr store1 < 2.035 and attr store1 > 1.835 )
     ((attr store1 < 2.133 and attr store1 > 2.033 ) and 
      (bondedto (attr store1 < 123.655873623  and attr store1 > 122.455873623 ) or 
       bondedto (attr store1 < 75.916  and attr store1 > 74.716 ) or 
       bondedto (attr store1 < 28.1761263766  and attr store1 > 26.9761263766 ))) 
6 0.1 0.1 peak 377 volume 40.00230 ppm1 2.083 ppm2 1.935
 
! ############### hot_mothernoesy_072403.378 folded +
assi (attr store1 < 4.557 and attr store1 > 4.357 )
     ((attr store1 < 2.123 and attr store1 > 2.023 ) and 
      (bondedto (attr store1 < 123.619873623  and attr store1 > 122.419873623 ) or 
       bondedto (attr store1 < 75.88  and attr store1 > 74.68 ) or 
       bondedto (attr store1 < 28.1401263766  and attr store1 > 26.9401263766 ))) 
6 0.1 0.1 peak 378 volume 6.69530 ppm1 2.073 ppm2 4.457
 
! ############### hot_mothernoesy_072403.379 folded +
assi (attr store1 < 3.715 and attr store1 > 3.515 )
     ((attr store1 < 2.125 and attr store1 > 2.025 ) and 
      (bondedto (attr store1 < 123.627873623  and attr store1 > 122.427873623 ) or 
       bondedto (attr store1 < 75.888  and attr store1 > 74.688 ) or 
       bondedto (attr store1 < 28.1481263766  and attr store1 > 26.9481263766 ))) 
6 0.1 0.1 peak 379 volume 15.33350 ppm1 2.075 ppm2 3.615
 
! ############### hot_mothernoesy_072403.380 folded +
assi (attr store1 < 1.086 and attr store1 > 0.886 )
     ((attr store1 < 1.957 and attr store1 > 1.857 ) and 
      (bondedto (attr store1 < 123.593873623  and attr store1 > 122.393873623 ) or 
       bondedto (attr store1 < 75.854  and attr store1 > 74.654 ) or 
       bondedto (attr store1 < 28.1141263766  and attr store1 > 26.9141263766 ))) 
6 0.1 0.1 peak 380 volume 19.91590 ppm1 1.907 ppm2 0.986
 
! ############### hot_mothernoesy_072403.381 folded +
assi (attr store1 < 4.068 and attr store1 > 3.868 )
     ((attr store1 < 1.822 and attr store1 > 1.722 ) and 
      (bondedto (attr store1 < 123.659873623  and attr store1 > 122.459873623 ) or 
       bondedto (attr store1 < 75.92  and attr store1 > 74.72 ) or 
       bondedto (attr store1 < 28.1801263766  and attr store1 > 26.9801263766 ))) 
6 0.1 0.1 peak 381 volume 6.65990 ppm1 1.772 ppm2 3.968
 
! ############### hot_mothernoesy_072403.382 folded +
assi (attr store1 < 3.308 and attr store1 > 3.108 )
     ((attr store1 < 1.818 and attr store1 > 1.718 ) and 
      (bondedto (attr store1 < 123.675873623  and attr store1 > 122.475873623 ) or 
       bondedto (attr store1 < 75.936  and attr store1 > 74.736 ) or 
       bondedto (attr store1 < 28.1961263766  and attr store1 > 26.9961263766 ))) 
6 0.1 0.1 peak 382 volume 13.40340 ppm1 1.768 ppm2 3.208
 
! ############### hot_mothernoesy_072403.383 folded +
assi (attr store1 < 1.706 and attr store1 > 1.506 )
     ((attr store1 < 1.819 and attr store1 > 1.719 ) and 
      (bondedto (attr store1 < 123.664873623  and attr store1 > 122.464873623 ) or 
       bondedto (attr store1 < 75.925  and attr store1 > 74.725 ) or 
       bondedto (attr store1 < 28.1851263766  and attr store1 > 26.9851263766 ))) 
6 0.1 0.1 peak 383 volume 30.70570 ppm1 1.769 ppm2 1.606
 
! ############### hot_mothernoesy_072403.384 folded +
assi (attr store1 < 1.871 and attr store1 > 1.671 )
     ((attr store1 < 1.655 and attr store1 > 1.555 ) and 
      (bondedto (attr store1 < 123.664873623  and attr store1 > 122.464873623 ) or 
       bondedto (attr store1 < 75.925  and attr store1 > 74.725 ) or 
       bondedto (attr store1 < 28.1851263766  and attr store1 > 26.9851263766 ))) 
6 0.1 0.1 peak 384 volume 31.64940 ppm1 1.605 ppm2 1.771
 
! ############### hot_mothernoesy_072403.385 folded +
assi (attr store1 < 4.065 and attr store1 > 3.865 )
     ((attr store1 < 1.65 and attr store1 > 1.55 ) and 
      (bondedto (attr store1 < 123.666873623  and attr store1 > 122.466873623 ) or 
       bondedto (attr store1 < 75.927  and attr store1 > 74.727 ) or 
       bondedto (attr store1 < 28.1871263766  and attr store1 > 26.9871263766 ))) 
6 0.1 0.1 peak 385 volume 7.34240 ppm1 1.600 ppm2 3.965
 
! ############### hot_mothernoesy_072403.386 folded +
assi (attr store1 < 4.126 and attr store1 > 3.926 )
     ((attr store1 < 1.231 and attr store1 > 1.131 ) and 
      (bondedto (attr store1 < 123.606873623  and attr store1 > 122.406873623 ) or 
       bondedto (attr store1 < 75.867  and attr store1 > 74.667 ) or 
       bondedto (attr store1 < 28.1271263766  and attr store1 > 26.9271263766 ))) 
6 0.1 0.1 peak 386 volume 5.78940 ppm1 1.181 ppm2 4.026
 
! ############### hot_mothernoesy_072403.387 folded +
assi (attr store1 < 4.762 and attr store1 > 4.562 )
     ((attr store1 < 2.108 and attr store1 > 2.008 ) and 
      (bondedto (attr store1 < 123.562873623  and attr store1 > 122.362873623 ) or 
       bondedto (attr store1 < 75.823  and attr store1 > 74.623 ) or 
       bondedto (attr store1 < 28.0831263766  and attr store1 > 26.8831263766 ))) 
6 0.1 0.1 peak 387 volume 3.47150 ppm1 2.058 ppm2 4.662
 
! ############### hot_mothernoesy_072403.388 folded +
assi (attr store1 < 4.76 and attr store1 > 4.56 )
     ((attr store1 < 2.091 and attr store1 > 1.991 ) and 
      (bondedto (attr store1 < 123.586873623  and attr store1 > 122.386873623 ) or 
       bondedto (attr store1 < 75.847  and attr store1 > 74.647 ) or 
       bondedto (attr store1 < 28.1071263766  and attr store1 > 26.9071263766 ))) 
6 0.1 0.1 peak 388 volume 3.56080 ppm1 2.041 ppm2 4.660
 
! ############### hot_mothernoesy_072403.389 folded +
assi (attr store1 < 4.139 and attr store1 > 3.939 )
     ((attr store1 < 1.958 and attr store1 > 1.858 ) and 
      (bondedto (attr store1 < 123.570873623  and attr store1 > 122.370873623 ) or 
       bondedto (attr store1 < 75.831  and attr store1 > 74.631 ) or 
       bondedto (attr store1 < 28.0911263766  and attr store1 > 26.8911263766 ))) 
6 0.1 0.1 peak 389 volume 4.28920 ppm1 1.908 ppm2 4.039
 
! ############### hot_mothernoesy_072403.390 folded +
assi (attr store1 < 1.279 and attr store1 > 1.079 )
     ((attr store1 < 1.928 and attr store1 > 1.828 ) and 
      (bondedto (attr store1 < 123.582873623  and attr store1 > 122.382873623 ) or 
       bondedto (attr store1 < 75.843  and attr store1 > 74.643 ) or 
       bondedto (attr store1 < 28.1031263766  and attr store1 > 26.9031263766 ))) 
6 0.1 0.1 peak 390 volume 6.96330 ppm1 1.878 ppm2 1.179
 
! ############### hot_mothernoesy_072403.391 folded +
assi (attr store1 < 4.123 and attr store1 > 3.923 )
     ((attr store1 < 1.502 and attr store1 > 1.402 ) and 
      (bondedto (attr store1 < 123.571873623  and attr store1 > 122.371873623 ) or 
       bondedto (attr store1 < 75.832  and attr store1 > 74.632 ) or 
       bondedto (attr store1 < 28.0921263766  and attr store1 > 26.8921263766 ))) 
6 0.1 0.1 peak 391 volume 5.35070 ppm1 1.452 ppm2 4.023
 
! ############### hot_mothernoesy_072403.392 folded +
assi (attr store1 < 1.976 and attr store1 > 1.776 )
     ((attr store1 < 1.5 and attr store1 > 1.4 ) and 
      (bondedto (attr store1 < 123.511873623  and attr store1 > 122.311873623 ) or 
       bondedto (attr store1 < 75.772  and attr store1 > 74.572 ) or 
       bondedto (attr store1 < 28.0321263766  and attr store1 > 26.8321263766 ))) 
6 0.1 0.1 peak 392 volume 11.04880 ppm1 1.450 ppm2 1.876
 
! ############### hot_mothernoesy_072403.393 folded +
assi (attr store1 < 1.551 and attr store1 > 1.351 )
     ((attr store1 < 1.5 and attr store1 > 1.4 ) and 
      (bondedto (attr store1 < 123.581873623  and attr store1 > 122.381873623 ) or 
       bondedto (attr store1 < 75.842  and attr store1 > 74.642 ) or 
       bondedto (attr store1 < 28.1021263766  and attr store1 > 26.9021263766 ))) 
6 0.1 0.1 peak 393 volume 182.95230 ppm1 1.450 ppm2 1.451
 
! ############### hot_mothernoesy_072403.394 folded +
assi (attr store1 < 1.282 and attr store1 > 1.082 )
     ((attr store1 < 1.501 and attr store1 > 1.401 ) and 
      (bondedto (attr store1 < 123.555873623  and attr store1 > 122.355873623 ) or 
       bondedto (attr store1 < 75.816  and attr store1 > 74.616 ) or 
       bondedto (attr store1 < 28.0761263766  and attr store1 > 26.8761263766 ))) 
6 0.1 0.1 peak 394 volume 87.53030 ppm1 1.451 ppm2 1.182
 
! ############### hot_mothernoesy_072403.395 folded +
assi (attr store1 < 0.976 and attr store1 > 0.776 )
     ((attr store1 < 1.501 and attr store1 > 1.401 ) and 
      (bondedto (attr store1 < 123.583873623  and attr store1 > 122.383873623 ) or 
       bondedto (attr store1 < 75.844  and attr store1 > 74.644 ) or 
       bondedto (attr store1 < 28.1041263766  and attr store1 > 26.9041263766 ))) 
6 0.1 0.1 peak 395 volume 25.51500 ppm1 1.451 ppm2 0.876
 
! ############### hot_mothernoesy_072403.396 folded +
assi (attr store1 < 1.973 and attr store1 > 1.773 )
     ((attr store1 < 1.234 and attr store1 > 1.134 ) and 
      (bondedto (attr store1 < 123.553873623  and attr store1 > 122.353873623 ) or 
       bondedto (attr store1 < 75.814  and attr store1 > 74.614 ) or 
       bondedto (attr store1 < 28.0741263766  and attr store1 > 26.8741263766 ))) 
6 0.1 0.1 peak 396 volume 7.39810 ppm1 1.184 ppm2 1.873
 
! ############### hot_mothernoesy_072403.397 folded +
assi (attr store1 < 1.551 and attr store1 > 1.351 )
     ((attr store1 < 1.232 and attr store1 > 1.132 ) and 
      (bondedto (attr store1 < 123.556873623  and attr store1 > 122.356873623 ) or 
       bondedto (attr store1 < 75.817  and attr store1 > 74.617 ) or 
       bondedto (attr store1 < 28.0771263766  and attr store1 > 26.8771263766 ))) 
6 0.1 0.1 peak 397 volume 76.78340 ppm1 1.182 ppm2 1.451
 
! ############### hot_mothernoesy_072403.398 folded +
assi (attr store1 < 1.281 and attr store1 > 1.081 )
     ((attr store1 < 1.231 and attr store1 > 1.131 ) and 
      (bondedto (attr store1 < 123.563873623  and attr store1 > 122.363873623 ) or 
       bondedto (attr store1 < 75.824  and attr store1 > 74.624 ) or 
       bondedto (attr store1 < 28.0841263766  and attr store1 > 26.8841263766 ))) 
6 0.1 0.1 peak 398 volume 195.05740 ppm1 1.181 ppm2 1.181
 
! ############### hot_mothernoesy_072403.399 folded +
assi (attr store1 < 0.98 and attr store1 > 0.78 )
     ((attr store1 < 1.23 and attr store1 > 1.13 ) and 
      (bondedto (attr store1 < 123.558873623  and attr store1 > 122.358873623 ) or 
       bondedto (attr store1 < 75.819  and attr store1 > 74.619 ) or 
       bondedto (attr store1 < 28.0791263766  and attr store1 > 26.8791263766 ))) 
6 0.1 0.1 peak 399 volume 30.54190 ppm1 1.180 ppm2 0.880
 
! ############### hot_mothernoesy_072403.400 folded +
assi (attr store1 < 4.021 and attr store1 > 3.821 )
     ((attr store1 < 2.089 and attr store1 > 1.989 ) and 
      (bondedto (attr store1 < 123.442873623  and attr store1 > 122.242873623 ) or 
       bondedto (attr store1 < 75.703  and attr store1 > 74.503 ) or 
       bondedto (attr store1 < 27.9631263766  and attr store1 > 26.7631263766 ))) 
6 0.1 0.1 peak 400 volume 24.16490 ppm1 2.039 ppm2 3.921
 
! ############### hot_mothernoesy_072403.401 folded +
assi (attr store1 < 3.928 and attr store1 > 3.728 )
     ((attr store1 < 2.088 and attr store1 > 1.988 ) and 
      (bondedto (attr store1 < 123.405873623  and attr store1 > 122.205873623 ) or 
       bondedto (attr store1 < 75.666  and attr store1 > 74.466 ) or 
       bondedto (attr store1 < 27.9261263766  and attr store1 > 26.7261263766 ))) 
6 0.1 0.1 peak 401 volume 15.00410 ppm1 2.038 ppm2 3.828
 
! ############### hot_mothernoesy_072403.403 folded +
assi (attr store1 < 1.131 and attr store1 > 0.931 )
     ((attr store1 < 1.116 and attr store1 > 1.016 ) and 
      (bondedto (attr store1 < 123.420873623  and attr store1 > 122.220873623 ) or 
       bondedto (attr store1 < 75.681  and attr store1 > 74.481 ) or 
       bondedto (attr store1 < 27.9411263766  and attr store1 > 26.7411263766 ))) 
6 0.1 0.1 peak 403 volume 11.87480 ppm1 1.066 ppm2 1.031
 
! ############### hot_mothernoesy_072403.404 folded -
assi (attr store1 < 1.126 and attr store1 > 0.926 )
     ((attr store1 < 4.0 and attr store1 > 3.9 ) and 
      (bondedto (attr store1 < 147.278810435  and attr store1 > 146.078810435 ) or 
       bondedto (attr store1 < 51.7990631883  and attr store1 > 50.5990631883 ))) 
6 0.1 0.1 peak 404 volume 5.7646 ppm1 3.950 ppm2 1.026
 
! ############### hot_mothernoesy_072403.405 folded -
assi (attr store1 < 4.056 and attr store1 > 3.856 )
     ((attr store1 < 3.678 and attr store1 > 3.578 ) and 
      (bondedto (attr store1 < 147.276810435  and attr store1 > 146.076810435 ) or 
       bondedto (attr store1 < 51.7970631883  and attr store1 > 50.5970631883 ))) 
6 0.1 0.1 peak 405 volume 10.5088 ppm1 3.628 ppm2 3.956
 
! ############### hot_mothernoesy_072403.406 folded -
assi (attr store1 < 1.126 and attr store1 > 0.926 )
     ((attr store1 < 3.675 and attr store1 > 3.575 ) and 
      (bondedto (attr store1 < 147.277810435  and attr store1 > 146.077810435 ) or 
       bondedto (attr store1 < 51.7980631883  and attr store1 > 50.5980631883 ))) 
6 0.1 0.1 peak 406 volume 7.6032 ppm1 3.625 ppm2 1.026
 
! ############### hot_mothernoesy_072403.407 folded +
assi (attr store1 < 2.011 and attr store1 > 1.811 )
     ((attr store1 < 2.089 and attr store1 > 1.989 ) and 
      (bondedto (attr store1 < 123.319873623  and attr store1 > 122.119873623 ) or 
       bondedto (attr store1 < 75.58  and attr store1 > 74.38 ) or 
       bondedto (attr store1 < 27.8401263766  and attr store1 > 26.6401263766 ))) 
6 0.1 0.1 peak 407 volume 65.29450 ppm1 2.039 ppm2 1.911
 
! ############### hot_mothernoesy_072403.408 folded +
assi (attr store1 < 2.134 and attr store1 > 1.934 )
     ((attr store1 < 1.964 and attr store1 > 1.864 ) and 
      (bondedto (attr store1 < 123.357873623  and attr store1 > 122.157873623 ) or 
       bondedto (attr store1 < 75.618  and attr store1 > 74.418 ) or 
       bondedto (attr store1 < 27.8781263766  and attr store1 > 26.6781263766 ))) 
6 0.1 0.1 peak 408 volume 29.92680 ppm1 1.914 ppm2 2.034
 
! ############### hot_mothernoesy_072403.409 folded +
assi (attr store1 < 1.102 and attr store1 > 0.902 )
     ((attr store1 < 1.629 and attr store1 > 1.529 ) and 
      (bondedto (attr store1 < 123.393873623  and attr store1 > 122.193873623 ) or 
       bondedto (attr store1 < 75.654  and attr store1 > 74.454 ) or 
       bondedto (attr store1 < 27.9141263766  and attr store1 > 26.7141263766 ))) 
6 0.1 0.1 peak 409 volume 12.43010 ppm1 1.579 ppm2 1.002
 
! ############### hot_mothernoesy_072403.412 folded +
assi (attr store1 < 1.676 and attr store1 > 1.476 )
     ((attr store1 < 1.285 and attr store1 > 1.185 ) and 
      (bondedto (attr store1 < 123.400873623  and attr store1 > 122.200873623 ) or 
       bondedto (attr store1 < 75.661  and attr store1 > 74.461 ) or 
       bondedto (attr store1 < 27.9211263766  and attr store1 > 26.7211263766 ))) 
6 0.1 0.1 peak 412 volume 4.71620 ppm1 1.235 ppm2 1.576
 
! ############### hot_mothernoesy_072403.413 folded +
assi (attr store1 < 1.674 and attr store1 > 1.474 )
     ((attr store1 < 1.127 and attr store1 > 1.027 ) and 
      (bondedto (attr store1 < 123.398873623  and attr store1 > 122.198873623 ) or 
       bondedto (attr store1 < 75.659  and attr store1 > 74.459 ) or 
       bondedto (attr store1 < 27.9191263766  and attr store1 > 26.7191263766 ))) 
6 0.1 0.1 peak 413 volume 9.23690 ppm1 1.077 ppm2 1.574
 
! ############### hot_mothernoesy_072403.414 folded -
assi (attr store1 < 4.515 and attr store1 > 4.315 )
     ((attr store1 < 3.999 and attr store1 > 3.899 ) and 
      (bondedto (attr store1 < 147.210810435  and attr store1 > 146.010810435 ) or 
       bondedto (attr store1 < 51.7310631883  and attr store1 > 50.5310631883 ))) 
6 0.1 0.1 peak 414 volume 8.263 ppm1 3.949 ppm2 4.415
 
! ############### hot_mothernoesy_072403.415 folded -
assi (attr store1 < 3.725 and attr store1 > 3.525 )
     ((attr store1 < 4.001 and attr store1 > 3.901 ) and 
      (bondedto (attr store1 < 147.268810435  and attr store1 > 146.068810435 ) or 
       bondedto (attr store1 < 51.7890631883  and attr store1 > 50.5890631883 ))) 
6 0.1 0.1 peak 415 volume 10.0646 ppm1 3.951 ppm2 3.625
 
! ############### hot_mothernoesy_072403.416 folded -
assi (attr store1 < 4.518 and attr store1 > 4.318 )
     ((attr store1 < 3.676 and attr store1 > 3.576 ) and 
      (bondedto (attr store1 < 147.267810435  and attr store1 > 146.067810435 ) or 
       bondedto (attr store1 < 51.7880631883  and attr store1 > 50.5880631883 ))) 
6 0.1 0.1 peak 416 volume 8.0212 ppm1 3.626 ppm2 4.418
 
! ############### hot_mothernoesy_072403.417 folded -
assi (attr store1 < 2.053 and attr store1 > 1.853 )
     ((attr store1 < 3.676 and attr store1 > 3.576 ) and 
      (bondedto (attr store1 < 147.261810435  and attr store1 > 146.061810435 ) or 
       bondedto (attr store1 < 51.7820631883  and attr store1 > 50.5820631883 ))) 
6 0.1 0.1 peak 417 volume 5.1152 ppm1 3.626 ppm2 1.953
 
! ############### hot_mothernoesy_072403.418 folded +
assi (attr store1 < 4.507 and attr store1 > 4.307 )
     ((attr store1 < 2.087 and attr store1 > 1.987 ) and 
      (bondedto (attr store1 < 123.286873623  and attr store1 > 122.086873623 ) or 
       bondedto (attr store1 < 75.547  and attr store1 > 74.347 ) or 
       bondedto (attr store1 < 27.8071263766  and attr store1 > 26.6071263766 ))) 
6 0.1 0.1 peak 418 volume 9.09670 ppm1 2.037 ppm2 4.407
 
! ############### hot_mothernoesy_072403.419 folded +
assi (attr store1 < 2.401 and attr store1 > 2.201 )
     ((attr store1 < 2.088 and attr store1 > 1.988 ) and 
      (bondedto (attr store1 < 123.291873623  and attr store1 > 122.091873623 ) or 
       bondedto (attr store1 < 75.552  and attr store1 > 74.352 ) or 
       bondedto (attr store1 < 27.8121263766  and attr store1 > 26.6121263766 ))) 
6 0.1 0.1 peak 419 volume 65.55980 ppm1 2.038 ppm2 2.301
 
! ############### hot_mothernoesy_072403.420 folded +
assi (attr store1 < 2.138 and attr store1 > 1.938 )
     ((attr store1 < 2.087 and attr store1 > 1.987 ) and 
      (bondedto (attr store1 < 123.272873623  and attr store1 > 122.072873623 ) or 
       bondedto (attr store1 < 75.533  and attr store1 > 74.333 ) or 
       bondedto (attr store1 < 27.7931263766  and attr store1 > 26.5931263766 ))) 
6 0.1 0.1 peak 420 volume 870.34711 ppm1 2.037 ppm2 2.038
 
! ############### hot_mothernoesy_072403.421 folded -
assi (attr store1 < 2.01 and attr store1 > 1.81 )
     ((attr store1 < 3.988 and attr store1 > 3.888 ) and 
      (bondedto (attr store1 < 147.089810435  and attr store1 > 145.889810435 ) or 
       bondedto (attr store1 < 51.6100631883  and attr store1 > 50.4100631883 ))) 
6 0.1 0.1 peak 421 volume 5.6144 ppm1 3.938 ppm2 1.910
 
! ############### hot_mothernoesy_072403.422 folded +
assi (attr store1 < 2.436 and attr store1 > 2.236 )
     ((attr store1 < 1.494 and attr store1 > 1.394 ) and 
      (bondedto (attr store1 < 123.213873623  and attr store1 > 122.013873623 ) or 
       bondedto (attr store1 < 75.474  and attr store1 > 74.274 ) or 
       bondedto (attr store1 < 27.7341263766  and attr store1 > 26.5341263766 ))) 
6 0.1 0.1 peak 422 volume 3.48790 ppm1 1.444 ppm2 2.336
 
! ############### hot_mothernoesy_072403.423 folded +
assi (attr store1 < 0.854 and attr store1 > 0.654 )
     ((attr store1 < 1.491 and attr store1 > 1.391 ) and 
      (bondedto (attr store1 < 123.177873623  and attr store1 > 121.977873623 ) or 
       bondedto (attr store1 < 75.438  and attr store1 > 74.238 ) or 
       bondedto (attr store1 < 27.6981263766  and attr store1 > 26.4981263766 ))) 
6 0.1 0.1 peak 423 volume 13.54540 ppm1 1.441 ppm2 0.754
 
! ############### hot_mothernoesy_072403.424 folded +
assi (attr store1 < 1.019 and attr store1 > 0.819 )
     ((attr store1 < 1.072 and attr store1 > 0.972 ) and 
      (bondedto (attr store1 < 123.179873623  and attr store1 > 121.979873623 ) or 
       bondedto (attr store1 < 75.44  and attr store1 > 74.24 ) or 
       bondedto (attr store1 < 27.7001263766  and attr store1 > 26.5001263766 ))) 
6 0.1 0.1 peak 424 volume 5.78700 ppm1 1.022 ppm2 0.919
 
! ############### hot_mothernoesy_072403.425 folded +
assi (attr store1 < 3.959 and attr store1 > 3.759 )
     ((attr store1 < 0.978 and attr store1 > 0.878 ) and 
      (bondedto (attr store1 < 123.154873623  and attr store1 > 121.954873623 ) or 
       bondedto (attr store1 < 75.415  and attr store1 > 74.215 ) or 
       bondedto (attr store1 < 27.6751263766  and attr store1 > 26.4751263766 ))) 
6 0.1 0.1 peak 425 volume 8.42520 ppm1 0.928 ppm2 3.859
 
! ############### hot_mothernoesy_072403.426 folded +
assi (attr store1 < 3.47 and attr store1 > 3.27 )
     ((attr store1 < 0.981 and attr store1 > 0.881 ) and 
      (bondedto (attr store1 < 123.163873623  and attr store1 > 121.963873623 ) or 
       bondedto (attr store1 < 75.424  and attr store1 > 74.224 ) or 
       bondedto (attr store1 < 27.6841263766  and attr store1 > 26.4841263766 ))) 
6 0.1 0.1 peak 426 volume 3.71860 ppm1 0.931 ppm2 3.370
 
! ############### hot_mothernoesy_072403.427 folded +
assi (attr store1 < 2.93 and attr store1 > 2.73 )
     ((attr store1 < 0.98 and attr store1 > 0.88 ) and 
      (bondedto (attr store1 < 123.157873623  and attr store1 > 121.957873623 ) or 
       bondedto (attr store1 < 75.418  and attr store1 > 74.218 ) or 
       bondedto (attr store1 < 27.6781263766  and attr store1 > 26.4781263766 ))) 
6 0.1 0.1 peak 427 volume 7.08390 ppm1 0.930 ppm2 2.830
 
! ############### hot_mothernoesy_072403.428 folded +
assi (attr store1 < 2.612 and attr store1 > 2.412 )
     ((attr store1 < 0.979 and attr store1 > 0.879 ) and 
      (bondedto (attr store1 < 123.152873623  and attr store1 > 121.952873623 ) or 
       bondedto (attr store1 < 75.413  and attr store1 > 74.213 ) or 
       bondedto (attr store1 < 27.6731263766  and attr store1 > 26.4731263766 ))) 
6 0.1 0.1 peak 428 volume 11.16310 ppm1 0.929 ppm2 2.512
 
! ############### hot_mothernoesy_072403.429 folded +
assi (attr store1 < 2.418 and attr store1 > 2.218 )
     ((attr store1 < 0.978 and attr store1 > 0.878 ) and 
      (bondedto (attr store1 < 123.167873623  and attr store1 > 121.967873623 ) or 
       bondedto (attr store1 < 75.428  and attr store1 > 74.228 ) or 
       bondedto (attr store1 < 27.6881263766  and attr store1 > 26.4881263766 ))) 
6 0.1 0.1 peak 429 volume 5.29760 ppm1 0.928 ppm2 2.318
 
! ############### hot_mothernoesy_072403.430 folded +
assi (attr store1 < 2.229 and attr store1 > 2.029 )
     ((attr store1 < 0.977 and attr store1 > 0.877 ) and 
      (bondedto (attr store1 < 123.136873623  and attr store1 > 121.936873623 ) or 
       bondedto (attr store1 < 75.397  and attr store1 > 74.197 ) or 
       bondedto (attr store1 < 27.6571263766  and attr store1 > 26.4571263766 ))) 
6 0.1 0.1 peak 430 volume 10.72810 ppm1 0.927 ppm2 2.129
 
! ############### hot_mothernoesy_072403.431 folded +
assi (attr store1 < 1.731 and attr store1 > 1.531 )
     ((attr store1 < 0.979 and attr store1 > 0.879 ) and 
      (bondedto (attr store1 < 123.134873623  and attr store1 > 121.934873623 ) or 
       bondedto (attr store1 < 75.395  and attr store1 > 74.195 ) or 
       bondedto (attr store1 < 27.6551263766  and attr store1 > 26.4551263766 ))) 
6 0.1 0.1 peak 431 volume 28.65850 ppm1 0.929 ppm2 1.631
 
! ############### hot_mothernoesy_072403.432 folded +
assi (attr store1 < 1.632 and attr store1 > 1.432 )
     ((attr store1 < 0.977 and attr store1 > 0.877 ) and 
      (bondedto (attr store1 < 123.146873623  and attr store1 > 121.946873623 ) or 
       bondedto (attr store1 < 75.407  and attr store1 > 74.207 ) or 
       bondedto (attr store1 < 27.6671263766  and attr store1 > 26.4671263766 ))) 
6 0.1 0.1 peak 432 volume 27.83120 ppm1 0.927 ppm2 1.532
 
! ############### hot_mothernoesy_072403.433 folded +
assi (attr store1 < 1.026 and attr store1 > 0.826 )
     ((attr store1 < 0.977 and attr store1 > 0.877 ) and 
      (bondedto (attr store1 < 123.157873623  and attr store1 > 121.957873623 ) or 
       bondedto (attr store1 < 75.418  and attr store1 > 74.218 ) or 
       bondedto (attr store1 < 27.6781263766  and attr store1 > 26.4781263766 ))) 
6 0.1 0.1 peak 433 volume 184.80409 ppm1 0.927 ppm2 0.926
 
! ############### hot_mothernoesy_072403.434 folded +
assi (attr store1 < 0.921 and attr store1 > 0.721 )
     ((attr store1 < 0.977 and attr store1 > 0.877 ) and 
      (bondedto (attr store1 < 123.144873623  and attr store1 > 121.944873623 ) or 
       bondedto (attr store1 < 75.405  and attr store1 > 74.205 ) or 
       bondedto (attr store1 < 27.6651263766  and attr store1 > 26.4651263766 ))) 
6 0.1 0.1 peak 434 volume 42.77300 ppm1 0.927 ppm2 0.821
 
! ############### hot_mothernoesy_072403.437 folded +
assi (attr store1 < 1.357 and attr store1 > 1.157 )
     ((attr store1 < 0.804 and attr store1 > 0.704 ) and 
      (bondedto (attr store1 < 123.162873623  and attr store1 > 121.962873623 ) or 
       bondedto (attr store1 < 75.423  and attr store1 > 74.223 ) or 
       bondedto (attr store1 < 27.6831263766  and attr store1 > 26.4831263766 ))) 
6 0.1 0.1 peak 437 volume 4.71690 ppm1 0.754 ppm2 1.257
 
! ############### hot_mothernoesy_072403.438 folded +
assi (attr store1 < 1.932 and attr store1 > 1.732 )
     ((attr store1 < 0.8 and attr store1 > 0.7 ) and 
      (bondedto (attr store1 < 123.170873623  and attr store1 > 121.970873623 ) or 
       bondedto (attr store1 < 75.431  and attr store1 > 74.231 ) or 
       bondedto (attr store1 < 27.6911263766  and attr store1 > 26.4911263766 ))) 
6 0.1 0.1 peak 438 volume 5.91650 ppm1 0.750 ppm2 1.832
 
! ############### hot_mothernoesy_072403.439 folded +
assi (attr store1 < 1.541 and attr store1 > 1.341 )
     ((attr store1 < 0.803 and attr store1 > 0.703 ) and 
      (bondedto (attr store1 < 123.176873623  and attr store1 > 121.976873623 ) or 
       bondedto (attr store1 < 75.437  and attr store1 > 74.237 ) or 
       bondedto (attr store1 < 27.6971263766  and attr store1 > 26.4971263766 ))) 
6 0.1 0.1 peak 439 volume 12.97710 ppm1 0.753 ppm2 1.441
 
! ############### hot_mothernoesy_072403.440 folded +
assi (attr store1 < 0.856 and attr store1 > 0.656 )
     ((attr store1 < 0.802 and attr store1 > 0.702 ) and 
      (bondedto (attr store1 < 123.187873623  and attr store1 > 121.987873623 ) or 
       bondedto (attr store1 < 75.448  and attr store1 > 74.248 ) or 
       bondedto (attr store1 < 27.7081263766  and attr store1 > 26.5081263766 ))) 
6 0.1 0.1 peak 440 volume 17.67630 ppm1 0.752 ppm2 0.756
 
! ############### hot_mothernoesy_072403.441 folded -
assi (attr store1 < 5.006 and attr store1 > 4.806 )
     ((attr store1 < 3.979 and attr store1 > 3.879 ) and 
      (bondedto (attr store1 < 147.024810435  and attr store1 > 145.824810435 ) or 
       bondedto (attr store1 < 51.5450631883  and attr store1 > 50.3450631883 ))) 
6 0.1 0.1 peak 441 volume 37.0844 ppm1 3.929 ppm2 4.906
 
! ############### hot_mothernoesy_072403.442 folded -
assi (attr store1 < 4.03 and attr store1 > 3.83 )
     ((attr store1 < 3.979 and attr store1 > 3.879 ) and 
      (bondedto (attr store1 < 147.019810435  and attr store1 > 145.819810435 ) or 
       bondedto (attr store1 < 51.5400631883  and attr store1 > 50.3400631883 ))) 
6 0.1 0.1 peak 442 volume 240.6219 ppm1 3.929 ppm2 3.930
 
! ############### hot_mothernoesy_072403.443 folded -
assi (attr store1 < 3.929 and attr store1 > 3.729 )
     ((attr store1 < 3.978 and attr store1 > 3.878 ) and 
      (bondedto (attr store1 < 147.024810435  and attr store1 > 145.824810435 ) or 
       bondedto (attr store1 < 51.5450631883  and attr store1 > 50.3450631883 ))) 
6 0.1 0.1 peak 443 volume 186.1299 ppm1 3.928 ppm2 3.829
 
! ############### hot_mothernoesy_072403.444 folded -
assi (attr store1 < 2.909 and attr store1 > 2.709 )
     ((attr store1 < 3.977 and attr store1 > 3.877 ) and 
      (bondedto (attr store1 < 147.022810435  and attr store1 > 145.822810435 ) or 
       bondedto (attr store1 < 51.5430631883  and attr store1 > 50.3430631883 ))) 
6 0.1 0.1 peak 444 volume 4.0469 ppm1 3.927 ppm2 2.809
 
! ############### hot_mothernoesy_072403.445 folded -
assi (attr store1 < 5.006 and attr store1 > 4.806 )
     ((attr store1 < 3.879 and attr store1 > 3.779 ) and 
      (bondedto (attr store1 < 147.017810435  and attr store1 > 145.817810435 ) or 
       bondedto (attr store1 < 51.5380631883  and attr store1 > 50.3380631883 ))) 
6 0.1 0.1 peak 445 volume 36.5951 ppm1 3.829 ppm2 4.906
 
! ############### hot_mothernoesy_072403.446 folded -
assi (attr store1 < 4.028 and attr store1 > 3.828 )
     ((attr store1 < 3.879 and attr store1 > 3.779 ) and 
      (bondedto (attr store1 < 147.024810435  and attr store1 > 145.824810435 ) or 
       bondedto (attr store1 < 51.5450631883  and attr store1 > 50.3450631883 ))) 
6 0.1 0.1 peak 446 volume 178.4529 ppm1 3.829 ppm2 3.928
 
! ############### hot_mothernoesy_072403.447 folded -
assi (attr store1 < 2.907 and attr store1 > 2.707 )
     ((attr store1 < 3.878 and attr store1 > 3.778 ) and 
      (bondedto (attr store1 < 147.022810435  and attr store1 > 145.822810435 ) or 
       bondedto (attr store1 < 51.5430631883  and attr store1 > 50.3430631883 ))) 
6 0.1 0.1 peak 447 volume 4.6166 ppm1 3.828 ppm2 2.807
 
! ############### hot_mothernoesy_072403.448 folded -
assi (attr store1 < 2.005 and attr store1 > 1.805 )
     ((attr store1 < 3.878 and attr store1 > 3.778 ) and 
      (bondedto (attr store1 < 147.011810435  and attr store1 > 145.811810435 ) or 
       bondedto (attr store1 < 51.5320631883  and attr store1 > 50.3320631883 ))) 
6 0.1 0.1 peak 448 volume 5.0122 ppm1 3.828 ppm2 1.905
 
! ############### hot_mothernoesy_072403.449 folded -
assi (attr store1 < 2.4 and attr store1 > 2.2 )
     ((attr store1 < 3.875 and attr store1 > 3.775 ) and 
      (bondedto (attr store1 < 147.010810435  and attr store1 > 145.810810435 ) or 
       bondedto (attr store1 < 51.5310631883  and attr store1 > 50.3310631883 ))) 
6 0.1 0.1 peak 449 volume 4.376 ppm1 3.825 ppm2 2.300
 
! ############### hot_mothernoesy_072403.450 folded +
assi (attr store1 < 5.175 and attr store1 > 4.975 )
     ((attr store1 < 0.979 and attr store1 > 0.879 ) and 
      (bondedto (attr store1 < 123.117873623  and attr store1 > 121.917873623 ) or 
       bondedto (attr store1 < 75.378  and attr store1 > 74.178 ) or 
       bondedto (attr store1 < 27.6381263766  and attr store1 > 26.4381263766 ))) 
6 0.1 0.1 peak 450 volume 4.53310 ppm1 0.929 ppm2 5.075
 
! ############### hot_mothernoesy_072403.451 folded +
assi (attr store1 < 2.105 and attr store1 > 1.905 )
     ((attr store1 < 0.977 and attr store1 > 0.877 ) and 
      (bondedto (attr store1 < 123.116873623  and attr store1 > 121.916873623 ) or 
       bondedto (attr store1 < 75.377  and attr store1 > 74.177 ) or 
       bondedto (attr store1 < 27.6371263766  and attr store1 > 26.4371263766 ))) 
6 0.1 0.1 peak 451 volume 7.23550 ppm1 0.927 ppm2 2.005
 
! ############### hot_mothernoesy_072403.452 folded +
assi (attr store1 < 1.827 and attr store1 > 1.627 )
     ((attr store1 < 0.965 and attr store1 > 0.865 ) and 
      (bondedto (attr store1 < 123.094873623  and attr store1 > 121.894873623 ) or 
       bondedto (attr store1 < 75.355  and attr store1 > 74.155 ) or 
       bondedto (attr store1 < 27.6151263766  and attr store1 > 26.4151263766 ))) 
6 0.1 0.1 peak 452 volume 9.05030 ppm1 0.915 ppm2 1.727
 
! ############### hot_mothernoesy_072403.455 folded +
assi (attr store1 < 0.996 and attr store1 > 0.796 )
     ((attr store1 < 0.95 and attr store1 > 0.85 ) and 
      (bondedto (attr store1 < 123.110873623  and attr store1 > 121.910873623 ) or 
       bondedto (attr store1 < 75.371  and attr store1 > 74.171 ) or 
       bondedto (attr store1 < 27.6311263766  and attr store1 > 26.4311263766 ))) 
6 0.1 0.1 peak 455 volume 180.00510 ppm1 0.900 ppm2 0.896
 
! ############### hot_mothernoesy_072403.456 folded +
assi (attr store1 < 4.327 and attr store1 > 4.127 )
     ((attr store1 < 0.943 and attr store1 > 0.843 ) and 
      (bondedto (attr store1 < 123.109873623  and attr store1 > 121.909873623 ) or 
       bondedto (attr store1 < 75.37  and attr store1 > 74.17 ) or 
       bondedto (attr store1 < 27.6301263766  and attr store1 > 26.4301263766 ))) 
6 0.1 0.1 peak 456 volume 4.25680 ppm1 0.893 ppm2 4.227
 
! ############### hot_mothernoesy_072403.457 folded +
assi (attr store1 < 1.318 and attr store1 > 1.118 )
     ((attr store1 < 0.944 and attr store1 > 0.844 ) and 
      (bondedto (attr store1 < 123.105873623  and attr store1 > 121.905873623 ) or 
       bondedto (attr store1 < 75.366  and attr store1 > 74.166 ) or 
       bondedto (attr store1 < 27.6261263766  and attr store1 > 26.4261263766 ))) 
6 0.1 0.1 peak 457 volume 11.32170 ppm1 0.894 ppm2 1.218
 
! ############### hot_mothernoesy_072403.458 folded -
assi (attr store1 < 2.14 and attr store1 > 1.94 )
     ((attr store1 < 3.979 and attr store1 > 3.879 ) and 
      (bondedto (attr store1 < 146.923810435  and attr store1 > 145.723810435 ) or 
       bondedto (attr store1 < 51.4440631883  and attr store1 > 50.2440631883 ))) 
6 0.1 0.1 peak 458 volume 25.2729 ppm1 3.929 ppm2 2.040
 
! ############### hot_mothernoesy_072403.459 folded -
assi (attr store1 < 2.139 and attr store1 > 1.939 )
     ((attr store1 < 3.878 and attr store1 > 3.778 ) and 
      (bondedto (attr store1 < 146.980810435  and attr store1 > 145.780810435 ) or 
       bondedto (attr store1 < 51.5010631883  and attr store1 > 50.3010631883 ))) 
6 0.1 0.1 peak 459 volume 22.7919 ppm1 3.828 ppm2 2.039
 
! ############### hot_mothernoesy_072403.460 folded +
assi (attr store1 < 1.014 and attr store1 > 0.814 )
     ((attr store1 < 1.773 and attr store1 > 1.673 ) and 
      (bondedto (attr store1 < 122.989873623  and attr store1 > 121.789873623 ) or 
       bondedto (attr store1 < 75.25  and attr store1 > 74.05 ) or 
       bondedto (attr store1 < 27.5101263766  and attr store1 > 26.3101263766 ))) 
6 0.1 0.1 peak 460 volume 13.92330 ppm1 1.723 ppm2 0.914
 
! ############### hot_mothernoesy_072403.461 folded +
assi (attr store1 < 1.028 and attr store1 > 0.828 )
     ((attr store1 < 1.682 and attr store1 > 1.582 ) and 
      (bondedto (attr store1 < 122.996873623  and attr store1 > 121.796873623 ) or 
       bondedto (attr store1 < 75.257  and attr store1 > 74.057 ) or 
       bondedto (attr store1 < 27.5171263766  and attr store1 > 26.3171263766 ))) 
6 0.1 0.1 peak 461 volume 12.02730 ppm1 1.632 ppm2 0.928
 
! ############### hot_mothernoesy_072403.462 folded -
assi (attr store1 < 2.41 and attr store1 > 2.21 )
     ((attr store1 < 3.974 and attr store1 > 3.874 ) and 
      (bondedto (attr store1 < 146.880810435  and attr store1 > 145.680810435 ) or 
       bondedto (attr store1 < 51.4010631883  and attr store1 > 50.2010631883 ))) 
6 0.1 0.1 peak 462 volume 5.4533 ppm1 3.924 ppm2 2.310
 
! ############### hot_mothernoesy_072403.463 folded +
assi (attr store1 < 3.79 and attr store1 > 3.59 )
     ((attr store1 < 4.633 and attr store1 > 4.533 ) and 
      (bondedto (attr store1 < 122.894873623  and attr store1 > 121.694873623 ) or 
       bondedto (attr store1 < 75.155  and attr store1 > 73.955 ) or 
       bondedto (attr store1 < 27.4151263766  and attr store1 > 26.2151263766 ))) 
6 0.1 0.1 peak 463 volume 3.65250 ppm1 4.583 ppm2 3.690
 
! ############### hot_mothernoesy_072403.464 folded +
assi (attr store1 < 4.382 and attr store1 > 4.182 )
     ((attr store1 < 1.874 and attr store1 > 1.774 ) and 
      (bondedto (attr store1 < 122.880873623  and attr store1 > 121.680873623 ) or 
       bondedto (attr store1 < 75.141  and attr store1 > 73.941 ) or 
       bondedto (attr store1 < 27.4011263766  and attr store1 > 26.2011263766 ))) 
6 0.1 0.1 peak 464 volume 5.26540 ppm1 1.824 ppm2 4.282
 
! ############### hot_mothernoesy_072403.465 folded +
assi (attr store1 < 1.746 and attr store1 > 1.546 )
     ((attr store1 < 1.874 and attr store1 > 1.774 ) and 
      (bondedto (attr store1 < 122.921873623  and attr store1 > 121.721873623 ) or 
       bondedto (attr store1 < 75.182  and attr store1 > 73.982 ) or 
       bondedto (attr store1 < 27.4421263766  and attr store1 > 26.2421263766 ))) 
6 0.1 0.1 peak 465 volume 11.20570 ppm1 1.824 ppm2 1.646
 
! ############### hot_mothernoesy_072403.466 folded +
assi (attr store1 < 1.007 and attr store1 > 0.807 )
     ((attr store1 < 1.874 and attr store1 > 1.774 ) and 
      (bondedto (attr store1 < 122.922873623  and attr store1 > 121.722873623 ) or 
       bondedto (attr store1 < 75.183  and attr store1 > 73.983 ) or 
       bondedto (attr store1 < 27.4431263766  and attr store1 > 26.2431263766 ))) 
6 0.1 0.1 peak 466 volume 13.38430 ppm1 1.824 ppm2 0.907
 
! ############### hot_mothernoesy_072403.467 folded +
assi (attr store1 < 1.918 and attr store1 > 1.718 )
     ((attr store1 < 1.871 and attr store1 > 1.771 ) and 
      (bondedto (attr store1 < 122.910873623  and attr store1 > 121.710873623 ) or 
       bondedto (attr store1 < 75.171  and attr store1 > 73.971 ) or 
       bondedto (attr store1 < 27.4311263766  and attr store1 > 26.2311263766 ))) 
6 0.1 0.1 peak 467 volume 50.28160 ppm1 1.821 ppm2 1.818
 
! ############### hot_mothernoesy_072403.468 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 1.886 and attr store1 > 1.786 ) and 
      (bondedto (attr store1 < 122.758873623  and attr store1 > 121.558873623 ) or 
       bondedto (attr store1 < 75.019  and attr store1 > 73.819 ) or 
       bondedto (attr store1 < 27.2791263766  and attr store1 > 26.0791263766 ))) 
6 0.1 0.1 peak 468 volume 4.77770 ppm1 1.836 ppm2 4.772
 
! ############### hot_mothernoesy_072403.469 folded +
assi (attr store1 < 4.247 and attr store1 > 4.047 )
     ((attr store1 < 1.88 and attr store1 > 1.78 ) and 
      (bondedto (attr store1 < 122.804873623  and attr store1 > 121.604873623 ) or 
       bondedto (attr store1 < 75.065  and attr store1 > 73.865 ) or 
       bondedto (attr store1 < 27.3251263766  and attr store1 > 26.1251263766 ))) 
6 0.1 0.1 peak 469 volume 4.98900 ppm1 1.830 ppm2 4.147
 
! ############### hot_mothernoesy_072403.470 folded +
assi (attr store1 < 1.089 and attr store1 > 0.889 )
     ((attr store1 < 1.776 and attr store1 > 1.676 ) and 
      (bondedto (attr store1 < 122.782873623  and attr store1 > 121.582873623 ) or 
       bondedto (attr store1 < 75.043  and attr store1 > 73.843 ) or 
       bondedto (attr store1 < 27.3031263766  and attr store1 > 26.1031263766 ))) 
6 0.1 0.1 peak 470 volume 6.59370 ppm1 1.726 ppm2 0.989
 
! ############### hot_mothernoesy_072403.471 folded -
assi (attr store1 < 4.761 and attr store1 > 4.561 )
     ((attr store1 < 3.958 and attr store1 > 3.858 ) and 
      (bondedto (attr store1 < 146.631810435  and attr store1 > 145.431810435 ) or 
       bondedto (attr store1 < 51.1520631883  and attr store1 > 49.9520631883 ))) 
6 0.1 0.1 peak 471 volume 22.0242 ppm1 3.908 ppm2 4.661
 
! ############### hot_mothernoesy_072403.472 folded -
assi (attr store1 < 3.711 and attr store1 > 3.511 )
     ((attr store1 < 3.958 and attr store1 > 3.858 ) and 
      (bondedto (attr store1 < 146.632810435  and attr store1 > 145.432810435 ) or 
       bondedto (attr store1 < 51.1530631883  and attr store1 > 49.9530631883 ))) 
6 0.1 0.1 peak 472 volume 45.0044 ppm1 3.908 ppm2 3.611
 
! ############### hot_mothernoesy_072403.473 folded -
assi (attr store1 < 2.42 and attr store1 > 2.22 )
     ((attr store1 < 3.96 and attr store1 > 3.86 ) and 
      (bondedto (attr store1 < 146.694810435  and attr store1 > 145.494810435 ) or 
       bondedto (attr store1 < 51.2150631883  and attr store1 > 50.0150631883 ))) 
6 0.1 0.1 peak 473 volume 5.529 ppm1 3.910 ppm2 2.320
 
! ############### hot_mothernoesy_072403.474 folded -
assi (attr store1 < 2.005 and attr store1 > 1.805 )
     ((attr store1 < 3.961 and attr store1 > 3.861 ) and 
      (bondedto (attr store1 < 146.673810435  and attr store1 > 145.473810435 ) or 
       bondedto (attr store1 < 51.1940631883  and attr store1 > 49.9940631883 ))) 
6 0.1 0.1 peak 474 volume 6.1904 ppm1 3.911 ppm2 1.905
 
! ############### hot_mothernoesy_072403.477 folded -
assi (attr store1 < 3.712 and attr store1 > 3.512 )
     ((attr store1 < 3.663 and attr store1 > 3.563 ) and 
      (bondedto (attr store1 < 146.629810435  and attr store1 > 145.429810435 ) or 
       bondedto (attr store1 < 51.1500631883  and attr store1 > 49.9500631883 ))) 
6 0.1 0.1 peak 477 volume 62.6794 ppm1 3.613 ppm2 3.612
 
! ############### hot_mothernoesy_072403.480 folded -
assi (attr store1 < 1.908 and attr store1 > 1.708 )
     ((attr store1 < 3.662 and attr store1 > 3.562 ) and 
      (bondedto (attr store1 < 146.628810435  and attr store1 > 145.428810435 ) or 
       bondedto (attr store1 < 51.1490631883  and attr store1 > 49.9490631883 ))) 
6 0.1 0.1 peak 480 volume 4.8302 ppm1 3.612 ppm2 1.808
 
! ############### hot_mothernoesy_072403.481 folded -
assi (attr store1 < 1.839 and attr store1 > 1.639 )
     ((attr store1 < 3.662 and attr store1 > 3.562 ) and 
      (bondedto (attr store1 < 146.657810435  and attr store1 > 145.457810435 ) or 
       bondedto (attr store1 < 51.1780631883  and attr store1 > 49.9780631883 ))) 
6 0.1 0.1 peak 481 volume 3.4836 ppm1 3.612 ppm2 1.739
 
! ############### hot_mothernoesy_072403.482 folded -
assi (attr store1 < 1.661 and attr store1 > 1.461 )
     ((attr store1 < 3.662 and attr store1 > 3.562 ) and 
      (bondedto (attr store1 < 146.624810435  and attr store1 > 145.424810435 ) or 
       bondedto (attr store1 < 51.1450631883  and attr store1 > 49.9450631883 ))) 
6 0.1 0.1 peak 482 volume 7.2518 ppm1 3.612 ppm2 1.561
 
! ############### hot_mothernoesy_072403.483 folded -
assi (attr store1 < 1.095 and attr store1 > 0.895 )
     ((attr store1 < 3.665 and attr store1 > 3.565 ) and 
      (bondedto (attr store1 < 146.631810435  and attr store1 > 145.431810435 ) or 
       bondedto (attr store1 < 51.1520631883  and attr store1 > 49.9520631883 ))) 
6 0.1 0.1 peak 483 volume 4.3569 ppm1 3.615 ppm2 0.995
 
! ############### hot_mothernoesy_072403.485 folded +
assi (attr store1 < 1.089 and attr store1 > 0.889 )
     ((attr store1 < 1.905 and attr store1 > 1.805 ) and 
      (bondedto (attr store1 < 122.712873623  and attr store1 > 121.512873623 ) or 
       bondedto (attr store1 < 74.973  and attr store1 > 73.773 ) or 
       bondedto (attr store1 < 27.2331263766  and attr store1 > 26.0331263766 ))) 
6 0.1 0.1 peak 485 volume 7.13980 ppm1 1.855 ppm2 0.989
 
! ############### hot_mothernoesy_072403.486 folded +
assi (attr store1 < 2.116 and attr store1 > 1.916 )
     ((attr store1 < 1.879 and attr store1 > 1.779 ) and 
      (bondedto (attr store1 < 122.736873623  and attr store1 > 121.536873623 ) or 
       bondedto (attr store1 < 74.997  and attr store1 > 73.797 ) or 
       bondedto (attr store1 < 27.2571263766  and attr store1 > 26.0571263766 ))) 
6 0.1 0.1 peak 486 volume 6.02960 ppm1 1.829 ppm2 2.016
 
! ############### hot_mothernoesy_072403.487 folded +
assi (attr store1 < 1.553 and attr store1 > 1.353 )
     ((attr store1 < 1.229 and attr store1 > 1.129 ) and 
      (bondedto (attr store1 < 122.733873623  and attr store1 > 121.533873623 ) or 
       bondedto (attr store1 < 74.994  and attr store1 > 73.794 ) or 
       bondedto (attr store1 < 27.2541263766  and attr store1 > 26.0541263766 ))) 
6 0.1 0.1 peak 487 volume 10.13260 ppm1 1.179 ppm2 1.453
 
! ############### hot_mothernoesy_072403.489 folded -
assi (attr store1 < 1.908 and attr store1 > 1.708 )
     ((attr store1 < 3.954 and attr store1 > 3.854 ) and 
      (bondedto (attr store1 < 146.549810435  and attr store1 > 145.349810435 ) or 
       bondedto (attr store1 < 51.0700631883  and attr store1 > 49.8700631883 ))) 
6 0.1 0.1 peak 489 volume 4.2616 ppm1 3.904 ppm2 1.808
 
! ############### hot_mothernoesy_072403.490 folded -
assi (attr store1 < 1.656 and attr store1 > 1.456 )
     ((attr store1 < 3.949 and attr store1 > 3.849 ) and 
      (bondedto (attr store1 < 146.559810435  and attr store1 > 145.359810435 ) or 
       bondedto (attr store1 < 51.0800631883  and attr store1 > 49.8800631883 ))) 
6 0.1 0.1 peak 490 volume 6.908 ppm1 3.899 ppm2 1.556
 
! ############### hot_mothernoesy_072403.492 folded +
assi (attr store1 < 1.084 and attr store1 > 0.884 )
     ((attr store1 < 1.873 and attr store1 > 1.773 ) and 
      (bondedto (attr store1 < 122.644873623  and attr store1 > 121.444873623 ) or 
       bondedto (attr store1 < 74.905  and attr store1 > 73.705 ) or 
       bondedto (attr store1 < 27.1651263766  and attr store1 > 25.9651263766 ))) 
6 0.1 0.1 peak 492 volume 8.19590 ppm1 1.823 ppm2 0.984
 
! ############### hot_mothernoesy_072403.493 folded +
assi (attr store1 < 4.214 and attr store1 > 4.014 )
     ((attr store1 < 1.627 and attr store1 > 1.527 ) and 
      (bondedto (attr store1 < 122.593873623  and attr store1 > 121.393873623 ) or 
       bondedto (attr store1 < 74.854  and attr store1 > 73.654 ) or 
       bondedto (attr store1 < 27.1141263766  and attr store1 > 25.9141263766 ))) 
6 0.1 0.1 peak 493 volume 3.61160 ppm1 1.577 ppm2 4.114
 
! ############### hot_mothernoesy_072403.494 folded +
assi (attr store1 < 1.678 and attr store1 > 1.478 )
     ((attr store1 < 1.628 and attr store1 > 1.528 ) and 
      (bondedto (attr store1 < 122.642873623  and attr store1 > 121.442873623 ) or 
       bondedto (attr store1 < 74.903  and attr store1 > 73.703 ) or 
       bondedto (attr store1 < 27.1631263766  and attr store1 > 25.9631263766 ))) 
6 0.1 0.1 peak 494 volume 33.57680 ppm1 1.578 ppm2 1.578
 
! ############### hot_mothernoesy_072403.495 folded +
assi (attr store1 < 1.197 and attr store1 > 0.997 )
     ((attr store1 < 1.536 and attr store1 > 1.436 ) and 
      (bondedto (attr store1 < 122.589873623  and attr store1 > 121.389873623 ) or 
       bondedto (attr store1 < 74.85  and attr store1 > 73.65 ) or 
       bondedto (attr store1 < 27.1101263766  and attr store1 > 25.9101263766 ))) 
6 0.1 0.1 peak 495 volume 21.27830 ppm1 1.486 ppm2 1.097
 
! ############### hot_mothernoesy_072403.496 folded +
assi (attr store1 < 4.592 and attr store1 > 4.392 )
     ((attr store1 < 1.532 and attr store1 > 1.432 ) and 
      (bondedto (attr store1 < 122.591873623  and attr store1 > 121.391873623 ) or 
       bondedto (attr store1 < 74.852  and attr store1 > 73.652 ) or 
       bondedto (attr store1 < 27.1121263766  and attr store1 > 25.9121263766 ))) 
6 0.1 0.1 peak 496 volume 3.94680 ppm1 1.482 ppm2 4.492
 
! ############### hot_mothernoesy_072403.497 folded +
assi (attr store1 < 0.976 and attr store1 > 0.776 )
     ((attr store1 < 1.533 and attr store1 > 1.433 ) and 
      (bondedto (attr store1 < 122.591873623  and attr store1 > 121.391873623 ) or 
       bondedto (attr store1 < 74.852  and attr store1 > 73.652 ) or 
       bondedto (attr store1 < 27.1121263766  and attr store1 > 25.9121263766 ))) 
6 0.1 0.1 peak 497 volume 22.61100 ppm1 1.483 ppm2 0.876
 
! ############### hot_mothernoesy_072403.498 folded +
assi (attr store1 < 2.038 and attr store1 > 1.838 )
     ((attr store1 < 1.157 and attr store1 > 1.057 ) and 
      (bondedto (attr store1 < 122.584873623  and attr store1 > 121.384873623 ) or 
       bondedto (attr store1 < 74.845  and attr store1 > 73.645 ) or 
       bondedto (attr store1 < 27.1051263766  and attr store1 > 25.9051263766 ))) 
6 0.1 0.1 peak 498 volume 4.51630 ppm1 1.107 ppm2 1.938
 
! ############### hot_mothernoesy_072403.499 folded +
assi (attr store1 < 1.587 and attr store1 > 1.387 )
     ((attr store1 < 1.155 and attr store1 > 1.055 ) and 
      (bondedto (attr store1 < 122.593873623  and attr store1 > 121.393873623 ) or 
       bondedto (attr store1 < 74.854  and attr store1 > 73.654 ) or 
       bondedto (attr store1 < 27.1141263766  and attr store1 > 25.9141263766 ))) 
6 0.1 0.1 peak 499 volume 18.67210 ppm1 1.105 ppm2 1.487
 
! ############### hot_mothernoesy_072403.500 folded +
assi (attr store1 < 1.197 and attr store1 > 0.997 )
     ((attr store1 < 1.157 and attr store1 > 1.057 ) and 
      (bondedto (attr store1 < 122.592873623  and attr store1 > 121.392873623 ) or 
       bondedto (attr store1 < 74.853  and attr store1 > 73.653 ) or 
       bondedto (attr store1 < 27.1131263766  and attr store1 > 25.9131263766 ))) 
6 0.1 0.1 peak 500 volume 24.40180 ppm1 1.107 ppm2 1.097
 
! ############### hot_mothernoesy_072403.501 folded +
assi (attr store1 < 4.597 and attr store1 > 4.397 )
     ((attr store1 < 1.155 and attr store1 > 1.055 ) and 
      (bondedto (attr store1 < 122.586873623  and attr store1 > 121.386873623 ) or 
       bondedto (attr store1 < 74.847  and attr store1 > 73.647 ) or 
       bondedto (attr store1 < 27.1071263766  and attr store1 > 25.9071263766 ))) 
6 0.1 0.1 peak 501 volume 3.76420 ppm1 1.105 ppm2 4.497
 
! ############### hot_mothernoesy_072403.502 folded +
assi (attr store1 < 0.977 and attr store1 > 0.777 )
     ((attr store1 < 1.153 and attr store1 > 1.053 ) and 
      (bondedto (attr store1 < 122.588873623  and attr store1 > 121.388873623 ) or 
       bondedto (attr store1 < 74.849  and attr store1 > 73.649 ) or 
       bondedto (attr store1 < 27.1091263766  and attr store1 > 25.9091263766 ))) 
6 0.1 0.1 peak 502 volume 23.43270 ppm1 1.103 ppm2 0.877
 
! ############### hot_mothernoesy_072403.503 folded +
assi (attr store1 < 0.905 and attr store1 > 0.705 )
     ((attr store1 < 1.629 and attr store1 > 1.529 ) and 
      (bondedto (attr store1 < 122.547873623  and attr store1 > 121.347873623 ) or 
       bondedto (attr store1 < 74.808  and attr store1 > 73.608 ) or 
       bondedto (attr store1 < 27.0681263766  and attr store1 > 25.8681263766 ))) 
6 0.1 0.1 peak 503 volume 15.18210 ppm1 1.579 ppm2 0.805
 
! ############### hot_mothernoesy_072403.504 folded -
assi (attr store1 < 4.566 and attr store1 > 4.366 )
     ((attr store1 < 3.933 and attr store1 > 3.833 ) and 
      (bondedto (attr store1 < 146.411810435  and attr store1 > 145.211810435 ) or 
       bondedto (attr store1 < 50.9320631883  and attr store1 > 49.7320631883 ))) 
6 0.1 0.1 peak 504 volume 7.8932 ppm1 3.883 ppm2 4.466
 
! ############### hot_mothernoesy_072403.505 folded -
assi (attr store1 < 3.47 and attr store1 > 3.27 )
     ((attr store1 < 3.934 and attr store1 > 3.834 ) and 
      (bondedto (attr store1 < 146.397810435  and attr store1 > 145.197810435 ) or 
       bondedto (attr store1 < 50.9180631883  and attr store1 > 49.7180631883 ))) 
6 0.1 0.1 peak 505 volume 7.2687 ppm1 3.884 ppm2 3.370
 
! ############### hot_mothernoesy_072403.506 folded -
assi (attr store1 < 1.754 and attr store1 > 1.554 )
     ((attr store1 < 3.931 and attr store1 > 3.831 ) and 
      (bondedto (attr store1 < 146.410810435  and attr store1 > 145.210810435 ) or 
       bondedto (attr store1 < 50.9310631883  and attr store1 > 49.7310631883 ))) 
6 0.1 0.1 peak 506 volume 3.6836 ppm1 3.881 ppm2 1.654
 
! ############### hot_mothernoesy_072403.507 folded -
assi (attr store1 < 4.566 and attr store1 > 4.366 )
     ((attr store1 < 3.423 and attr store1 > 3.323 ) and 
      (bondedto (attr store1 < 146.393810435  and attr store1 > 145.193810435 ) or 
       bondedto (attr store1 < 50.9140631883  and attr store1 > 49.7140631883 ))) 
6 0.1 0.1 peak 507 volume 5.108 ppm1 3.373 ppm2 4.466
 
! ############### hot_mothernoesy_072403.508 folded -
assi (attr store1 < 3.475 and attr store1 > 3.275 )
     ((attr store1 < 3.426 and attr store1 > 3.326 ) and 
      (bondedto (attr store1 < 146.364810435  and attr store1 > 145.164810435 ) or 
       bondedto (attr store1 < 50.8850631883  and attr store1 > 49.6850631883 ))) 
6 0.1 0.1 peak 508 volume 4.5948 ppm1 3.376 ppm2 3.375
 
! ############### hot_mothernoesy_072403.509 folded -
assi (attr store1 < 2.206 and attr store1 > 2.006 )
     ((attr store1 < 3.423 and attr store1 > 3.323 ) and 
      (bondedto (attr store1 < 146.359810435  and attr store1 > 145.159810435 ) or 
       bondedto (attr store1 < 50.8800631883  and attr store1 > 49.6800631883 ))) 
6 0.1 0.1 peak 509 volume 5.6737 ppm1 3.373 ppm2 2.106
 
! ############### hot_mothernoesy_072403.510 folded -
assi (attr store1 < 1.629 and attr store1 > 1.429 )
     ((attr store1 < 3.426 and attr store1 > 3.326 ) and 
      (bondedto (attr store1 < 146.377810435  and attr store1 > 145.177810435 ) or 
       bondedto (attr store1 < 50.8980631883  and attr store1 > 49.6980631883 ))) 
6 0.1 0.1 peak 510 volume 5.1752 ppm1 3.376 ppm2 1.529
 
! ############### hot_mothernoesy_072403.511 folded -
assi (attr store1 < 3.978 and attr store1 > 3.778 )
     ((attr store1 < 3.42 and attr store1 > 3.32 ) and 
      (bondedto (attr store1 < 146.381810435  and attr store1 > 145.181810435 ) or 
       bondedto (attr store1 < 50.9020631883  and attr store1 > 49.7020631883 ))) 
6 0.1 0.1 peak 511 volume 6.8681 ppm1 3.370 ppm2 3.878
 
! ############### hot_mothernoesy_072403.512 folded -
assi (attr store1 < 2.106 and attr store1 > 1.906 )
     ((attr store1 < 3.417 and attr store1 > 3.317 ) and 
      (bondedto (attr store1 < 146.369810435  and attr store1 > 145.169810435 ) or 
       bondedto (attr store1 < 50.8900631883  and attr store1 > 49.6900631883 ))) 
6 0.1 0.1 peak 512 volume 4.0813 ppm1 3.367 ppm2 2.006
 
! ############### hot_mothernoesy_072403.513 folded -
assi (attr store1 < 1.756 and attr store1 > 1.556 )
     ((attr store1 < 3.42 and attr store1 > 3.32 ) and 
      (bondedto (attr store1 < 146.376810435  and attr store1 > 145.176810435 ) or 
       bondedto (attr store1 < 50.8970631883  and attr store1 > 49.6970631883 ))) 
6 0.1 0.1 peak 513 volume 3.5696 ppm1 3.370 ppm2 1.656
 
! ############### hot_mothernoesy_072403.514 folded -
assi (attr store1 < 3.641 and attr store1 > 3.441 )
     ((attr store1 < 3.594 and attr store1 > 3.494 ) and 
      (bondedto (attr store1 < 146.293810435  and attr store1 > 145.093810435 ) or 
       bondedto (attr store1 < 50.8140631883  and attr store1 > 49.6140631883 ))) 
6 0.1 0.1 peak 514 volume 45.2547 ppm1 3.544 ppm2 3.541
 
! ############### hot_mothernoesy_072403.515 folded -
assi (attr store1 < 1.085 and attr store1 > 0.885 )
     ((attr store1 < 1.036 and attr store1 > 0.936 ) and 
      (bondedto (attr store1 < 146.199810435  and attr store1 > 144.999810435 ) or 
       bondedto (attr store1 < 50.7200631883  and attr store1 > 49.5200631883 ))) 
6 0.1 0.1 peak 515 volume 286.3259 ppm1 0.986 ppm2 0.985
 
! ############### hot_mothernoesy_072403.516 folded -
assi (attr store1 < 0.916 and attr store1 > 0.716 )
     ((attr store1 < 0.861 and attr store1 > 0.761 ) and 
      (bondedto (attr store1 < 146.204810435  and attr store1 > 145.004810435 ) or 
       bondedto (attr store1 < 50.7250631883  and attr store1 > 49.5250631883 ))) 
6 0.1 0.1 peak 516 volume 100.7641 ppm1 0.811 ppm2 0.816
 
! ############### hot_mothernoesy_072403.517 folded +
assi (attr store1 < 1.089 and attr store1 > 0.889 )
     ((attr store1 < 1.777 and attr store1 > 1.677 ) and 
      (bondedto (attr store1 < 122.106873623  and attr store1 > 120.906873623 ) or 
       bondedto (attr store1 < 74.367  and attr store1 > 73.167 ) or 
       bondedto (attr store1 < 26.6271263766  and attr store1 > 25.4271263766 ))) 
6 0.1 0.1 peak 517 volume 9.66350 ppm1 1.727 ppm2 0.989
 
! ############### hot_mothernoesy_072403.518 folded -
assi (attr store1 < 1.076 and attr store1 > 0.876 )
     ((attr store1 < 1.438 and attr store1 > 1.338 ) and 
      (bondedto (attr store1 < 145.841810435  and attr store1 > 144.641810435 ) or 
       bondedto (attr store1 < 50.3620631883  and attr store1 > 49.1620631883 ))) 
6 0.1 0.1 peak 518 volume 13.3706 ppm1 1.388 ppm2 0.976
 
! ############### hot_mothernoesy_072403.519 folded -
assi (attr store1 < 0.827 and attr store1 > 0.627 )
     ((attr store1 < 1.438 and attr store1 > 1.338 ) and 
      (bondedto (attr store1 < 145.814810435  and attr store1 > 144.614810435 ) or 
       bondedto (attr store1 < 50.3350631883  and attr store1 > 49.1350631883 ))) 
6 0.1 0.1 peak 519 volume 4.3673 ppm1 1.388 ppm2 0.727
 
! ############### hot_mothernoesy_072403.520 folded +
assi (attr store1 < 1.665 and attr store1 > 1.465 )
     ((attr store1 < 1.042 and attr store1 > 0.942 ) and 
      (bondedto (attr store1 < 121.770873623  and attr store1 > 120.570873623 ) or 
       bondedto (attr store1 < 74.031  and attr store1 > 72.831 ) or 
       bondedto (attr store1 < 26.2911263766  and attr store1 > 25.0911263766 ))) 
6 0.1 0.1 peak 520 volume 11.49130 ppm1 0.992 ppm2 1.565
 
! ############### hot_mothernoesy_072403.521 folded +
assi (attr store1 < 1.088 and attr store1 > 0.888 )
     ((attr store1 < 1.043 and attr store1 > 0.943 ) and 
      (bondedto (attr store1 < 121.769873623  and attr store1 > 120.569873623 ) or 
       bondedto (attr store1 < 74.03  and attr store1 > 72.83 ) or 
       bondedto (attr store1 < 26.2901263766  and attr store1 > 25.0901263766 ))) 
6 0.1 0.1 peak 521 volume 268.69321 ppm1 0.993 ppm2 0.988
 
! ############### hot_mothernoesy_072403.524 folded +
assi (attr store1 < 0.912 and attr store1 > 0.712 )
     ((attr store1 < 0.975 and attr store1 > 0.875 ) and 
      (bondedto (attr store1 < 121.796873623  and attr store1 > 120.596873623 ) or 
       bondedto (attr store1 < 74.057  and attr store1 > 72.857 ) or 
       bondedto (attr store1 < 26.3171263766  and attr store1 > 25.1171263766 ))) 
6 0.1 0.1 peak 524 volume 8.75570 ppm1 0.925 ppm2 0.812
 
! ############### hot_mothernoesy_072403.525 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 0.861 and attr store1 > 0.761 ) and 
      (bondedto (attr store1 < 121.734873623  and attr store1 > 120.534873623 ) or 
       bondedto (attr store1 < 73.995  and attr store1 > 72.795 ) or 
       bondedto (attr store1 < 26.2551263766  and attr store1 > 25.0551263766 ))) 
6 0.1 0.1 peak 525 volume 6.69420 ppm1 0.811 ppm2 4.773
 
! ############### hot_mothernoesy_072403.526 folded +
assi (attr store1 < 4.351 and attr store1 > 4.151 )
     ((attr store1 < 0.863 and attr store1 > 0.763 ) and 
      (bondedto (attr store1 < 121.739873623  and attr store1 > 120.539873623 ) or 
       bondedto (attr store1 < 74.0  and attr store1 > 72.8 ) or 
       bondedto (attr store1 < 26.2601263766  and attr store1 > 25.0601263766 ))) 
6 0.1 0.1 peak 526 volume 5.45500 ppm1 0.813 ppm2 4.251
 
! ############### hot_mothernoesy_072403.527 folded +
assi (attr store1 < 4.218 and attr store1 > 4.018 )
     ((attr store1 < 0.863 and attr store1 > 0.763 ) and 
      (bondedto (attr store1 < 121.730873623  and attr store1 > 120.530873623 ) or 
       bondedto (attr store1 < 73.991  and attr store1 > 72.791 ) or 
       bondedto (attr store1 < 26.2511263766  and attr store1 > 25.0511263766 ))) 
6 0.1 0.1 peak 527 volume 4.66900 ppm1 0.813 ppm2 4.118
 
! ############### hot_mothernoesy_072403.528 folded +
assi (attr store1 < 1.858 and attr store1 > 1.658 )
     ((attr store1 < 0.862 and attr store1 > 0.762 ) and 
      (bondedto (attr store1 < 121.739873623  and attr store1 > 120.539873623 ) or 
       bondedto (attr store1 < 74.0  and attr store1 > 72.8 ) or 
       bondedto (attr store1 < 26.2601263766  and attr store1 > 25.0601263766 ))) 
6 0.1 0.1 peak 528 volume 9.03130 ppm1 0.812 ppm2 1.758
 
! ############### hot_mothernoesy_072403.529 folded +
assi (attr store1 < 1.673 and attr store1 > 1.473 )
     ((attr store1 < 0.862 and attr store1 > 0.762 ) and 
      (bondedto (attr store1 < 121.757873623  and attr store1 > 120.557873623 ) or 
       bondedto (attr store1 < 74.018  and attr store1 > 72.818 ) or 
       bondedto (attr store1 < 26.2781263766  and attr store1 > 25.0781263766 ))) 
6 0.1 0.1 peak 529 volume 20.00370 ppm1 0.812 ppm2 1.573
 
! ############### hot_mothernoesy_072403.530 folded +
assi (attr store1 < 1.08 and attr store1 > 0.88 )
     ((attr store1 < 0.863 and attr store1 > 0.763 ) and 
      (bondedto (attr store1 < 121.741873623  and attr store1 > 120.541873623 ) or 
       bondedto (attr store1 < 74.002  and attr store1 > 72.802 ) or 
       bondedto (attr store1 < 26.2621263766  and attr store1 > 25.0621263766 ))) 
6 0.1 0.1 peak 530 volume 13.06780 ppm1 0.813 ppm2 0.980
 
! ############### hot_mothernoesy_072403.531 folded +
assi (attr store1 < 0.911 and attr store1 > 0.711 )
     ((attr store1 < 0.863 and attr store1 > 0.763 ) and 
      (bondedto (attr store1 < 121.733873623  and attr store1 > 120.533873623 ) or 
       bondedto (attr store1 < 73.994  and attr store1 > 72.794 ) or 
       bondedto (attr store1 < 26.2541263766  and attr store1 > 25.0541263766 ))) 
6 0.1 0.1 peak 531 volume 385.54099 ppm1 0.813 ppm2 0.811
 
! ############### hot_mothernoesy_072403.532 folded +
assi (attr store1 < 0.712 and attr store1 > 0.512 )
     ((attr store1 < 0.862 and attr store1 > 0.762 ) and 
      (bondedto (attr store1 < 121.737873623  and attr store1 > 120.537873623 ) or 
       bondedto (attr store1 < 73.998  and attr store1 > 72.798 ) or 
       bondedto (attr store1 < 26.2581263766  and attr store1 > 25.0581263766 ))) 
6 0.1 0.1 peak 532 volume 7.93360 ppm1 0.812 ppm2 0.612
 
! ############### hot_mothernoesy_072403.533 folded +
assi (attr store1 < 0.257 and attr store1 > 0.057 )
     ((attr store1 < 0.863 and attr store1 > 0.763 ) and 
      (bondedto (attr store1 < 121.733873623  and attr store1 > 120.533873623 ) or 
       bondedto (attr store1 < 73.994  and attr store1 > 72.794 ) or 
       bondedto (attr store1 < 26.2541263766  and attr store1 > 25.0541263766 ))) 
6 0.1 0.1 peak 533 volume 10.97840 ppm1 0.813 ppm2 0.157
 
! ############### hot_mothernoesy_072403.534 folded -
assi (attr store1 < 1.091 and attr store1 > 0.891 )
     ((attr store1 < 1.783 and attr store1 > 1.683 ) and 
      (bondedto (attr store1 < 145.635810435  and attr store1 > 144.435810435 ) or 
       bondedto (attr store1 < 50.1560631883  and attr store1 > 48.9560631883 ))) 
6 0.1 0.1 peak 534 volume 11.0442 ppm1 1.733 ppm2 0.991
 
! ############### hot_mothernoesy_072403.535 folded -
assi (attr store1 < 1.666 and attr store1 > 1.466 )
     ((attr store1 < 0.209 and attr store1 > 0.109 ) and 
      (bondedto (attr store1 < 145.571810435  and attr store1 > 144.371810435 ) or 
       bondedto (attr store1 < 50.0920631883  and attr store1 > 48.8920631883 ))) 
6 0.1 0.1 peak 535 volume 4.7433 ppm1 0.159 ppm2 1.566
 
! ############### hot_mothernoesy_072403.536 folded -
assi (attr store1 < 1.332 and attr store1 > 1.132 )
     ((attr store1 < 0.209 and attr store1 > 0.109 ) and 
      (bondedto (attr store1 < 145.544810435  and attr store1 > 144.344810435 ) or 
       bondedto (attr store1 < 50.0650631883  and attr store1 > 48.8650631883 ))) 
6 0.1 0.1 peak 536 volume 3.216 ppm1 0.159 ppm2 1.232
 
! ############### hot_mothernoesy_072403.537 folded -
assi (attr store1 < 1.088 and attr store1 > 0.888 )
     ((attr store1 < 0.208 and attr store1 > 0.108 ) and 
      (bondedto (attr store1 < 145.574810435  and attr store1 > 144.374810435 ) or 
       bondedto (attr store1 < 50.0950631883  and attr store1 > 48.8950631883 ))) 
6 0.1 0.1 peak 537 volume 5.2429 ppm1 0.158 ppm2 0.988
 
! ############### hot_mothernoesy_072403.538 folded -
assi (attr store1 < 0.909 and attr store1 > 0.709 )
     ((attr store1 < 0.21 and attr store1 > 0.11 ) and 
      (bondedto (attr store1 < 145.558810435  and attr store1 > 144.358810435 ) or 
       bondedto (attr store1 < 50.0790631883  and attr store1 > 48.8790631883 ))) 
6 0.1 0.1 peak 538 volume 4.1237 ppm1 0.160 ppm2 0.809
 
! ############### hot_mothernoesy_072403.539 folded -
assi (attr store1 < 0.708 and attr store1 > 0.508 )
     ((attr store1 < 0.207 and attr store1 > 0.107 ) and 
      (bondedto (attr store1 < 145.568810435  and attr store1 > 144.368810435 ) or 
       bondedto (attr store1 < 50.0890631883  and attr store1 > 48.8890631883 ))) 
6 0.1 0.1 peak 539 volume 8.1964 ppm1 0.157 ppm2 0.608
 
! ############### hot_mothernoesy_072403.540 folded -
assi (attr store1 < 0.257 and attr store1 > 0.057 )
     ((attr store1 < 0.208 and attr store1 > 0.108 ) and 
      (bondedto (attr store1 < 145.549810435  and attr store1 > 144.349810435 ) or 
       bondedto (attr store1 < 50.0700631883  and attr store1 > 48.8700631883 ))) 
6 0.1 0.1 peak 540 volume 83.8988 ppm1 0.158 ppm2 0.157
 
! ############### hot_mothernoesy_072403.541 folded +
assi (attr store1 < 1.813 and attr store1 > 1.613 )
     ((attr store1 < 1.429 and attr store1 > 1.329 ) and 
      (bondedto (attr store1 < 121.458873623  and attr store1 > 120.258873623 ) or 
       bondedto (attr store1 < 73.719  and attr store1 > 72.519 ) or 
       bondedto (attr store1 < 25.9791263766  and attr store1 > 24.7791263766 ))) 
6 0.1 0.1 peak 541 volume 5.72830 ppm1 1.379 ppm2 1.713
 
! ############### hot_mothernoesy_072403.542 folded -
assi (attr store1 < 1.949 and attr store1 > 1.749 )
     ((attr store1 < 1.572 and attr store1 > 1.472 ) and 
      (bondedto (attr store1 < 145.356810435  and attr store1 > 144.156810435 ) or 
       bondedto (attr store1 < 49.8770631883  and attr store1 > 48.6770631883 ))) 
6 0.1 0.1 peak 542 volume 6.8082 ppm1 1.522 ppm2 1.849
 
! ############### hot_mothernoesy_072403.543 folded -
assi (attr store1 < 1.844 and attr store1 > 1.644 )
     ((attr store1 < 1.567 and attr store1 > 1.467 ) and 
      (bondedto (attr store1 < 145.348810435  and attr store1 > 144.148810435 ) or 
       bondedto (attr store1 < 49.8690631883  and attr store1 > 48.6690631883 ))) 
6 0.1 0.1 peak 543 volume 23.9687 ppm1 1.517 ppm2 1.744
 
! ############### hot_mothernoesy_072403.544 folded -
assi (attr store1 < 1.954 and attr store1 > 1.754 )
     ((attr store1 < 1.552 and attr store1 > 1.452 ) and 
      (bondedto (attr store1 < 145.369810435  and attr store1 > 144.169810435 ) or 
       bondedto (attr store1 < 49.8900631883  and attr store1 > 48.6900631883 ))) 
6 0.1 0.1 peak 544 volume 8.4148 ppm1 1.502 ppm2 1.854
 
! ############### hot_mothernoesy_072403.545 folded -
assi (attr store1 < 1.951 and attr store1 > 1.751 )
     ((attr store1 < 1.502 and attr store1 > 1.402 ) and 
      (bondedto (attr store1 < 145.361810435  and attr store1 > 144.161810435 ) or 
       bondedto (attr store1 < 49.8820631883  and attr store1 > 48.6820631883 ))) 
6 0.1 0.1 peak 545 volume 5.6473 ppm1 1.452 ppm2 1.851
 
! ############### hot_mothernoesy_072403.546 folded +
assi (attr store1 < 1.976 and attr store1 > 1.776 )
     ((attr store1 < 1.444 and attr store1 > 1.344 ) and 
      (bondedto (attr store1 < 121.360873623  and attr store1 > 120.160873623 ) or 
       bondedto (attr store1 < 73.621  and attr store1 > 72.421 ) or 
       bondedto (attr store1 < 25.8811263766  and attr store1 > 24.6811263766 ))) 
6 0.1 0.1 peak 546 volume 4.47240 ppm1 1.394 ppm2 1.876
 
! ############### hot_mothernoesy_072403.547 folded +
assi (attr store1 < 3.998 and attr store1 > 3.798 )
     ((attr store1 < 1.439 and attr store1 > 1.339 ) and 
      (bondedto (attr store1 < 121.385873623  and attr store1 > 120.185873623 ) or 
       bondedto (attr store1 < 73.646  and attr store1 > 72.446 ) or 
       bondedto (attr store1 < 25.9061263766  and attr store1 > 24.7061263766 ))) 
6 0.1 0.1 peak 547 volume 5.25490 ppm1 1.389 ppm2 3.898
 
! ############### hot_mothernoesy_072403.548 folded +
assi (attr store1 < 3.874 and attr store1 > 3.674 )
     ((attr store1 < 1.44 and attr store1 > 1.34 ) and 
      (bondedto (attr store1 < 121.378873623  and attr store1 > 120.178873623 ) or 
       bondedto (attr store1 < 73.639  and attr store1 > 72.439 ) or 
       bondedto (attr store1 < 25.8991263766  and attr store1 > 24.6991263766 ))) 
6 0.1 0.1 peak 548 volume 4.46300 ppm1 1.390 ppm2 3.774
 
! ############### hot_mothernoesy_072403.551 folded +
assi (attr store1 < 2.168 and attr store1 > 1.968 )
     ((attr store1 < 1.439 and attr store1 > 1.339 ) and 
      (bondedto (attr store1 < 121.389873623  and attr store1 > 120.189873623 ) or 
       bondedto (attr store1 < 73.65  and attr store1 > 72.45 ) or 
       bondedto (attr store1 < 25.9101263766  and attr store1 > 24.7101263766 ))) 
6 0.1 0.1 peak 551 volume 6.71960 ppm1 1.389 ppm2 2.068
 
! ############### hot_mothernoesy_072403.554 folded -
assi (attr store1 < 2.162 and attr store1 > 1.962 )
     ((attr store1 < 2.124 and attr store1 > 2.024 ) and 
      (bondedto (attr store1 < 145.181810435  and attr store1 > 143.981810435 ) or 
       bondedto (attr store1 < 49.7020631883  and attr store1 > 48.5020631883 ))) 
6 0.1 0.1 peak 554 volume 11.0004 ppm1 2.074 ppm2 2.062
 
! ############### hot_mothernoesy_072403.555 folded -
assi (attr store1 < 1.806 and attr store1 > 1.606 )
     ((attr store1 < 1.489 and attr store1 > 1.389 ) and 
      (bondedto (attr store1 < 145.180810435  and attr store1 > 143.980810435 ) or 
       bondedto (attr store1 < 49.7010631883  and attr store1 > 48.5010631883 ))) 
6 0.1 0.1 peak 555 volume 47.6773 ppm1 1.439 ppm2 1.706
 
! ############### hot_mothernoesy_072403.556 folded +
assi (attr store1 < 4.228 and attr store1 > 4.028 )
     ((attr store1 < 1.041 and attr store1 > 0.941 ) and 
      (bondedto (attr store1 < 121.122873623  and attr store1 > 119.922873623 ) or 
       bondedto (attr store1 < 73.383  and attr store1 > 72.183 ) or 
       bondedto (attr store1 < 25.6431263766  and attr store1 > 24.4431263766 ))) 
6 0.1 0.1 peak 556 volume 12.65400 ppm1 0.991 ppm2 4.128
 
! ############### hot_mothernoesy_072403.557 folded +
assi (attr store1 < 2.647 and attr store1 > 2.447 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 121.136873623  and attr store1 > 119.936873623 ) or 
       bondedto (attr store1 < 73.397  and attr store1 > 72.197 ) or 
       bondedto (attr store1 < 25.6571263766  and attr store1 > 24.4571263766 ))) 
6 0.1 0.1 peak 557 volume 3.26910 ppm1 0.990 ppm2 2.547
 
! ############### hot_mothernoesy_072403.558 folded +
assi (attr store1 < 2.517 and attr store1 > 2.317 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 121.136873623  and attr store1 > 119.936873623 ) or 
       bondedto (attr store1 < 73.397  and attr store1 > 72.197 ) or 
       bondedto (attr store1 < 25.6571263766  and attr store1 > 24.4571263766 ))) 
6 0.1 0.1 peak 558 volume 5.35320 ppm1 0.990 ppm2 2.417
 
! ############### hot_mothernoesy_072403.559 folded +
assi (attr store1 < 1.912 and attr store1 > 1.712 )
     ((attr store1 < 1.038 and attr store1 > 0.938 ) and 
      (bondedto (attr store1 < 121.076873623  and attr store1 > 119.876873623 ) or 
       bondedto (attr store1 < 73.337  and attr store1 > 72.137 ) or 
       bondedto (attr store1 < 25.5971263766  and attr store1 > 24.3971263766 ))) 
6 0.1 0.1 peak 559 volume 47.79310 ppm1 0.988 ppm2 1.812
 
! ############### hot_mothernoesy_072403.560 folded +
assi (attr store1 < 1.088 and attr store1 > 0.888 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 121.098873623  and attr store1 > 119.898873623 ) or 
       bondedto (attr store1 < 73.359  and attr store1 > 72.159 ) or 
       bondedto (attr store1 < 25.6191263766  and attr store1 > 24.4191263766 ))) 
6 0.1 0.1 peak 560 volume 1475.20215 ppm1 0.990 ppm2 0.988
 
! ############### hot_mothernoesy_072403.561 folded +
assi (attr store1 < 4.385 and attr store1 > 4.185 )
     ((attr store1 < 1.037 and attr store1 > 0.937 ) and 
      (bondedto (attr store1 < 121.158873623  and attr store1 > 119.958873623 ) or 
       bondedto (attr store1 < 73.419  and attr store1 > 72.219 ) or 
       bondedto (attr store1 < 25.6791263766  and attr store1 > 24.4791263766 ))) 
6 0.1 0.1 peak 561 volume 8.21270 ppm1 0.987 ppm2 4.285
 
! ############### hot_mothernoesy_072403.562 folded +
assi (attr store1 < 2.287 and attr store1 > 2.087 )
     ((attr store1 < 1.037 and attr store1 > 0.937 ) and 
      (bondedto (attr store1 < 121.104873623  and attr store1 > 119.904873623 ) or 
       bondedto (attr store1 < 73.365  and attr store1 > 72.165 ) or 
       bondedto (attr store1 < 25.6251263766  and attr store1 > 24.4251263766 ))) 
6 0.1 0.1 peak 562 volume 5.50150 ppm1 0.987 ppm2 2.187
 
! ############### hot_mothernoesy_072403.566 folded +
assi (attr store1 < 1.845 and attr store1 > 1.645 )
     ((attr store1 < 0.208 and attr store1 > 0.108 ) and 
      (bondedto (attr store1 < 121.095873623  and attr store1 > 119.895873623 ) or 
       bondedto (attr store1 < 73.356  and attr store1 > 72.156 ) or 
       bondedto (attr store1 < 25.6161263766  and attr store1 > 24.4161263766 ))) 
6 0.1 0.1 peak 566 volume 6.20680 ppm1 0.158 ppm2 1.745
 
! ############### hot_mothernoesy_072403.568 folded +
assi (attr store1 < 1.529 and attr store1 > 1.329 )
     ((attr store1 < 0.208 and attr store1 > 0.108 ) and 
      (bondedto (attr store1 < 121.097873623  and attr store1 > 119.897873623 ) or 
       bondedto (attr store1 < 73.358  and attr store1 > 72.158 ) or 
       bondedto (attr store1 < 25.6181263766  and attr store1 > 24.4181263766 ))) 
6 0.1 0.1 peak 568 volume 9.74400 ppm1 0.158 ppm2 1.429
 
! ############### hot_mothernoesy_072403.570 folded +
assi (attr store1 < 1.088 and attr store1 > 0.888 )
     ((attr store1 < 0.208 and attr store1 > 0.108 ) and 
      (bondedto (attr store1 < 121.101873623  and attr store1 > 119.901873623 ) or 
       bondedto (attr store1 < 73.362  and attr store1 > 72.162 ) or 
       bondedto (attr store1 < 25.6221263766  and attr store1 > 24.4221263766 ))) 
6 0.1 0.1 peak 570 volume 22.82290 ppm1 0.158 ppm2 0.988
 
! ############### hot_mothernoesy_072403.571 folded +
assi (attr store1 < 0.909 and attr store1 > 0.709 )
     ((attr store1 < 0.208 and attr store1 > 0.108 ) and 
      (bondedto (attr store1 < 121.096873623  and attr store1 > 119.896873623 ) or 
       bondedto (attr store1 < 73.357  and attr store1 > 72.157 ) or 
       bondedto (attr store1 < 25.6171263766  and attr store1 > 24.4171263766 ))) 
6 0.1 0.1 peak 571 volume 18.99210 ppm1 0.158 ppm2 0.809
 
! ############### hot_mothernoesy_072403.573 folded +
assi (attr store1 < 0.258 and attr store1 > 0.058 )
     ((attr store1 < 0.208 and attr store1 > 0.108 ) and 
      (bondedto (attr store1 < 121.094873623  and attr store1 > 119.894873623 ) or 
       bondedto (attr store1 < 73.355  and attr store1 > 72.155 ) or 
       bondedto (attr store1 < 25.6151263766  and attr store1 > 24.4151263766 ))) 
6 0.1 0.1 peak 573 volume 361.88040 ppm1 0.158 ppm2 0.158
 
! ############### hot_mothernoesy_072403.574 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 0.203 and attr store1 > 0.103 ) and 
      (bondedto (attr store1 < 121.106873623  and attr store1 > 119.906873623 ) or 
       bondedto (attr store1 < 73.367  and attr store1 > 72.167 ) or 
       bondedto (attr store1 < 25.6271263766  and attr store1 > 24.4271263766 ))) 
6 0.1 0.1 peak 574 volume 3.35580 ppm1 0.153 ppm2 4.773
 
! ############### hot_mothernoesy_072403.575 folded +
assi (attr store1 < 1.927 and attr store1 > 1.727 )
     ((attr store1 < 1.878 and attr store1 > 1.778 ) and 
      (bondedto (attr store1 < 120.982873623  and attr store1 > 119.782873623 ) or 
       bondedto (attr store1 < 73.243  and attr store1 > 72.043 ) or 
       bondedto (attr store1 < 25.5031263766  and attr store1 > 24.3031263766 ))) 
6 0.1 0.1 peak 575 volume 17.71400 ppm1 1.828 ppm2 1.827
 
! ############### hot_mothernoesy_072403.576 folded +
assi (attr store1 < 3.998 and attr store1 > 3.798 )
     ((attr store1 < 1.039 and attr store1 > 0.939 ) and 
      (bondedto (attr store1 < 120.981873623  and attr store1 > 119.781873623 ) or 
       bondedto (attr store1 < 73.242  and attr store1 > 72.042 ) or 
       bondedto (attr store1 < 25.5021263766  and attr store1 > 24.3021263766 ))) 
6 0.1 0.1 peak 576 volume 7.39530 ppm1 0.989 ppm2 3.898
 
! ############### hot_mothernoesy_072403.577 folded +
assi (attr store1 < 2.988 and attr store1 > 2.788 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 120.982873623  and attr store1 > 119.782873623 ) or 
       bondedto (attr store1 < 73.243  and attr store1 > 72.043 ) or 
       bondedto (attr store1 < 25.5031263766  and attr store1 > 24.3031263766 ))) 
6 0.1 0.1 peak 577 volume 9.85490 ppm1 0.990 ppm2 2.888
 
! ############### hot_mothernoesy_072403.578 folded +
assi (attr store1 < 2.388 and attr store1 > 2.188 )
     ((attr store1 < 1.038 and attr store1 > 0.938 ) and 
      (bondedto (attr store1 < 121.006873623  and attr store1 > 119.806873623 ) or 
       bondedto (attr store1 < 73.267  and attr store1 > 72.067 ) or 
       bondedto (attr store1 < 25.5271263766  and attr store1 > 24.3271263766 ))) 
6 0.1 0.1 peak 578 volume 5.61240 ppm1 0.988 ppm2 2.288
 
! ############### hot_mothernoesy_072403.580 folded +
assi (attr store1 < 2.007 and attr store1 > 1.807 )
     ((attr store1 < 1.039 and attr store1 > 0.939 ) and 
      (bondedto (attr store1 < 120.988873623  and attr store1 > 119.788873623 ) or 
       bondedto (attr store1 < 73.249  and attr store1 > 72.049 ) or 
       bondedto (attr store1 < 25.5091263766  and attr store1 > 24.3091263766 ))) 
6 0.1 0.1 peak 580 volume 37.76320 ppm1 0.989 ppm2 1.907
 
! ############### hot_mothernoesy_072403.581 folded +
assi (attr store1 < 1.771 and attr store1 > 1.571 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 121.049873623  and attr store1 > 119.849873623 ) or 
       bondedto (attr store1 < 73.31  and attr store1 > 72.11 ) or 
       bondedto (attr store1 < 25.5701263766  and attr store1 > 24.3701263766 ))) 
6 0.1 0.1 peak 581 volume 30.33880 ppm1 0.990 ppm2 1.671
 
! ############### hot_mothernoesy_072403.582 folded +
assi (attr store1 < 0.831 and attr store1 > 0.631 )
     ((attr store1 < 1.039 and attr store1 > 0.939 ) and 
      (bondedto (attr store1 < 120.990873623  and attr store1 > 119.790873623 ) or 
       bondedto (attr store1 < 73.251  and attr store1 > 72.051 ) or 
       bondedto (attr store1 < 25.5111263766  and attr store1 > 24.3111263766 ))) 
6 0.1 0.1 peak 582 volume 27.51340 ppm1 0.989 ppm2 0.731
 
! ############### hot_mothernoesy_072403.583 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 1.035 and attr store1 > 0.935 ) and 
      (bondedto (attr store1 < 120.998873623  and attr store1 > 119.798873623 ) or 
       bondedto (attr store1 < 73.259  and attr store1 > 72.059 ) or 
       bondedto (attr store1 < 25.5191263766  and attr store1 > 24.3191263766 ))) 
6 0.1 0.1 peak 583 volume 10.51790 ppm1 0.985 ppm2 4.772
 
! ############### hot_mothernoesy_072403.584 folded +
assi (attr store1 < 4.784 and attr store1 > 4.584 )
     ((attr store1 < 1.037 and attr store1 > 0.937 ) and 
      (bondedto (attr store1 < 121.012873623  and attr store1 > 119.812873623 ) or 
       bondedto (attr store1 < 73.273  and attr store1 > 72.073 ) or 
       bondedto (attr store1 < 25.5331263766  and attr store1 > 24.3331263766 ))) 
6 0.1 0.1 peak 584 volume 7.93340 ppm1 0.987 ppm2 4.684
 
! ############### hot_mothernoesy_072403.585 folded +
assi (attr store1 < 2.042 and attr store1 > 1.842 )
     ((attr store1 < 1.994 and attr store1 > 1.894 ) and 
      (bondedto (attr store1 < 120.931873623  and attr store1 > 119.731873623 ) or 
       bondedto (attr store1 < 73.192  and attr store1 > 71.992 ) or 
       bondedto (attr store1 < 25.4521263766  and attr store1 > 24.2521263766 ))) 
6 0.1 0.1 peak 585 volume 22.77650 ppm1 1.944 ppm2 1.942
 
! ############### hot_mothernoesy_072403.586 folded +
assi (attr store1 < 1.932 and attr store1 > 1.732 )
     ((attr store1 < 1.991 and attr store1 > 1.891 ) and 
      (bondedto (attr store1 < 120.922873623  and attr store1 > 119.722873623 ) or 
       bondedto (attr store1 < 73.183  and attr store1 > 71.983 ) or 
       bondedto (attr store1 < 25.4431263766  and attr store1 > 24.2431263766 ))) 
6 0.1 0.1 peak 586 volume 13.37740 ppm1 1.941 ppm2 1.832
 
! ############### hot_mothernoesy_072403.587 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 1.563 and attr store1 > 1.463 ) and 
      (bondedto (attr store1 < 120.905873623  and attr store1 > 119.705873623 ) or 
       bondedto (attr store1 < 73.166  and attr store1 > 71.966 ) or 
       bondedto (attr store1 < 25.4261263766  and attr store1 > 24.2261263766 ))) 
6 0.1 0.1 peak 587 volume 3.54430 ppm1 1.513 ppm2 4.772
 
! ############### hot_mothernoesy_072403.588 folded +
assi (attr store1 < 1.952 and attr store1 > 1.752 )
     ((attr store1 < 1.561 and attr store1 > 1.461 ) and 
      (bondedto (attr store1 < 120.887873623  and attr store1 > 119.687873623 ) or 
       bondedto (attr store1 < 73.148  and attr store1 > 71.948 ) or 
       bondedto (attr store1 < 25.4081263766  and attr store1 > 24.2081263766 ))) 
6 0.1 0.1 peak 588 volume 23.37830 ppm1 1.511 ppm2 1.852
 
! ############### hot_mothernoesy_072403.589 folded +
assi (attr store1 < 4.424 and attr store1 > 4.224 )
     ((attr store1 < 1.556 and attr store1 > 1.456 ) and 
      (bondedto (attr store1 < 120.892873623  and attr store1 > 119.692873623 ) or 
       bondedto (attr store1 < 73.153  and attr store1 > 71.953 ) or 
       bondedto (attr store1 < 25.4131263766  and attr store1 > 24.2131263766 ))) 
6 0.1 0.1 peak 589 volume 9.61050 ppm1 1.506 ppm2 4.324
 
! ############### hot_mothernoesy_072403.590 folded +
assi (attr store1 < 3.058 and attr store1 > 2.858 )
     ((attr store1 < 1.546 and attr store1 > 1.446 ) and 
      (bondedto (attr store1 < 120.950873623  and attr store1 > 119.750873623 ) or 
       bondedto (attr store1 < 73.211  and attr store1 > 72.011 ) or 
       bondedto (attr store1 < 25.4711263766  and attr store1 > 24.2711263766 ))) 
6 0.1 0.1 peak 590 volume 6.66340 ppm1 1.496 ppm2 2.958
 
! ############### hot_mothernoesy_072403.591 folded +
assi (attr store1 < 1.741 and attr store1 > 1.541 )
     ((attr store1 < 1.549 and attr store1 > 1.449 ) and 
      (bondedto (attr store1 < 120.932873623  and attr store1 > 119.732873623 ) or 
       bondedto (attr store1 < 73.193  and attr store1 > 71.993 ) or 
       bondedto (attr store1 < 25.4531263766  and attr store1 > 24.2531263766 ))) 
6 0.1 0.1 peak 591 volume 46.25700 ppm1 1.499 ppm2 1.641
 
! ############### hot_mothernoesy_072403.592 folded +
assi (attr store1 < 3.056 and attr store1 > 2.856 )
     ((attr store1 < 1.506 and attr store1 > 1.406 ) and 
      (bondedto (attr store1 < 120.934873623  and attr store1 > 119.734873623 ) or 
       bondedto (attr store1 < 73.195  and attr store1 > 71.995 ) or 
       bondedto (attr store1 < 25.4551263766  and attr store1 > 24.2551263766 ))) 
6 0.1 0.1 peak 592 volume 6.45880 ppm1 1.456 ppm2 2.956
 
! ############### hot_mothernoesy_072403.593 folded +
assi (attr store1 < 4.116 and attr store1 > 3.916 )
     ((attr store1 < 1.041 and attr store1 > 0.941 ) and 
      (bondedto (attr store1 < 120.960873623  and attr store1 > 119.760873623 ) or 
       bondedto (attr store1 < 73.221  and attr store1 > 72.021 ) or 
       bondedto (attr store1 < 25.4811263766  and attr store1 > 24.2811263766 ))) 
6 0.1 0.1 peak 593 volume 20.71200 ppm1 0.991 ppm2 4.016
 
! ############### hot_mothernoesy_072403.594 folded +
assi (attr store1 < 3.607 and attr store1 > 3.407 )
     ((attr store1 < 1.041 and attr store1 > 0.941 ) and 
      (bondedto (attr store1 < 120.945873623  and attr store1 > 119.745873623 ) or 
       bondedto (attr store1 < 73.206  and attr store1 > 72.006 ) or 
       bondedto (attr store1 < 25.4661263766  and attr store1 > 24.2661263766 ))) 
6 0.1 0.1 peak 594 volume 12.35020 ppm1 0.991 ppm2 3.507
 
! ############### hot_mothernoesy_072403.595 folded +
assi (attr store1 < 3.255 and attr store1 > 3.055 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 120.957873623  and attr store1 > 119.757873623 ) or 
       bondedto (attr store1 < 73.218  and attr store1 > 72.018 ) or 
       bondedto (attr store1 < 25.4781263766  and attr store1 > 24.2781263766 ))) 
6 0.1 0.1 peak 595 volume 6.10040 ppm1 0.990 ppm2 3.155
 
! ############### hot_mothernoesy_072403.596 folded +
assi (attr store1 < 1.491 and attr store1 > 1.291 )
     ((attr store1 < 1.041 and attr store1 > 0.941 ) and 
      (bondedto (attr store1 < 120.972873623  and attr store1 > 119.772873623 ) or 
       bondedto (attr store1 < 73.233  and attr store1 > 72.033 ) or 
       bondedto (attr store1 < 25.4931263766  and attr store1 > 24.2931263766 ))) 
6 0.1 0.1 peak 596 volume 28.22880 ppm1 0.991 ppm2 1.391
 
! ############### hot_mothernoesy_072403.597 folded +
assi (attr store1 < 3.146 and attr store1 > 2.946 )
     ((attr store1 < 1.566 and attr store1 > 1.466 ) and 
      (bondedto (attr store1 < 120.871873623  and attr store1 > 119.671873623 ) or 
       bondedto (attr store1 < 73.132  and attr store1 > 71.932 ) or 
       bondedto (attr store1 < 25.3921263766  and attr store1 > 24.1921263766 ))) 
6 0.1 0.1 peak 597 volume 7.11210 ppm1 1.516 ppm2 3.046
 
! ############### hot_mothernoesy_072403.598 folded +
assi (attr store1 < 1.83 and attr store1 > 1.63 )
     ((attr store1 < 1.556 and attr store1 > 1.456 ) and 
      (bondedto (attr store1 < 120.834873623  and attr store1 > 119.634873623 ) or 
       bondedto (attr store1 < 73.095  and attr store1 > 71.895 ) or 
       bondedto (attr store1 < 25.3551263766  and attr store1 > 24.1551263766 ))) 
6 0.1 0.1 peak 598 volume 85.44170 ppm1 1.506 ppm2 1.730
 
! ############### hot_mothernoesy_072403.599 folded +
assi (attr store1 < 1.518 and attr store1 > 1.318 )
     ((attr store1 < 1.467 and attr store1 > 1.367 ) and 
      (bondedto (attr store1 < 120.810873623  and attr store1 > 119.610873623 ) or 
       bondedto (attr store1 < 73.071  and attr store1 > 71.871 ) or 
       bondedto (attr store1 < 25.3311263766  and attr store1 > 24.1311263766 ))) 
6 0.1 0.1 peak 599 volume 1415.70496 ppm1 1.417 ppm2 1.418
 
! ############### hot_mothernoesy_072403.600 folded +
assi (attr store1 < 1.946 and attr store1 > 1.746 )
     ((attr store1 < 1.5 and attr store1 > 1.4 ) and 
      (bondedto (attr store1 < 120.730873623  and attr store1 > 119.530873623 ) or 
       bondedto (attr store1 < 72.991  and attr store1 > 71.791 ) or 
       bondedto (attr store1 < 25.2511263766  and attr store1 > 24.0511263766 ))) 
6 0.1 0.1 peak 600 volume 21.04830 ppm1 1.450 ppm2 1.846
 
! ############### hot_mothernoesy_072403.601 folded +
assi (attr store1 < 1.805 and attr store1 > 1.605 )
     ((attr store1 < 1.49 and attr store1 > 1.39 ) and 
      (bondedto (attr store1 < 120.695873623  and attr store1 > 119.495873623 ) or 
       bondedto (attr store1 < 72.956  and attr store1 > 71.756 ) or 
       bondedto (attr store1 < 25.2161263766  and attr store1 > 24.0161263766 ))) 
6 0.1 0.1 peak 601 volume 133.84810 ppm1 1.440 ppm2 1.705
 
! ############### hot_mothernoesy_072403.602 folded -
assi (attr store1 < 1.811 and attr store1 > 1.611 )
     ((attr store1 < 1.754 and attr store1 > 1.654 ) and 
      (bondedto (attr store1 < 144.490810435  and attr store1 > 143.290810435 ) or 
       bondedto (attr store1 < 49.0110631883  and attr store1 > 47.8110631883 ))) 
6 0.1 0.1 peak 602 volume 75.2221 ppm1 1.704 ppm2 1.711
 
! ############### hot_mothernoesy_072403.603 folded -
assi (attr store1 < 1.05 and attr store1 > 0.85 )
     ((attr store1 < 1.001 and attr store1 > 0.901 ) and 
      (bondedto (attr store1 < 144.206810435  and attr store1 > 143.006810435 ) or 
       bondedto (attr store1 < 48.7270631883  and attr store1 > 47.5270631883 ))) 
6 0.1 0.1 peak 603 volume 158.7296 ppm1 0.951 ppm2 0.950
 
! ############### hot_mothernoesy_072403.604 folded -
assi (attr store1 < 4.009 and attr store1 > 3.809 )
     ((attr store1 < 0.995 and attr store1 > 0.895 ) and 
      (bondedto (attr store1 < 144.250810435  and attr store1 > 143.050810435 ) or 
       bondedto (attr store1 < 48.7710631883  and attr store1 > 47.5710631883 ))) 
6 0.1 0.1 peak 604 volume 3.8024 ppm1 0.945 ppm2 3.909
 
! ############### hot_mothernoesy_072403.605 folded -
assi (attr store1 < 1.477 and attr store1 > 1.277 )
     ((attr store1 < 0.996 and attr store1 > 0.896 ) and 
      (bondedto (attr store1 < 144.248810435  and attr store1 > 143.048810435 ) or 
       bondedto (attr store1 < 48.7690631883  and attr store1 > 47.5690631883 ))) 
6 0.1 0.1 peak 605 volume 6.2115 ppm1 0.946 ppm2 1.377
 
! ############### hot_mothernoesy_072403.606 folded -
assi (attr store1 < 1.33 and attr store1 > 1.13 )
     ((attr store1 < 0.99 and attr store1 > 0.89 ) and 
      (bondedto (attr store1 < 144.270810435  and attr store1 > 143.070810435 ) or 
       bondedto (attr store1 < 48.7910631883  and attr store1 > 47.5910631883 ))) 
6 0.1 0.1 peak 606 volume 4.2874 ppm1 0.940 ppm2 1.230
 
! ############### hot_mothernoesy_072403.607 folded +
assi (attr store1 < 4.174 and attr store1 > 3.974 )
     ((attr store1 < 1.606 and attr store1 > 1.506 ) and 
      (bondedto (attr store1 < 120.078873623  and attr store1 > 118.878873623 ) or 
       bondedto (attr store1 < 72.339  and attr store1 > 71.139 ) or 
       bondedto (attr store1 < 24.5991263766  and attr store1 > 23.3991263766 ))) 
6 0.1 0.1 peak 607 volume 7.67010 ppm1 1.556 ppm2 4.074
 
! ############### hot_mothernoesy_072403.608 folded +
assi (attr store1 < 3.812 and attr store1 > 3.612 )
     ((attr store1 < 1.603 and attr store1 > 1.503 ) and 
      (bondedto (attr store1 < 120.102873623  and attr store1 > 118.902873623 ) or 
       bondedto (attr store1 < 72.363  and attr store1 > 71.163 ) or 
       bondedto (attr store1 < 24.6231263766  and attr store1 > 23.4231263766 ))) 
6 0.1 0.1 peak 608 volume 9.20240 ppm1 1.553 ppm2 3.712
 
! ############### hot_mothernoesy_072403.609 folded +
assi (attr store1 < 3.658 and attr store1 > 3.458 )
     ((attr store1 < 1.605 and attr store1 > 1.505 ) and 
      (bondedto (attr store1 < 120.116873623  and attr store1 > 118.916873623 ) or 
       bondedto (attr store1 < 72.377  and attr store1 > 71.177 ) or 
       bondedto (attr store1 < 24.6371263766  and attr store1 > 23.4371263766 ))) 
6 0.1 0.1 peak 609 volume 4.96980 ppm1 1.555 ppm2 3.558
 
! ############### hot_mothernoesy_072403.610 folded +
assi (attr store1 < 3.332 and attr store1 > 3.132 )
     ((attr store1 < 1.604 and attr store1 > 1.504 ) and 
      (bondedto (attr store1 < 120.095873623  and attr store1 > 118.895873623 ) or 
       bondedto (attr store1 < 72.356  and attr store1 > 71.156 ) or 
       bondedto (attr store1 < 24.6161263766  and attr store1 > 23.4161263766 ))) 
6 0.1 0.1 peak 610 volume 6.95900 ppm1 1.554 ppm2 3.232
 
! ############### hot_mothernoesy_072403.611 folded +
assi (attr store1 < 3.16 and attr store1 > 2.96 )
     ((attr store1 < 1.603 and attr store1 > 1.503 ) and 
      (bondedto (attr store1 < 120.086873623  and attr store1 > 118.886873623 ) or 
       bondedto (attr store1 < 72.347  and attr store1 > 71.147 ) or 
       bondedto (attr store1 < 24.6071263766  and attr store1 > 23.4071263766 ))) 
6 0.1 0.1 peak 611 volume 3.89490 ppm1 1.553 ppm2 3.060
 
! ############### hot_mothernoesy_072403.612 folded +
assi (attr store1 < 2.605 and attr store1 > 2.405 )
     ((attr store1 < 1.605 and attr store1 > 1.505 ) and 
      (bondedto (attr store1 < 120.065873623  and attr store1 > 118.865873623 ) or 
       bondedto (attr store1 < 72.326  and attr store1 > 71.126 ) or 
       bondedto (attr store1 < 24.5861263766  and attr store1 > 23.3861263766 ))) 
6 0.1 0.1 peak 612 volume 7.36700 ppm1 1.555 ppm2 2.505
 
! ############### hot_mothernoesy_072403.613 folded +
assi (attr store1 < 1.646 and attr store1 > 1.446 )
     ((attr store1 < 1.604 and attr store1 > 1.504 ) and 
      (bondedto (attr store1 < 120.059873623  and attr store1 > 118.859873623 ) or 
       bondedto (attr store1 < 72.32  and attr store1 > 71.12 ) or 
       bondedto (attr store1 < 24.5801263766  and attr store1 > 23.3801263766 ))) 
6 0.1 0.1 peak 613 volume 121.59150 ppm1 1.554 ppm2 1.546
 
! ############### hot_mothernoesy_072403.614 folded +
assi (attr store1 < 1.35 and attr store1 > 1.15 )
     ((attr store1 < 1.605 and attr store1 > 1.505 ) and 
      (bondedto (attr store1 < 120.102873623  and attr store1 > 118.902873623 ) or 
       bondedto (attr store1 < 72.363  and attr store1 > 71.163 ) or 
       bondedto (attr store1 < 24.6231263766  and attr store1 > 23.4231263766 ))) 
6 0.1 0.1 peak 614 volume 4.60260 ppm1 1.555 ppm2 1.250
 
! ############### hot_mothernoesy_072403.615 folded +
assi (attr store1 < 0.912 and attr store1 > 0.712 )
     ((attr store1 < 1.607 and attr store1 > 1.507 ) and 
      (bondedto (attr store1 < 120.093873623  and attr store1 > 118.893873623 ) or 
       bondedto (attr store1 < 72.354  and attr store1 > 71.154 ) or 
       bondedto (attr store1 < 24.6141263766  and attr store1 > 23.4141263766 ))) 
6 0.1 0.1 peak 615 volume 4.49090 ppm1 1.557 ppm2 0.812
 
! ############### hot_mothernoesy_072403.616 folded -
assi (attr store1 < 4.755 and attr store1 > 4.555 )
     ((attr store1 < 0.962 and attr store1 > 0.862 ) and 
      (bondedto (attr store1 < 143.869810435  and attr store1 > 142.669810435 ) or 
       bondedto (attr store1 < 48.3900631883  and attr store1 > 47.1900631883 ))) 
6 0.1 0.1 peak 616 volume 7.7924 ppm1 0.912 ppm2 4.655
 
! ############### hot_mothernoesy_072403.617 folded -
assi (attr store1 < 1.81 and attr store1 > 1.61 )
     ((attr store1 < 0.963 and attr store1 > 0.863 ) and 
      (bondedto (attr store1 < 143.861810435  and attr store1 > 142.661810435 ) or 
       bondedto (attr store1 < 48.3820631883  and attr store1 > 47.1820631883 ))) 
6 0.1 0.1 peak 617 volume 10.2646 ppm1 0.913 ppm2 1.710
 
! ############### hot_mothernoesy_072403.618 folded -
assi (attr store1 < 0.71 and attr store1 > 0.51 )
     ((attr store1 < 0.961 and attr store1 > 0.861 ) and 
      (bondedto (attr store1 < 143.892810435  and attr store1 > 142.692810435 ) or 
       bondedto (attr store1 < 48.4130631883  and attr store1 > 47.2130631883 ))) 
6 0.1 0.1 peak 618 volume 4.6498 ppm1 0.911 ppm2 0.610
 
! ############### hot_mothernoesy_072403.619 folded -
assi (attr store1 < 1.911 and attr store1 > 1.711 )
     ((attr store1 < 0.954 and attr store1 > 0.854 ) and 
      (bondedto (attr store1 < 143.861810435  and attr store1 > 142.661810435 ) or 
       bondedto (attr store1 < 48.3820631883  and attr store1 > 47.1820631883 ))) 
6 0.1 0.1 peak 619 volume 9.2874 ppm1 0.904 ppm2 1.811
 
! ############### hot_mothernoesy_072403.620 folded -
assi (attr store1 < 1.667 and attr store1 > 1.467 )
     ((attr store1 < 0.959 and attr store1 > 0.859 ) and 
      (bondedto (attr store1 < 143.889810435  and attr store1 > 142.689810435 ) or 
       bondedto (attr store1 < 48.4100631883  and attr store1 > 47.2100631883 ))) 
6 0.1 0.1 peak 620 volume 4.1685 ppm1 0.909 ppm2 1.567
 
! ############### hot_mothernoesy_072403.621 folded -
assi (attr store1 < 1.014 and attr store1 > 0.814 )
     ((attr store1 < 0.958 and attr store1 > 0.858 ) and 
      (bondedto (attr store1 < 143.886810435  and attr store1 > 142.686810435 ) or 
       bondedto (attr store1 < 48.4070631883  and attr store1 > 47.2070631883 ))) 
6 0.1 0.1 peak 621 volume 434.46451 ppm1 0.908 ppm2 0.914
 
! ############### hot_mothernoesy_072403.622 folded +
assi (attr store1 < 3.871 and attr store1 > 3.671 )
     ((attr store1 < 0.999 and attr store1 > 0.899 ) and 
      (bondedto (attr store1 < 119.818873623  and attr store1 > 118.618873623 ) or 
       bondedto (attr store1 < 72.079  and attr store1 > 70.879 ) or 
       bondedto (attr store1 < 24.3391263766  and attr store1 > 23.1391263766 ))) 
6 0.1 0.1 peak 622 volume 3.88300 ppm1 0.949 ppm2 3.771
 
! ############### hot_mothernoesy_072403.623 folded +
assi (attr store1 < 4.006 and attr store1 > 3.806 )
     ((attr store1 < 0.997 and attr store1 > 0.897 ) and 
      (bondedto (attr store1 < 119.814873623  and attr store1 > 118.614873623 ) or 
       bondedto (attr store1 < 72.075  and attr store1 > 70.875 ) or 
       bondedto (attr store1 < 24.3351263766  and attr store1 > 23.1351263766 ))) 
6 0.1 0.1 peak 623 volume 11.30590 ppm1 0.947 ppm2 3.906
 
! ############### hot_mothernoesy_072403.624 folded +
assi (attr store1 < 3.092 and attr store1 > 2.892 )
     ((attr store1 < 0.998 and attr store1 > 0.898 ) and 
      (bondedto (attr store1 < 119.806873623  and attr store1 > 118.606873623 ) or 
       bondedto (attr store1 < 72.067  and attr store1 > 70.867 ) or 
       bondedto (attr store1 < 24.3271263766  and attr store1 > 23.1271263766 ))) 
6 0.1 0.1 peak 624 volume 3.32480 ppm1 0.948 ppm2 2.992
 
! ############### hot_mothernoesy_072403.625 folded +
assi (attr store1 < 2.377 and attr store1 > 2.177 )
     ((attr store1 < 0.997 and attr store1 > 0.897 ) and 
      (bondedto (attr store1 < 119.826873623  and attr store1 > 118.626873623 ) or 
       bondedto (attr store1 < 72.087  and attr store1 > 70.887 ) or 
       bondedto (attr store1 < 24.3471263766  and attr store1 > 23.1471263766 ))) 
6 0.1 0.1 peak 625 volume 5.86350 ppm1 0.947 ppm2 2.277
 
! ############### hot_mothernoesy_072403.626 folded +
assi (attr store1 < 1.967 and attr store1 > 1.767 )
     ((attr store1 < 0.996 and attr store1 > 0.896 ) and 
      (bondedto (attr store1 < 119.801873623  and attr store1 > 118.601873623 ) or 
       bondedto (attr store1 < 72.062  and attr store1 > 70.862 ) or 
       bondedto (attr store1 < 24.3221263766  and attr store1 > 23.1221263766 ))) 
6 0.1 0.1 peak 626 volume 10.19260 ppm1 0.946 ppm2 1.867
 
! ############### hot_mothernoesy_072403.627 folded +
assi (attr store1 < 1.446 and attr store1 > 1.246 )
     ((attr store1 < 0.997 and attr store1 > 0.897 ) and 
      (bondedto (attr store1 < 119.819873623  and attr store1 > 118.619873623 ) or 
       bondedto (attr store1 < 72.08  and attr store1 > 70.88 ) or 
       bondedto (attr store1 < 24.3401263766  and attr store1 > 23.1401263766 ))) 
6 0.1 0.1 peak 627 volume 11.97530 ppm1 0.947 ppm2 1.346
 
! ############### hot_mothernoesy_072403.628 folded +
assi (attr store1 < 1.324 and attr store1 > 1.124 )
     ((attr store1 < 0.997 and attr store1 > 0.897 ) and 
      (bondedto (attr store1 < 119.808873623  and attr store1 > 118.608873623 ) or 
       bondedto (attr store1 < 72.069  and attr store1 > 70.869 ) or 
       bondedto (attr store1 < 24.3291263766  and attr store1 > 23.1291263766 ))) 
6 0.1 0.1 peak 628 volume 14.53110 ppm1 0.947 ppm2 1.224
 
! ############### hot_mothernoesy_072403.629 folded -
assi (attr store1 < 5.173 and attr store1 > 4.973 )
     ((attr store1 < 0.856 and attr store1 > 0.756 ) and 
      (bondedto (attr store1 < 143.674810435  and attr store1 > 142.474810435 ) or 
       bondedto (attr store1 < 48.1950631883  and attr store1 > 46.9950631883 ))) 
6 0.1 0.1 peak 629 volume 4.6137 ppm1 0.806 ppm2 5.073
 
! ############### hot_mothernoesy_072403.630 folded -
assi (attr store1 < 2.307 and attr store1 > 2.107 )
     ((attr store1 < 0.85 and attr store1 > 0.75 ) and 
      (bondedto (attr store1 < 143.644810435  and attr store1 > 142.444810435 ) or 
       bondedto (attr store1 < 48.1650631883  and attr store1 > 46.9650631883 ))) 
6 0.1 0.1 peak 630 volume 4.423 ppm1 0.800 ppm2 2.207
 
! ############### hot_mothernoesy_072403.631 folded -
assi (attr store1 < 4.353 and attr store1 > 4.153 )
     ((attr store1 < 1.066 and attr store1 > 0.966 ) and 
      (bondedto (attr store1 < 143.569810435  and attr store1 > 142.369810435 ) or 
       bondedto (attr store1 < 48.0900631883  and attr store1 > 46.8900631883 ))) 
6 0.1 0.1 peak 631 volume 3.1942 ppm1 1.016 ppm2 4.253
 
! ############### hot_mothernoesy_072403.632 folded -
assi (attr store1 < 2.429 and attr store1 > 2.229 )
     ((attr store1 < 1.066 and attr store1 > 0.966 ) and 
      (bondedto (attr store1 < 143.580810435  and attr store1 > 142.380810435 ) or 
       bondedto (attr store1 < 48.1010631883  and attr store1 > 46.9010631883 ))) 
6 0.1 0.1 peak 632 volume 4.7233 ppm1 1.016 ppm2 2.329
 
! ############### hot_mothernoesy_072403.633 folded -
assi (attr store1 < 4.206 and attr store1 > 4.006 )
     ((attr store1 < 0.851 and attr store1 > 0.751 ) and 
      (bondedto (attr store1 < 143.595810435  and attr store1 > 142.395810435 ) or 
       bondedto (attr store1 < 48.1160631883  and attr store1 > 46.9160631883 ))) 
6 0.1 0.1 peak 633 volume 7.78 ppm1 0.801 ppm2 4.106
 
! ############### hot_mothernoesy_072403.634 folded -
assi (attr store1 < 1.862 and attr store1 > 1.662 )
     ((attr store1 < 0.85 and attr store1 > 0.75 ) and 
      (bondedto (attr store1 < 143.628810435  and attr store1 > 142.428810435 ) or 
       bondedto (attr store1 < 48.1490631883  and attr store1 > 46.9490631883 ))) 
6 0.1 0.1 peak 634 volume 3.397 ppm1 0.800 ppm2 1.762
 
! ############### hot_mothernoesy_072403.635 folded -
assi (attr store1 < 1.675 and attr store1 > 1.475 )
     ((attr store1 < 0.851 and attr store1 > 0.751 ) and 
      (bondedto (attr store1 < 143.622810435  and attr store1 > 142.422810435 ) or 
       bondedto (attr store1 < 48.1430631883  and attr store1 > 46.9430631883 ))) 
6 0.1 0.1 peak 635 volume 11.8979 ppm1 0.801 ppm2 1.575
 
! ############### hot_mothernoesy_072403.636 folded -
assi (attr store1 < 0.902 and attr store1 > 0.702 )
     ((attr store1 < 0.851 and attr store1 > 0.751 ) and 
      (bondedto (attr store1 < 143.630810435  and attr store1 > 142.430810435 ) or 
       bondedto (attr store1 < 48.1510631883  and attr store1 > 46.9510631883 ))) 
6 0.1 0.1 peak 636 volume 240.853 ppm1 0.801 ppm2 0.802
 
! ############### hot_mothernoesy_072403.637 folded +
assi (attr store1 < 4.567 and attr store1 > 4.367 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.620873623  and attr store1 > 118.420873623 ) or 
       bondedto (attr store1 < 71.881  and attr store1 > 70.681 ) or 
       bondedto (attr store1 < 24.1411263766  and attr store1 > 22.9411263766 ))) 
6 0.1 0.1 peak 637 volume 4.98220 ppm1 1.526 ppm2 4.467
 
! ############### hot_mothernoesy_072403.638 folded +
assi (attr store1 < 4.17 and attr store1 > 3.97 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.620873623  and attr store1 > 118.420873623 ) or 
       bondedto (attr store1 < 71.881  and attr store1 > 70.681 ) or 
       bondedto (attr store1 < 24.1411263766  and attr store1 > 22.9411263766 ))) 
6 0.1 0.1 peak 638 volume 16.76990 ppm1 1.526 ppm2 4.070
 
! ############### hot_mothernoesy_072403.639 folded +
assi (attr store1 < 3.967 and attr store1 > 3.767 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.623873623  and attr store1 > 118.423873623 ) or 
       bondedto (attr store1 < 71.884  and attr store1 > 70.684 ) or 
       bondedto (attr store1 < 24.1441263766  and attr store1 > 22.9441263766 ))) 
6 0.1 0.1 peak 639 volume 10.95040 ppm1 1.526 ppm2 3.867
 
! ############### hot_mothernoesy_072403.640 folded +
assi (attr store1 < 3.471 and attr store1 > 3.271 )
     ((attr store1 < 1.575 and attr store1 > 1.475 ) and 
      (bondedto (attr store1 < 119.615873623  and attr store1 > 118.415873623 ) or 
       bondedto (attr store1 < 71.876  and attr store1 > 70.676 ) or 
       bondedto (attr store1 < 24.1361263766  and attr store1 > 22.9361263766 ))) 
6 0.1 0.1 peak 640 volume 8.00860 ppm1 1.525 ppm2 3.371
 
! ############### hot_mothernoesy_072403.641 folded +
assi (attr store1 < 3.157 and attr store1 > 2.957 )
     ((attr store1 < 1.577 and attr store1 > 1.477 ) and 
      (bondedto (attr store1 < 119.656873623  and attr store1 > 118.456873623 ) or 
       bondedto (attr store1 < 71.917  and attr store1 > 70.717 ) or 
       bondedto (attr store1 < 24.1771263766  and attr store1 > 22.9771263766 ))) 
6 0.1 0.1 peak 641 volume 4.03700 ppm1 1.527 ppm2 3.057
 
! ############### hot_mothernoesy_072403.642 folded +
assi (attr store1 < 3.061 and attr store1 > 2.861 )
     ((attr store1 < 1.575 and attr store1 > 1.475 ) and 
      (bondedto (attr store1 < 119.616873623  and attr store1 > 118.416873623 ) or 
       bondedto (attr store1 < 71.877  and attr store1 > 70.677 ) or 
       bondedto (attr store1 < 24.1371263766  and attr store1 > 22.9371263766 ))) 
6 0.1 0.1 peak 642 volume 4.27600 ppm1 1.525 ppm2 2.961
 
! ############### hot_mothernoesy_072403.643 folded +
assi (attr store1 < 2.606 and attr store1 > 2.406 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.625873623  and attr store1 > 118.425873623 ) or 
       bondedto (attr store1 < 71.886  and attr store1 > 70.686 ) or 
       bondedto (attr store1 < 24.1461263766  and attr store1 > 22.9461263766 ))) 
6 0.1 0.1 peak 643 volume 17.60050 ppm1 1.526 ppm2 2.506
 
! ############### hot_mothernoesy_072403.644 folded +
assi (attr store1 < 2.228 and attr store1 > 2.028 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.627873623  and attr store1 > 118.427873623 ) or 
       bondedto (attr store1 < 71.888  and attr store1 > 70.688 ) or 
       bondedto (attr store1 < 24.1481263766  and attr store1 > 22.9481263766 ))) 
6 0.1 0.1 peak 644 volume 10.05710 ppm1 1.526 ppm2 2.128
 
! ############### hot_mothernoesy_072403.645 folded +
assi (attr store1 < 2.115 and attr store1 > 1.915 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.611873623  and attr store1 > 118.411873623 ) or 
       bondedto (attr store1 < 71.872  and attr store1 > 70.672 ) or 
       bondedto (attr store1 < 24.1321263766  and attr store1 > 22.9321263766 ))) 
6 0.1 0.1 peak 645 volume 6.49470 ppm1 1.526 ppm2 2.015
 
! ############### hot_mothernoesy_072403.646 folded +
assi (attr store1 < 1.627 and attr store1 > 1.427 )
     ((attr store1 < 1.575 and attr store1 > 1.475 ) and 
      (bondedto (attr store1 < 119.630873623  and attr store1 > 118.430873623 ) or 
       bondedto (attr store1 < 71.891  and attr store1 > 70.691 ) or 
       bondedto (attr store1 < 24.1511263766  and attr store1 > 22.9511263766 ))) 
6 0.1 0.1 peak 646 volume 232.27200 ppm1 1.525 ppm2 1.527
 
! ############### hot_mothernoesy_072403.647 folded +
assi (attr store1 < 1.355 and attr store1 > 1.155 )
     ((attr store1 < 1.574 and attr store1 > 1.474 ) and 
      (bondedto (attr store1 < 119.636873623  and attr store1 > 118.436873623 ) or 
       bondedto (attr store1 < 71.897  and attr store1 > 70.697 ) or 
       bondedto (attr store1 < 24.1571263766  and attr store1 > 22.9571263766 ))) 
6 0.1 0.1 peak 647 volume 4.02980 ppm1 1.524 ppm2 1.255
 
! ############### hot_mothernoesy_072403.648 folded +
assi (attr store1 < 1.031 and attr store1 > 0.831 )
     ((attr store1 < 1.575 and attr store1 > 1.475 ) and 
      (bondedto (attr store1 < 119.624873623  and attr store1 > 118.424873623 ) or 
       bondedto (attr store1 < 71.885  and attr store1 > 70.685 ) or 
       bondedto (attr store1 < 24.1451263766  and attr store1 > 22.9451263766 ))) 
6 0.1 0.1 peak 648 volume 19.47660 ppm1 1.525 ppm2 0.931
 
! ############### hot_mothernoesy_072403.649 folded +
assi (attr store1 < 0.912 and attr store1 > 0.712 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.622873623  and attr store1 > 118.422873623 ) or 
       bondedto (attr store1 < 71.883  and attr store1 > 70.683 ) or 
       bondedto (attr store1 < 24.1431263766  and attr store1 > 22.9431263766 ))) 
6 0.1 0.1 peak 649 volume 8.72680 ppm1 1.526 ppm2 0.812
 
! ############### hot_mothernoesy_072403.650 folded -
assi (attr store1 < 3.959 and attr store1 > 3.759 )
     ((attr store1 < 3.913 and attr store1 > 3.813 ) and 
      (bondedto (attr store1 < 143.503810435  and attr store1 > 142.303810435 ) or 
       bondedto (attr store1 < 48.0240631883  and attr store1 > 46.8240631883 ))) 
6 0.1 0.1 peak 650 volume 4.2387 ppm1 3.863 ppm2 3.859
 
! ############### hot_mothernoesy_072403.651 folded -
assi (attr store1 < 3.617 and attr store1 > 3.417 )
     ((attr store1 < 3.909 and attr store1 > 3.809 ) and 
      (bondedto (attr store1 < 143.511810435  and attr store1 > 142.311810435 ) or 
       bondedto (attr store1 < 48.0320631883  and attr store1 > 46.8320631883 ))) 
6 0.1 0.1 peak 651 volume 4.1042 ppm1 3.859 ppm2 3.517
 
! ############### hot_mothernoesy_072403.652 folded -
assi (attr store1 < 3.966 and attr store1 > 3.766 )
     ((attr store1 < 3.554 and attr store1 > 3.454 ) and 
      (bondedto (attr store1 < 143.476810435  and attr store1 > 142.276810435 ) or 
       bondedto (attr store1 < 47.9970631883  and attr store1 > 46.7970631883 ))) 
6 0.1 0.1 peak 652 volume 3.5452 ppm1 3.504 ppm2 3.866
 
! ############### hot_mothernoesy_072403.653 folded -
assi (attr store1 < 3.609 and attr store1 > 3.409 )
     ((attr store1 < 3.557 and attr store1 > 3.457 ) and 
      (bondedto (attr store1 < 143.490810435  and attr store1 > 142.290810435 ) or 
       bondedto (attr store1 < 48.0110631883  and attr store1 > 46.8110631883 ))) 
6 0.1 0.1 peak 653 volume 4.8347 ppm1 3.507 ppm2 3.509
 
! ############### hot_mothernoesy_072403.656 folded +
assi (attr store1 < 1.826 and attr store1 > 1.626 )
     ((attr store1 < 0.963 and attr store1 > 0.863 ) and 
      (bondedto (attr store1 < 119.489873623  and attr store1 > 118.289873623 ) or 
       bondedto (attr store1 < 71.75  and attr store1 > 70.55 ) or 
       bondedto (attr store1 < 24.0101263766  and attr store1 > 22.8101263766 ))) 
6 0.1 0.1 peak 656 volume 27.93860 ppm1 0.913 ppm2 1.726
 
! ############### hot_mothernoesy_072403.657 folded -
assi (attr store1 < 4.374 and attr store1 > 4.174 )
     ((attr store1 < 0.95 and attr store1 > 0.85 ) and 
      (bondedto (attr store1 < 143.449810435  and attr store1 > 142.249810435 ) or 
       bondedto (attr store1 < 47.9700631883  and attr store1 > 46.7700631883 ))) 
6 0.1 0.1 peak 657 volume 6.4356 ppm1 0.900 ppm2 4.274
 
! ############### hot_mothernoesy_072403.658 folded -
assi (attr store1 < 1.488 and attr store1 > 1.288 )
     ((attr store1 < 0.78 and attr store1 > 0.68 ) and 
      (bondedto (attr store1 < 143.365810435  and attr store1 > 142.165810435 ) or 
       bondedto (attr store1 < 47.8860631883  and attr store1 > 46.6860631883 ))) 
6 0.1 0.1 peak 658 volume 3.5165 ppm1 0.730 ppm2 1.388
 
! ############### hot_mothernoesy_072403.659 folded +
assi (attr store1 < 4.58 and attr store1 > 4.38 )
     ((attr store1 < 0.971 and attr store1 > 0.871 ) and 
      (bondedto (attr store1 < 119.420873623  and attr store1 > 118.220873623 ) or 
       bondedto (attr store1 < 71.681  and attr store1 > 70.481 ) or 
       bondedto (attr store1 < 23.9411263766  and attr store1 > 22.7411263766 ))) 
6 0.1 0.1 peak 659 volume 3.54820 ppm1 0.921 ppm2 4.480
 
! ############### hot_mothernoesy_072403.661 folded +
assi (attr store1 < 2.141 and attr store1 > 1.941 )
     ((attr store1 < 0.963 and attr store1 > 0.863 ) and 
      (bondedto (attr store1 < 119.462873623  and attr store1 > 118.262873623 ) or 
       bondedto (attr store1 < 71.723  and attr store1 > 70.523 ) or 
       bondedto (attr store1 < 23.9831263766  and attr store1 > 22.7831263766 ))) 
6 0.1 0.1 peak 661 volume 7.39050 ppm1 0.913 ppm2 2.041
 
! ############### hot_mothernoesy_072403.662 folded +
assi (attr store1 < 1.663 and attr store1 > 1.463 )
     ((attr store1 < 0.963 and attr store1 > 0.863 ) and 
      (bondedto (attr store1 < 119.481873623  and attr store1 > 118.281873623 ) or 
       bondedto (attr store1 < 71.742  and attr store1 > 70.542 ) or 
       bondedto (attr store1 < 24.0021263766  and attr store1 > 22.8021263766 ))) 
6 0.1 0.1 peak 662 volume 19.40720 ppm1 0.913 ppm2 1.563
 
! ############### hot_mothernoesy_072403.663 folded +
assi (attr store1 < 1.015 and attr store1 > 0.815 )
     ((attr store1 < 0.965 and attr store1 > 0.865 ) and 
      (bondedto (attr store1 < 119.408873623  and attr store1 > 118.208873623 ) or 
       bondedto (attr store1 < 71.669  and attr store1 > 70.469 ) or 
       bondedto (attr store1 < 23.9291263766  and attr store1 > 22.7291263766 ))) 
6 0.1 0.1 peak 663 volume 916.53900 ppm1 0.915 ppm2 0.915
 
! ############### hot_mothernoesy_072403.666 folded -
assi (attr store1 < 1.083 and attr store1 > 0.883 )
     ((attr store1 < 0.778 and attr store1 > 0.678 ) and 
      (bondedto (attr store1 < 143.326810435  and attr store1 > 142.126810435 ) or 
       bondedto (attr store1 < 47.8470631883  and attr store1 > 46.6470631883 ))) 
6 0.1 0.1 peak 666 volume 9.0651 ppm1 0.728 ppm2 0.983
 
! ############### hot_mothernoesy_072403.667 folded -
assi (attr store1 < 0.827 and attr store1 > 0.627 )
     ((attr store1 < 0.777 and attr store1 > 0.677 ) and 
      (bondedto (attr store1 < 143.313810435  and attr store1 > 142.113810435 ) or 
       bondedto (attr store1 < 47.8340631883  and attr store1 > 46.6340631883 ))) 
6 0.1 0.1 peak 667 volume 29.8211 ppm1 0.727 ppm2 0.727
 
! ############### hot_mothernoesy_072403.668 folded -
assi (attr store1 < 1.118 and attr store1 > 0.918 )
     ((attr store1 < 1.19 and attr store1 > 1.09 ) and 
      (bondedto (attr store1 < 143.232810435  and attr store1 > 142.032810435 ) or 
       bondedto (attr store1 < 47.7530631883  and attr store1 > 46.5530631883 ))) 
6 0.1 0.1 peak 668 volume 14.1451 ppm1 1.140 ppm2 1.018
 
! ############### hot_mothernoesy_072403.669 folded -
assi (attr store1 < 4.269 and attr store1 > 4.069 )
     ((attr store1 < 0.662 and attr store1 > 0.562 ) and 
      (bondedto (attr store1 < 143.210810435  and attr store1 > 142.010810435 ) or 
       bondedto (attr store1 < 47.7310631883  and attr store1 > 46.5310631883 ))) 
6 0.1 0.1 peak 669 volume 7.1604 ppm1 0.612 ppm2 4.169
 
! ############### hot_mothernoesy_072403.670 folded -
assi (attr store1 < 1.666 and attr store1 > 1.466 )
     ((attr store1 < 0.663 and attr store1 > 0.563 ) and 
      (bondedto (attr store1 < 143.203810435  and attr store1 > 142.003810435 ) or 
       bondedto (attr store1 < 47.7240631883  and attr store1 > 46.5240631883 ))) 
6 0.1 0.1 peak 670 volume 5.5309 ppm1 0.613 ppm2 1.566
 
! ############### hot_mothernoesy_072403.671 folded -
assi (attr store1 < 1.338 and attr store1 > 1.138 )
     ((attr store1 < 0.662 and attr store1 > 0.562 ) and 
      (bondedto (attr store1 < 143.184810435  and attr store1 > 141.984810435 ) or 
       bondedto (attr store1 < 47.7050631883  and attr store1 > 46.5050631883 ))) 
6 0.1 0.1 peak 671 volume 5.1262 ppm1 0.612 ppm2 1.238
 
! ############### hot_mothernoesy_072403.672 folded -
assi (attr store1 < 1.09 and attr store1 > 0.89 )
     ((attr store1 < 0.663 and attr store1 > 0.563 ) and 
      (bondedto (attr store1 < 143.221810435  and attr store1 > 142.021810435 ) or 
       bondedto (attr store1 < 47.7420631883  and attr store1 > 46.5420631883 ))) 
6 0.1 0.1 peak 672 volume 4.2084 ppm1 0.613 ppm2 0.990
 
! ############### hot_mothernoesy_072403.673 folded -
assi (attr store1 < 0.711 and attr store1 > 0.511 )
     ((attr store1 < 0.662 and attr store1 > 0.562 ) and 
      (bondedto (attr store1 < 143.195810435  and attr store1 > 141.995810435 ) or 
       bondedto (attr store1 < 47.7160631883  and attr store1 > 46.5160631883 ))) 
6 0.1 0.1 peak 673 volume 133.7449 ppm1 0.612 ppm2 0.611
 
! ############### hot_mothernoesy_072403.674 folded -
assi (attr store1 < 0.257 and attr store1 > 0.057 )
     ((attr store1 < 0.661 and attr store1 > 0.561 ) and 
      (bondedto (attr store1 < 143.196810435  and attr store1 > 141.996810435 ) or 
       bondedto (attr store1 < 47.7170631883  and attr store1 > 46.5170631883 ))) 
6 0.1 0.1 peak 674 volume 9.8718 ppm1 0.611 ppm2 0.157
 
! ############### hot_mothernoesy_072403.675 folded -
assi (attr store1 < 1.01 and attr store1 > 0.81 )
     ((attr store1 < 0.659 and attr store1 > 0.559 ) and 
      (bondedto (attr store1 < 143.231810435  and attr store1 > 142.031810435 ) or 
       bondedto (attr store1 < 47.7520631883  and attr store1 > 46.5520631883 ))) 
6 0.1 0.1 peak 675 volume 4.0236 ppm1 0.609 ppm2 0.910
 
! ############### hot_mothernoesy_072403.676 folded +
assi (attr store1 < 5.175 and attr store1 > 4.975 )
     ((attr store1 < 0.857 and attr store1 > 0.757 ) and 
      (bondedto (attr store1 < 119.288873623  and attr store1 > 118.088873623 ) or 
       bondedto (attr store1 < 71.549  and attr store1 > 70.349 ) or 
       bondedto (attr store1 < 23.8091263766  and attr store1 > 22.6091263766 ))) 
6 0.1 0.1 peak 676 volume 20.21020 ppm1 0.807 ppm2 5.075
 
! ############### hot_mothernoesy_072403.677 folded +
assi (attr store1 < 3.473 and attr store1 > 3.273 )
     ((attr store1 < 0.856 and attr store1 > 0.756 ) and 
      (bondedto (attr store1 < 119.287873623  and attr store1 > 118.087873623 ) or 
       bondedto (attr store1 < 71.548  and attr store1 > 70.348 ) or 
       bondedto (attr store1 < 23.8081263766  and attr store1 > 22.6081263766 ))) 
6 0.1 0.1 peak 677 volume 6.05240 ppm1 0.806 ppm2 3.373
 
! ############### hot_mothernoesy_072403.678 folded +
assi (attr store1 < 2.981 and attr store1 > 2.781 )
     ((attr store1 < 0.856 and attr store1 > 0.756 ) and 
      (bondedto (attr store1 < 119.272873623  and attr store1 > 118.072873623 ) or 
       bondedto (attr store1 < 71.533  and attr store1 > 70.333 ) or 
       bondedto (attr store1 < 23.7931263766  and attr store1 > 22.5931263766 ))) 
6 0.1 0.1 peak 678 volume 3.33420 ppm1 0.806 ppm2 2.881
 
! ############### hot_mothernoesy_072403.679 folded +
assi (attr store1 < 2.62 and attr store1 > 2.42 )
     ((attr store1 < 0.856 and attr store1 > 0.756 ) and 
      (bondedto (attr store1 < 119.249873623  and attr store1 > 118.049873623 ) or 
       bondedto (attr store1 < 71.51  and attr store1 > 70.31 ) or 
       bondedto (attr store1 < 23.7701263766  and attr store1 > 22.5701263766 ))) 
6 0.1 0.1 peak 679 volume 4.70010 ppm1 0.806 ppm2 2.520
 
! ############### hot_mothernoesy_072403.680 folded +
assi (attr store1 < 2.43 and attr store1 > 2.23 )
     ((attr store1 < 0.857 and attr store1 > 0.757 ) and 
      (bondedto (attr store1 < 119.267873623  and attr store1 > 118.067873623 ) or 
       bondedto (attr store1 < 71.528  and attr store1 > 70.328 ) or 
       bondedto (attr store1 < 23.7881263766  and attr store1 > 22.5881263766 ))) 
6 0.1 0.1 peak 680 volume 12.35670 ppm1 0.807 ppm2 2.330
 
! ############### hot_mothernoesy_072403.681 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 0.851 and attr store1 > 0.751 ) and 
      (bondedto (attr store1 < 119.210873623  and attr store1 > 118.010873623 ) or 
       bondedto (attr store1 < 71.471  and attr store1 > 70.271 ) or 
       bondedto (attr store1 < 23.7311263766  and attr store1 > 22.5311263766 ))) 
6 0.1 0.1 peak 681 volume 9.06100 ppm1 0.801 ppm2 4.773
 
! ############### hot_mothernoesy_072403.682 folded +
assi (attr store1 < 3.961 and attr store1 > 3.761 )
     ((attr store1 < 0.855 and attr store1 > 0.755 ) and 
      (bondedto (attr store1 < 119.235873623  and attr store1 > 118.035873623 ) or 
       bondedto (attr store1 < 71.496  and attr store1 > 70.296 ) or 
       bondedto (attr store1 < 23.7561263766  and attr store1 > 22.5561263766 ))) 
6 0.1 0.1 peak 682 volume 6.25840 ppm1 0.805 ppm2 3.861
 
! ############### hot_mothernoesy_072403.683 folded +
assi (attr store1 < 3.149 and attr store1 > 2.949 )
     ((attr store1 < 0.855 and attr store1 > 0.755 ) and 
      (bondedto (attr store1 < 119.262873623  and attr store1 > 118.062873623 ) or 
       bondedto (attr store1 < 71.523  and attr store1 > 70.323 ) or 
       bondedto (attr store1 < 23.7831263766  and attr store1 > 22.5831263766 ))) 
6 0.1 0.1 peak 683 volume 6.70960 ppm1 0.805 ppm2 3.049
 
! ############### hot_mothernoesy_072403.684 folded +
assi (attr store1 < 2.283 and attr store1 > 2.083 )
     ((attr store1 < 0.855 and attr store1 > 0.755 ) and 
      (bondedto (attr store1 < 119.250873623  and attr store1 > 118.050873623 ) or 
       bondedto (attr store1 < 71.511  and attr store1 > 70.311 ) or 
       bondedto (attr store1 < 23.7711263766  and attr store1 > 22.5711263766 ))) 
6 0.1 0.1 peak 684 volume 13.25950 ppm1 0.805 ppm2 2.183
 
! ############### hot_mothernoesy_072403.685 folded +
assi (attr store1 < 2.13 and attr store1 > 1.93 )
     ((attr store1 < 0.854 and attr store1 > 0.754 ) and 
      (bondedto (attr store1 < 119.236873623  and attr store1 > 118.036873623 ) or 
       bondedto (attr store1 < 71.497  and attr store1 > 70.297 ) or 
       bondedto (attr store1 < 23.7571263766  and attr store1 > 22.5571263766 ))) 
6 0.1 0.1 peak 685 volume 5.37310 ppm1 0.804 ppm2 2.030
 
! ############### hot_mothernoesy_072403.686 folded +
assi (attr store1 < 1.675 and attr store1 > 1.475 )
     ((attr store1 < 0.852 and attr store1 > 0.752 ) and 
      (bondedto (attr store1 < 119.210873623  and attr store1 > 118.010873623 ) or 
       bondedto (attr store1 < 71.471  and attr store1 > 70.271 ) or 
       bondedto (attr store1 < 23.7311263766  and attr store1 > 22.5311263766 ))) 
6 0.1 0.1 peak 686 volume 53.48300 ppm1 0.802 ppm2 1.575
 
! ############### hot_mothernoesy_072403.687 folded +
assi (attr store1 < 1.35 and attr store1 > 1.15 )
     ((attr store1 < 0.853 and attr store1 > 0.753 ) and 
      (bondedto (attr store1 < 119.240873623  and attr store1 > 118.040873623 ) or 
       bondedto (attr store1 < 71.501  and attr store1 > 70.301 ) or 
       bondedto (attr store1 < 23.7611263766  and attr store1 > 22.5611263766 ))) 
6 0.1 0.1 peak 687 volume 7.78440 ppm1 0.803 ppm2 1.250
 
! ############### hot_mothernoesy_072403.688 folded -
assi (attr store1 < 4.009 and attr store1 > 3.809 )
     ((attr store1 < 1.189 and attr store1 > 1.089 ) and 
      (bondedto (attr store1 < 143.134810435  and attr store1 > 141.934810435 ) or 
       bondedto (attr store1 < 47.6550631883  and attr store1 > 46.4550631883 ))) 
6 0.1 0.1 peak 688 volume 8.0899 ppm1 1.139 ppm2 3.909
 
! ############### hot_mothernoesy_072403.689 folded -
assi (attr store1 < 2.409 and attr store1 > 2.209 )
     ((attr store1 < 1.19 and attr store1 > 1.09 ) and 
      (bondedto (attr store1 < 143.152810435  and attr store1 > 141.952810435 ) or 
       bondedto (attr store1 < 47.6730631883  and attr store1 > 46.4730631883 ))) 
6 0.1 0.1 peak 689 volume 9.1118 ppm1 1.140 ppm2 2.309
 
! ############### hot_mothernoesy_072403.690 folded -
assi (attr store1 < 1.241 and attr store1 > 1.041 )
     ((attr store1 < 1.191 and attr store1 > 1.091 ) and 
      (bondedto (attr store1 < 143.132810435  and attr store1 > 141.932810435 ) or 
       bondedto (attr store1 < 47.6530631883  and attr store1 > 46.4530631883 ))) 
6 0.1 0.1 peak 690 volume 169.8412 ppm1 1.141 ppm2 1.141
 
! ############### hot_mothernoesy_072403.691 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 1.053 and attr store1 > 0.953 ) and 
      (bondedto (attr store1 < 119.142873623  and attr store1 > 117.942873623 ) or 
       bondedto (attr store1 < 71.403  and attr store1 > 70.203 ) or 
       bondedto (attr store1 < 23.6631263766  and attr store1 > 22.4631263766 ))) 
6 0.1 0.1 peak 691 volume 4.04820 ppm1 1.003 ppm2 4.774
 
! ############### hot_mothernoesy_072403.693 folded +
assi (attr store1 < 3.598 and attr store1 > 3.398 )
     ((attr store1 < 1.06 and attr store1 > 0.96 ) and 
      (bondedto (attr store1 < 119.120873623  and attr store1 > 117.920873623 ) or 
       bondedto (attr store1 < 71.381  and attr store1 > 70.181 ) or 
       bondedto (attr store1 < 23.6411263766  and attr store1 > 22.4411263766 ))) 
6 0.1 0.1 peak 693 volume 7.41600 ppm1 1.010 ppm2 3.498
 
! ############### hot_mothernoesy_072403.695 folded +
assi (attr store1 < 2.126 and attr store1 > 1.926 )
     ((attr store1 < 1.056 and attr store1 > 0.956 ) and 
      (bondedto (attr store1 < 119.125873623  and attr store1 > 117.925873623 ) or 
       bondedto (attr store1 < 71.386  and attr store1 > 70.186 ) or 
       bondedto (attr store1 < 23.6461263766  and attr store1 > 22.4461263766 ))) 
6 0.1 0.1 peak 695 volume 4.08730 ppm1 1.006 ppm2 2.026
 
! ############### hot_mothernoesy_072403.696 folded +
assi (attr store1 < 1.984 and attr store1 > 1.784 )
     ((attr store1 < 1.052 and attr store1 > 0.952 ) and 
      (bondedto (attr store1 < 119.144873623  and attr store1 > 117.944873623 ) or 
       bondedto (attr store1 < 71.405  and attr store1 > 70.205 ) or 
       bondedto (attr store1 < 23.6651263766  and attr store1 > 22.4651263766 ))) 
6 0.1 0.1 peak 696 volume 7.48010 ppm1 1.002 ppm2 1.884
 
! ############### hot_mothernoesy_072403.697 folded +
assi (attr store1 < 1.758 and attr store1 > 1.558 )
     ((attr store1 < 1.056 and attr store1 > 0.956 ) and 
      (bondedto (attr store1 < 119.144873623  and attr store1 > 117.944873623 ) or 
       bondedto (attr store1 < 71.405  and attr store1 > 70.205 ) or 
       bondedto (attr store1 < 23.6651263766  and attr store1 > 22.4651263766 ))) 
6 0.1 0.1 peak 697 volume 4.45850 ppm1 1.006 ppm2 1.658
 
! ############### hot_mothernoesy_072403.698 folded +
assi (attr store1 < 1.104 and attr store1 > 0.904 )
     ((attr store1 < 1.056 and attr store1 > 0.956 ) and 
      (bondedto (attr store1 < 119.131873623  and attr store1 > 117.931873623 ) or 
       bondedto (attr store1 < 71.392  and attr store1 > 70.192 ) or 
       bondedto (attr store1 < 23.6521263766  and attr store1 > 22.4521263766 ))) 
6 0.1 0.1 peak 698 volume 214.88451 ppm1 1.006 ppm2 1.004
 
! ############### hot_mothernoesy_072403.699 folded +
assi (attr store1 < 4.367 and attr store1 > 4.167 )
     ((attr store1 < 0.852 and attr store1 > 0.752 ) and 
      (bondedto (attr store1 < 119.169873623  and attr store1 > 117.969873623 ) or 
       bondedto (attr store1 < 71.43  and attr store1 > 70.23 ) or 
       bondedto (attr store1 < 23.6901263766  and attr store1 > 22.4901263766 ))) 
6 0.1 0.1 peak 699 volume 6.56060 ppm1 0.802 ppm2 4.267
 
! ############### hot_mothernoesy_072403.700 folded +
assi (attr store1 < 4.208 and attr store1 > 4.008 )
     ((attr store1 < 0.851 and attr store1 > 0.751 ) and 
      (bondedto (attr store1 < 119.179873623  and attr store1 > 117.979873623 ) or 
       bondedto (attr store1 < 71.44  and attr store1 > 70.24 ) or 
       bondedto (attr store1 < 23.7001263766  and attr store1 > 22.5001263766 ))) 
6 0.1 0.1 peak 700 volume 32.74970 ppm1 0.801 ppm2 4.108
 
! ############### hot_mothernoesy_072403.701 folded +
assi (attr store1 < 1.862 and attr store1 > 1.662 )
     ((attr store1 < 0.852 and attr store1 > 0.752 ) and 
      (bondedto (attr store1 < 119.203873623  and attr store1 > 118.003873623 ) or 
       bondedto (attr store1 < 71.464  and attr store1 > 70.264 ) or 
       bondedto (attr store1 < 23.7241263766  and attr store1 > 22.5241263766 ))) 
6 0.1 0.1 peak 701 volume 15.68590 ppm1 0.802 ppm2 1.762
 
! ############### hot_mothernoesy_072403.702 folded +
assi (attr store1 < 0.903 and attr store1 > 0.703 )
     ((attr store1 < 0.852 and attr store1 > 0.752 ) and 
      (bondedto (attr store1 < 119.205873623  and attr store1 > 118.005873623 ) or 
       bondedto (attr store1 < 71.466  and attr store1 > 70.266 ) or 
       bondedto (attr store1 < 23.7261263766  and attr store1 > 22.5261263766 ))) 
6 0.1 0.1 peak 702 volume 1084.25562 ppm1 0.802 ppm2 0.803
 
! ############### hot_mothernoesy_072403.703 folded +
assi (attr store1 < 0.258 and attr store1 > 0.058 )
     ((attr store1 < 0.851 and attr store1 > 0.751 ) and 
      (bondedto (attr store1 < 119.188873623  and attr store1 > 117.988873623 ) or 
       bondedto (attr store1 < 71.449  and attr store1 > 70.249 ) or 
       bondedto (attr store1 < 23.7091263766  and attr store1 > 22.5091263766 ))) 
6 0.1 0.1 peak 703 volume 9.33790 ppm1 0.801 ppm2 0.158
 
! ############### hot_mothernoesy_072403.704 folded +
assi (attr store1 < 1.617 and attr store1 > 1.417 )
     ((attr store1 < 1.057 and attr store1 > 0.957 ) and 
      (bondedto (attr store1 < 119.095873623  and attr store1 > 117.895873623 ) or 
       bondedto (attr store1 < 71.356  and attr store1 > 70.156 ) or 
       bondedto (attr store1 < 23.6161263766  and attr store1 > 22.4161263766 ))) 
6 0.1 0.1 peak 704 volume 9.73640 ppm1 1.007 ppm2 1.517
 
! ############### hot_mothernoesy_072403.705 folded +
assi (attr store1 < 1.49 and attr store1 > 1.29 )
     ((attr store1 < 1.061 and attr store1 > 0.961 ) and 
      (bondedto (attr store1 < 119.103873623  and attr store1 > 117.903873623 ) or 
       bondedto (attr store1 < 71.364  and attr store1 > 70.164 ) or 
       bondedto (attr store1 < 23.6241263766  and attr store1 > 22.4241263766 ))) 
6 0.1 0.1 peak 705 volume 17.06320 ppm1 1.011 ppm2 1.390
 
! ############### hot_mothernoesy_072403.706 folded +
assi (attr store1 < 1.937 and attr store1 > 1.737 )
     ((attr store1 < 1.045 and attr store1 > 0.945 ) and 
      (bondedto (attr store1 < 119.115873623  and attr store1 > 117.915873623 ) or 
       bondedto (attr store1 < 71.376  and attr store1 > 70.176 ) or 
       bondedto (attr store1 < 23.6361263766  and attr store1 > 22.4361263766 ))) 
6 0.1 0.1 peak 706 volume 7.81540 ppm1 0.995 ppm2 1.837
 
! ############### hot_mothernoesy_072403.708 folded +
assi (attr store1 < 4.003 and attr store1 > 3.803 )
     ((attr store1 < 0.991 and attr store1 > 0.891 ) and 
      (bondedto (attr store1 < 118.948873623  and attr store1 > 117.748873623 ) or 
       bondedto (attr store1 < 71.209  and attr store1 > 70.009 ) or 
       bondedto (attr store1 < 23.4691263766  and attr store1 > 22.2691263766 ))) 
6 0.1 0.1 peak 708 volume 11.54230 ppm1 0.941 ppm2 3.903
 
! ############### hot_mothernoesy_072403.709 folded +
assi (attr store1 < 3.594 and attr store1 > 3.394 )
     ((attr store1 < 0.99 and attr store1 > 0.89 ) and 
      (bondedto (attr store1 < 118.941873623  and attr store1 > 117.741873623 ) or 
       bondedto (attr store1 < 71.202  and attr store1 > 70.002 ) or 
       bondedto (attr store1 < 23.4621263766  and attr store1 > 22.2621263766 ))) 
6 0.1 0.1 peak 709 volume 9.35690 ppm1 0.940 ppm2 3.494
 
! ############### hot_mothernoesy_072403.710 folded +
assi (attr store1 < 2.724 and attr store1 > 2.524 )
     ((attr store1 < 0.992 and attr store1 > 0.892 ) and 
      (bondedto (attr store1 < 118.955873623  and attr store1 > 117.755873623 ) or 
       bondedto (attr store1 < 71.216  and attr store1 > 70.016 ) or 
       bondedto (attr store1 < 23.4761263766  and attr store1 > 22.2761263766 ))) 
6 0.1 0.1 peak 710 volume 3.98530 ppm1 0.942 ppm2 2.624
 
! ############### hot_mothernoesy_072403.711 folded +
assi (attr store1 < 2.383 and attr store1 > 2.183 )
     ((attr store1 < 0.992 and attr store1 > 0.892 ) and 
      (bondedto (attr store1 < 118.957873623  and attr store1 > 117.757873623 ) or 
       bondedto (attr store1 < 71.218  and attr store1 > 70.018 ) or 
       bondedto (attr store1 < 23.4781263766  and attr store1 > 22.2781263766 ))) 
6 0.1 0.1 peak 711 volume 13.97140 ppm1 0.942 ppm2 2.283
 
! ############### hot_mothernoesy_072403.712 folded +
assi (attr store1 < 1.619 and attr store1 > 1.419 )
     ((attr store1 < 0.99 and attr store1 > 0.89 ) and 
      (bondedto (attr store1 < 118.934873623  and attr store1 > 117.734873623 ) or 
       bondedto (attr store1 < 71.195  and attr store1 > 69.995 ) or 
       bondedto (attr store1 < 23.4551263766  and attr store1 > 22.2551263766 ))) 
6 0.1 0.1 peak 712 volume 21.18070 ppm1 0.940 ppm2 1.519
 
! ############### hot_mothernoesy_072403.714 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 0.952 and attr store1 > 0.852 ) and 
      (bondedto (attr store1 < 119.001873623  and attr store1 > 117.801873623 ) or 
       bondedto (attr store1 < 71.262  and attr store1 > 70.062 ) or 
       bondedto (attr store1 < 23.5221263766  and attr store1 > 22.3221263766 ))) 
6 0.1 0.1 peak 714 volume 11.35700 ppm1 0.902 ppm2 4.773
 
! ############### hot_mothernoesy_072403.716 folded +
assi (attr store1 < 4.251 and attr store1 > 4.051 )
     ((attr store1 < 0.954 and attr store1 > 0.854 ) and 
      (bondedto (attr store1 < 119.013873623  and attr store1 > 117.813873623 ) or 
       bondedto (attr store1 < 71.274  and attr store1 > 70.074 ) or 
       bondedto (attr store1 < 23.5341263766  and attr store1 > 22.3341263766 ))) 
6 0.1 0.1 peak 716 volume 7.73560 ppm1 0.904 ppm2 4.151
 
! ############### hot_mothernoesy_072403.718 folded +
assi (attr store1 < 1.001 and attr store1 > 0.801 )
     ((attr store1 < 0.953 and attr store1 > 0.853 ) and 
      (bondedto (attr store1 < 119.016873623  and attr store1 > 117.816873623 ) or 
       bondedto (attr store1 < 71.277  and attr store1 > 70.077 ) or 
       bondedto (attr store1 < 23.5371263766  and attr store1 > 22.3371263766 ))) 
6 0.1 0.1 peak 718 volume 1397.35461 ppm1 0.903 ppm2 0.901
 
! ############### hot_mothernoesy_072403.719 folded -
assi (attr store1 < 4.221 and attr store1 > 4.021 )
     ((attr store1 < 1.38 and attr store1 > 1.28 ) and 
      (bondedto (attr store1 < 142.801810435  and attr store1 > 141.601810435 ) or 
       bondedto (attr store1 < 47.3220631883  and attr store1 > 46.1220631883 ))) 
6 0.1 0.1 peak 719 volume 5.2424 ppm1 1.330 ppm2 4.121
 
! ############### hot_mothernoesy_072403.720 folded +
assi (attr store1 < 2.226 and attr store1 > 2.026 )
     ((attr store1 < 0.992 and attr store1 > 0.892 ) and 
      (bondedto (attr store1 < 118.915873623  and attr store1 > 117.715873623 ) or 
       bondedto (attr store1 < 71.176  and attr store1 > 69.976 ) or 
       bondedto (attr store1 < 23.4361263766  and attr store1 > 22.2361263766 ))) 
6 0.1 0.1 peak 720 volume 5.91120 ppm1 0.942 ppm2 2.126
 
! ############### hot_mothernoesy_072403.723 folded +
assi (attr store1 < 2.168 and attr store1 > 1.968 )
     ((attr store1 < 0.779 and attr store1 > 0.679 ) and 
      (bondedto (attr store1 < 118.850873623  and attr store1 > 117.650873623 ) or 
       bondedto (attr store1 < 71.111  and attr store1 > 69.911 ) or 
       bondedto (attr store1 < 23.3711263766  and attr store1 > 22.1711263766 ))) 
6 0.1 0.1 peak 723 volume 11.29850 ppm1 0.729 ppm2 2.068
 
! ############### hot_mothernoesy_072403.724 folded +
assi (attr store1 < 2.049 and attr store1 > 1.849 )
     ((attr store1 < 0.781 and attr store1 > 0.681 ) and 
      (bondedto (attr store1 < 118.854873623  and attr store1 > 117.654873623 ) or 
       bondedto (attr store1 < 71.115  and attr store1 > 69.915 ) or 
       bondedto (attr store1 < 23.3751263766  and attr store1 > 22.1751263766 ))) 
6 0.1 0.1 peak 724 volume 3.91560 ppm1 0.731 ppm2 1.949
 
! ############### hot_mothernoesy_072403.728 folded +
assi (attr store1 < 0.829 and attr store1 > 0.629 )
     ((attr store1 < 0.779 and attr store1 > 0.679 ) and 
      (bondedto (attr store1 < 118.848873623  and attr store1 > 117.648873623 ) or 
       bondedto (attr store1 < 71.109  and attr store1 > 69.909 ) or 
       bondedto (attr store1 < 23.3691263766  and attr store1 > 22.1691263766 ))) 
6 0.1 0.1 peak 728 volume 124.01680 ppm1 0.729 ppm2 0.729
 
! ############### hot_mothernoesy_072403.729 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 1.38 and attr store1 > 1.28 ) and 
      (bondedto (attr store1 < 142.782810435  and attr store1 > 141.582810435 ) or 
       bondedto (attr store1 < 47.3030631883  and attr store1 > 46.1030631883 ))) 
6 0.1 0.1 peak 729 volume 5.3936 ppm1 1.330 ppm2 4.773
 
! ############### hot_mothernoesy_072403.730 folded -
assi (attr store1 < 4.503 and attr store1 > 4.303 )
     ((attr store1 < 1.38 and attr store1 > 1.28 ) and 
      (bondedto (attr store1 < 142.795810435  and attr store1 > 141.595810435 ) or 
       bondedto (attr store1 < 47.3160631883  and attr store1 > 46.1160631883 ))) 
6 0.1 0.1 peak 730 volume 9.7755 ppm1 1.330 ppm2 4.403
 
! ############### hot_mothernoesy_072403.731 folded -
assi (attr store1 < 1.428 and attr store1 > 1.228 )
     ((attr store1 < 1.378 and attr store1 > 1.278 ) and 
      (bondedto (attr store1 < 142.798810435  and attr store1 > 141.598810435 ) or 
       bondedto (attr store1 < 47.3190631883  and attr store1 > 46.1190631883 ))) 
6 0.1 0.1 peak 731 volume 326.47089 ppm1 1.328 ppm2 1.328
 
! ############### hot_mothernoesy_072403.732 folded +
assi (attr store1 < 1.937 and attr store1 > 1.737 )
     ((attr store1 < 1.188 and attr store1 > 1.088 ) and 
      (bondedto (attr store1 < 118.756873623  and attr store1 > 117.556873623 ) or 
       bondedto (attr store1 < 71.017  and attr store1 > 69.817 ) or 
       bondedto (attr store1 < 23.2771263766  and attr store1 > 22.0771263766 ))) 
6 0.1 0.1 peak 732 volume 6.68530 ppm1 1.138 ppm2 1.837
 
! ############### hot_mothernoesy_072403.734 folded +
assi (attr store1 < 2.144 and attr store1 > 1.944 )
     ((attr store1 < 0.662 and attr store1 > 0.562 ) and 
      (bondedto (attr store1 < 118.804873623  and attr store1 > 117.604873623 ) or 
       bondedto (attr store1 < 71.065  and attr store1 > 69.865 ) or 
       bondedto (attr store1 < 23.3251263766  and attr store1 > 22.1251263766 ))) 
6 0.1 0.1 peak 734 volume 6.95180 ppm1 0.612 ppm2 2.044
 
! ############### hot_mothernoesy_072403.737 folded +
assi (attr store1 < 1.528 and attr store1 > 1.328 )
     ((attr store1 < 0.66 and attr store1 > 0.56 ) and 
      (bondedto (attr store1 < 118.798873623  and attr store1 > 117.598873623 ) or 
       bondedto (attr store1 < 71.059  and attr store1 > 69.859 ) or 
       bondedto (attr store1 < 23.3191263766  and attr store1 > 22.1191263766 ))) 
6 0.1 0.1 peak 737 volume 10.14960 ppm1 0.610 ppm2 1.428
 
! ############### hot_mothernoesy_072403.741 folded +
assi (attr store1 < 0.905 and attr store1 > 0.705 )
     ((attr store1 < 0.661 and attr store1 > 0.561 ) and 
      (bondedto (attr store1 < 118.808873623  and attr store1 > 117.608873623 ) or 
       bondedto (attr store1 < 71.069  and attr store1 > 69.869 ) or 
       bondedto (attr store1 < 23.3291263766  and attr store1 > 22.1291263766 ))) 
6 0.1 0.1 peak 741 volume 16.84630 ppm1 0.611 ppm2 0.805
 
! ############### hot_mothernoesy_072403.742 folded +
assi (attr store1 < 0.711 and attr store1 > 0.511 )
     ((attr store1 < 0.661 and attr store1 > 0.561 ) and 
      (bondedto (attr store1 < 118.790873623  and attr store1 > 117.590873623 ) or 
       bondedto (attr store1 < 71.051  and attr store1 > 69.851 ) or 
       bondedto (attr store1 < 23.3111263766  and attr store1 > 22.1111263766 ))) 
6 0.1 0.1 peak 742 volume 462.08829 ppm1 0.611 ppm2 0.611
 
! ############### hot_mothernoesy_072403.744 folded +
assi (attr store1 < 4.875 and attr store1 > 4.675 )
     ((attr store1 < 0.656 and attr store1 > 0.556 ) and 
      (bondedto (attr store1 < 118.791873623  and attr store1 > 117.591873623 ) or 
       bondedto (attr store1 < 71.052  and attr store1 > 69.852 ) or 
       bondedto (attr store1 < 23.3121263766  and attr store1 > 22.1121263766 ))) 
6 0.1 0.1 peak 744 volume 5.09290 ppm1 0.606 ppm2 4.775
 
! ############### hot_mothernoesy_072403.746 folded +
assi (attr store1 < 2.516 and attr store1 > 2.316 )
     ((attr store1 < 0.659 and attr store1 > 0.559 ) and 
      (bondedto (attr store1 < 118.795873623  and attr store1 > 117.595873623 ) or 
       bondedto (attr store1 < 71.056  and attr store1 > 69.856 ) or 
       bondedto (attr store1 < 23.3161263766  and attr store1 > 22.1161263766 ))) 
6 0.1 0.1 peak 746 volume 3.79050 ppm1 0.609 ppm2 2.416
 
! ############### hot_mothernoesy_072403.747 folded +
assi (attr store1 < 2.285 and attr store1 > 2.085 )
     ((attr store1 < 0.66 and attr store1 > 0.56 ) and 
      (bondedto (attr store1 < 118.801873623  and attr store1 > 117.601873623 ) or 
       bondedto (attr store1 < 71.062  and attr store1 > 69.862 ) or 
       bondedto (attr store1 < 23.3221263766  and attr store1 > 22.1221263766 ))) 
6 0.1 0.1 peak 747 volume 3.65000 ppm1 0.610 ppm2 2.185
 
! ############### hot_mothernoesy_072403.749 folded +
assi (attr store1 < 3.06 and attr store1 > 2.86 )
     ((attr store1 < 1.189 and attr store1 > 1.089 ) and 
      (bondedto (attr store1 < 118.717873623  and attr store1 > 117.517873623 ) or 
       bondedto (attr store1 < 70.978  and attr store1 > 69.778 ) or 
       bondedto (attr store1 < 23.2381263766  and attr store1 > 22.0381263766 ))) 
6 0.1 0.1 peak 749 volume 3.74470 ppm1 1.139 ppm2 2.960
 
! ############### hot_mothernoesy_072403.751 folded +
assi (attr store1 < 2.169 and attr store1 > 1.969 )
     ((attr store1 < 1.189 and attr store1 > 1.089 ) and 
      (bondedto (attr store1 < 118.710873623  and attr store1 > 117.510873623 ) or 
       bondedto (attr store1 < 70.971  and attr store1 > 69.771 ) or 
       bondedto (attr store1 < 23.2311263766  and attr store1 > 22.0311263766 ))) 
6 0.1 0.1 peak 751 volume 4.16580 ppm1 1.139 ppm2 2.069
 
! ############### hot_mothernoesy_072403.752 folded +
assi (attr store1 < 1.737 and attr store1 > 1.537 )
     ((attr store1 < 1.189 and attr store1 > 1.089 ) and 
      (bondedto (attr store1 < 118.726873623  and attr store1 > 117.526873623 ) or 
       bondedto (attr store1 < 70.987  and attr store1 > 69.787 ) or 
       bondedto (attr store1 < 23.2471263766  and attr store1 > 22.0471263766 ))) 
6 0.1 0.1 peak 752 volume 5.30300 ppm1 1.139 ppm2 1.637
 
! ############### hot_mothernoesy_072403.753 folded +
assi (attr store1 < 1.477 and attr store1 > 1.277 )
     ((attr store1 < 1.188 and attr store1 > 1.088 ) and 
      (bondedto (attr store1 < 118.708873623  and attr store1 > 117.508873623 ) or 
       bondedto (attr store1 < 70.969  and attr store1 > 69.769 ) or 
       bondedto (attr store1 < 23.2291263766  and attr store1 > 22.0291263766 ))) 
6 0.1 0.1 peak 753 volume 8.39260 ppm1 1.138 ppm2 1.377
 
! ############### hot_mothernoesy_072403.754 folded +
assi (attr store1 < 1.24 and attr store1 > 1.04 )
     ((attr store1 < 1.189 and attr store1 > 1.089 ) and 
      (bondedto (attr store1 < 118.725873623  and attr store1 > 117.525873623 ) or 
       bondedto (attr store1 < 70.986  and attr store1 > 69.786 ) or 
       bondedto (attr store1 < 23.2461263766  and attr store1 > 22.0461263766 ))) 
6 0.1 0.1 peak 754 volume 592.77698 ppm1 1.139 ppm2 1.140
 
! ############### hot_mothernoesy_072403.755 folded +
assi (attr store1 < 1.109 and attr store1 > 0.909 )
     ((attr store1 < 1.189 and attr store1 > 1.089 ) and 
      (bondedto (attr store1 < 118.735873623  and attr store1 > 117.535873623 ) or 
       bondedto (attr store1 < 70.996  and attr store1 > 69.796 ) or 
       bondedto (attr store1 < 23.2561263766  and attr store1 > 22.0561263766 ))) 
6 0.1 0.1 peak 755 volume 85.33410 ppm1 1.139 ppm2 1.009
 
! ############### hot_mothernoesy_072403.756 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 1.379 and attr store1 > 1.279 ) and 
      (bondedto (attr store1 < 118.391873623  and attr store1 > 117.191873623 ) or 
       bondedto (attr store1 < 70.652  and attr store1 > 69.452 ) or 
       bondedto (attr store1 < 22.9121263766  and attr store1 > 21.7121263766 ))) 
6 0.1 0.1 peak 756 volume 19.75280 ppm1 1.329 ppm2 4.773
 
! ############### hot_mothernoesy_072403.761 folded +
assi (attr store1 < 2.062 and attr store1 > 1.862 )
     ((attr store1 < 1.38 and attr store1 > 1.28 ) and 
      (bondedto (attr store1 < 118.393873623  and attr store1 > 117.193873623 ) or 
       bondedto (attr store1 < 70.654  and attr store1 > 69.454 ) or 
       bondedto (attr store1 < 22.9141263766  and attr store1 > 21.7141263766 ))) 
6 0.1 0.1 peak 761 volume 3.47790 ppm1 1.330 ppm2 1.962
 
! ############### hot_mothernoesy_072403.762 folded +
assi (attr store1 < 1.431 and attr store1 > 1.231 )
     ((attr store1 < 1.381 and attr store1 > 1.281 ) and 
      (bondedto (attr store1 < 118.385873623  and attr store1 > 117.185873623 ) or 
       bondedto (attr store1 < 70.646  and attr store1 > 69.446 ) or 
       bondedto (attr store1 < 22.9061263766  and attr store1 > 21.7061263766 ))) 
6 0.1 0.1 peak 762 volume 1205.59912 ppm1 1.331 ppm2 1.331
 
! ############### hot_mothernoesy_072403.763 folded +
assi (attr store1 < 1.07 and attr store1 > 0.87 )
     ((attr store1 < 1.129 and attr store1 > 1.029 ) and 
      (bondedto (attr store1 < 118.112873623  and attr store1 > 116.912873623 ) or 
       bondedto (attr store1 < 70.373  and attr store1 > 69.173 ) or 
       bondedto (attr store1 < 22.6331263766  and attr store1 > 21.4331263766 ))) 
6 0.1 0.1 peak 763 volume 10.49540 ppm1 1.079 ppm2 0.970
 
! ############### hot_mothernoesy_072403.764 folded +
assi (attr store1 < 0.829 and attr store1 > 0.629 )
     ((attr store1 < 1.02 and attr store1 > 0.92 ) and 
      (bondedto (attr store1 < 118.093873623  and attr store1 > 116.893873623 ) or 
       bondedto (attr store1 < 70.354  and attr store1 > 69.154 ) or 
       bondedto (attr store1 < 22.6141263766  and attr store1 > 21.4141263766 ))) 
6 0.1 0.1 peak 764 volume 35.93150 ppm1 0.970 ppm2 0.729
 
! ############### hot_mothernoesy_072403.765 folded +
assi (attr store1 < 2.012 and attr store1 > 1.812 )
     ((attr store1 < 1.033 and attr store1 > 0.933 ) and 
      (bondedto (attr store1 < 118.051873623  and attr store1 > 116.851873623 ) or 
       bondedto (attr store1 < 70.312  and attr store1 > 69.112 ) or 
       bondedto (attr store1 < 22.5721263766  and attr store1 > 21.3721263766 ))) 
6 0.1 0.1 peak 765 volume 6.05330 ppm1 0.983 ppm2 1.912
 
! ############### hot_mothernoesy_072403.766 folded +
assi (attr store1 < 3.998 and attr store1 > 3.798 )
     ((attr store1 < 1.018 and attr store1 > 0.918 ) and 
      (bondedto (attr store1 < 118.043873623  and attr store1 > 116.843873623 ) or 
       bondedto (attr store1 < 70.304  and attr store1 > 69.104 ) or 
       bondedto (attr store1 < 22.5641263766  and attr store1 > 21.3641263766 ))) 
6 0.1 0.1 peak 766 volume 7.97770 ppm1 0.968 ppm2 3.898
 
! ############### hot_mothernoesy_072403.767 folded +
assi (attr store1 < 3.629 and attr store1 > 3.429 )
     ((attr store1 < 1.02 and attr store1 > 0.92 ) and 
      (bondedto (attr store1 < 118.056873623  and attr store1 > 116.856873623 ) or 
       bondedto (attr store1 < 70.317  and attr store1 > 69.117 ) or 
       bondedto (attr store1 < 22.5771263766  and attr store1 > 21.3771263766 ))) 
6 0.1 0.1 peak 767 volume 20.88920 ppm1 0.970 ppm2 3.529
 
! ############### hot_mothernoesy_072403.768 folded +
assi (attr store1 < 2.399 and attr store1 > 2.199 )
     ((attr store1 < 1.015 and attr store1 > 0.915 ) and 
      (bondedto (attr store1 < 118.053873623  and attr store1 > 116.853873623 ) or 
       bondedto (attr store1 < 70.314  and attr store1 > 69.114 ) or 
       bondedto (attr store1 < 22.5741263766  and attr store1 > 21.3741263766 ))) 
6 0.1 0.1 peak 768 volume 7.56720 ppm1 0.965 ppm2 2.299
 
! ############### hot_mothernoesy_072403.769 folded +
assi (attr store1 < 2.169 and attr store1 > 1.969 )
     ((attr store1 < 1.021 and attr store1 > 0.921 ) and 
      (bondedto (attr store1 < 118.068873623  and attr store1 > 116.868873623 ) or 
       bondedto (attr store1 < 70.329  and attr store1 > 69.129 ) or 
       bondedto (attr store1 < 22.5891263766  and attr store1 > 21.3891263766 ))) 
6 0.1 0.1 peak 769 volume 21.88630 ppm1 0.971 ppm2 2.069
 
! ############### hot_mothernoesy_072403.770 folded +
assi (attr store1 < 2.062 and attr store1 > 1.862 )
     ((attr store1 < 1.018 and attr store1 > 0.918 ) and 
      (bondedto (attr store1 < 118.071873623  and attr store1 > 116.871873623 ) or 
       bondedto (attr store1 < 70.332  and attr store1 > 69.132 ) or 
       bondedto (attr store1 < 22.5921263766  and attr store1 > 21.3921263766 ))) 
6 0.1 0.1 peak 770 volume 6.42790 ppm1 0.968 ppm2 1.962
 
! ############### hot_mothernoesy_072403.771 folded +
assi (attr store1 < 1.779 and attr store1 > 1.579 )
     ((attr store1 < 1.022 and attr store1 > 0.922 ) and 
      (bondedto (attr store1 < 118.060873623  and attr store1 > 116.860873623 ) or 
       bondedto (attr store1 < 70.321  and attr store1 > 69.121 ) or 
       bondedto (attr store1 < 22.5811263766  and attr store1 > 21.3811263766 ))) 
6 0.1 0.1 peak 771 volume 4.06820 ppm1 0.972 ppm2 1.679
 
! ############### hot_mothernoesy_072403.772 folded +
assi (attr store1 < 1.595 and attr store1 > 1.395 )
     ((attr store1 < 1.019 and attr store1 > 0.919 ) and 
      (bondedto (attr store1 < 118.063873623  and attr store1 > 116.863873623 ) or 
       bondedto (attr store1 < 70.324  and attr store1 > 69.124 ) or 
       bondedto (attr store1 < 22.5841263766  and attr store1 > 21.3841263766 ))) 
6 0.1 0.1 peak 772 volume 7.82070 ppm1 0.969 ppm2 1.495
 
! ############### hot_mothernoesy_072403.773 folded +
assi (attr store1 < 1.49 and attr store1 > 1.29 )
     ((attr store1 < 1.019 and attr store1 > 0.919 ) and 
      (bondedto (attr store1 < 118.062873623  and attr store1 > 116.862873623 ) or 
       bondedto (attr store1 < 70.323  and attr store1 > 69.123 ) or 
       bondedto (attr store1 < 22.5831263766  and attr store1 > 21.3831263766 ))) 
6 0.1 0.1 peak 773 volume 25.28510 ppm1 0.969 ppm2 1.390
 
! ############### hot_mothernoesy_072403.774 folded -
assi (attr store1 < 1.113 and attr store1 > 0.913 )
     ((attr store1 < 1.065 and attr store1 > 0.965 ) and 
      (bondedto (attr store1 < 141.584810435  and attr store1 > 140.384810435 ) or 
       bondedto (attr store1 < 46.1050631883  and attr store1 > 44.9050631883 ))) 
6 0.1 0.1 peak 774 volume 128.4101 ppm1 1.015 ppm2 1.013
 
! ############### hot_mothernoesy_072403.775 folded -
assi (attr store1 < 4.014 and attr store1 > 3.814 )
     ((attr store1 < 1.062 and attr store1 > 0.962 ) and 
      (bondedto (attr store1 < 141.559810435  and attr store1 > 140.359810435 ) or 
       bondedto (attr store1 < 46.0800631883  and attr store1 > 44.8800631883 ))) 
6 0.1 0.1 peak 775 volume 4.4759 ppm1 1.012 ppm2 3.914
 
! ############### hot_mothernoesy_072403.776 folded -
assi (attr store1 < 2.404 and attr store1 > 2.204 )
     ((attr store1 < 1.06 and attr store1 > 0.96 ) and 
      (bondedto (attr store1 < 141.569810435  and attr store1 > 140.369810435 ) or 
       bondedto (attr store1 < 46.0900631883  and attr store1 > 44.8900631883 ))) 
6 0.1 0.1 peak 776 volume 7.7448 ppm1 1.010 ppm2 2.304
 
! ############### hot_mothernoesy_072403.777 folded -
assi (attr store1 < 1.239 and attr store1 > 1.039 )
     ((attr store1 < 1.06 and attr store1 > 0.96 ) and 
      (bondedto (attr store1 < 141.566810435  and attr store1 > 140.366810435 ) or 
       bondedto (attr store1 < 46.0870631883  and attr store1 > 44.8870631883 ))) 
6 0.1 0.1 peak 777 volume 18.046 ppm1 1.010 ppm2 1.139
 
! ############### hot_mothernoesy_072403.778 folded -
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 4.04 and attr store1 > 3.94 ) and 
      (bondedto (attr store1 < 141.377810435  and attr store1 > 140.177810435 ) or 
       bondedto (attr store1 < 45.8980631883  and attr store1 > 44.6980631883 ))) 
6 0.1 0.1 peak 778 volume 15.048 ppm1 3.990 ppm2 4.774
 
! ############### hot_mothernoesy_072403.779 folded -
assi (attr store1 < 4.397 and attr store1 > 4.197 )
     ((attr store1 < 4.04 and attr store1 > 3.94 ) and 
      (bondedto (attr store1 < 141.361810435  and attr store1 > 140.161810435 ) or 
       bondedto (attr store1 < 45.8820631883  and attr store1 > 44.6820631883 ))) 
6 0.1 0.1 peak 779 volume 5.52 ppm1 3.990 ppm2 4.297
 
! ############### hot_mothernoesy_072403.780 folded -
assi (attr store1 < 4.089 and attr store1 > 3.889 )
     ((attr store1 < 4.041 and attr store1 > 3.941 ) and 
      (bondedto (attr store1 < 141.369810435  and attr store1 > 140.169810435 ) or 
       bondedto (attr store1 < 45.8900631883  and attr store1 > 44.6900631883 ))) 
6 0.1 0.1 peak 780 volume 294.33441 ppm1 3.991 ppm2 3.989
 
! ############### hot_mothernoesy_072403.781 folded +
assi (attr store1 < 4.784 and attr store1 > 4.584 )
     ((attr store1 < 1.058 and attr store1 > 0.958 ) and 
      (bondedto (attr store1 < 117.163873623  and attr store1 > 115.963873623 ) or 
       bondedto (attr store1 < 69.424  and attr store1 > 68.224 ) or 
       bondedto (attr store1 < 21.6841263766  and attr store1 > 20.4841263766 ))) 
6 0.1 0.1 peak 781 volume 4.63820 ppm1 1.008 ppm2 4.684
 
! ############### hot_mothernoesy_072403.784 folded +
assi (attr store1 < 1.482 and attr store1 > 1.282 )
     ((attr store1 < 1.053 and attr store1 > 0.953 ) and 
      (bondedto (attr store1 < 117.159873623  and attr store1 > 115.959873623 ) or 
       bondedto (attr store1 < 69.42  and attr store1 > 68.22 ) or 
       bondedto (attr store1 < 21.6801263766  and attr store1 > 20.4801263766 ))) 
6 0.1 0.1 peak 784 volume 5.77640 ppm1 1.003 ppm2 1.382
 
! ############### hot_mothernoesy_072403.785 folded +
assi (attr store1 < 1.238 and attr store1 > 1.038 )
     ((attr store1 < 1.058 and attr store1 > 0.958 ) and 
      (bondedto (attr store1 < 117.171873623  and attr store1 > 115.971873623 ) or 
       bondedto (attr store1 < 69.432  and attr store1 > 68.232 ) or 
       bondedto (attr store1 < 21.6921263766  and attr store1 > 20.4921263766 ))) 
6 0.1 0.1 peak 785 volume 71.87900 ppm1 1.008 ppm2 1.138
 
! ############### hot_mothernoesy_072403.786 folded +
assi (attr store1 < 4.166 and attr store1 > 3.966 )
     ((attr store1 < 0.997 and attr store1 > 0.897 ) and 
      (bondedto (attr store1 < 117.213873623  and attr store1 > 116.013873623 ) or 
       bondedto (attr store1 < 69.474  and attr store1 > 68.274 ) or 
       bondedto (attr store1 < 21.7341263766  and attr store1 > 20.5341263766 ))) 
6 0.1 0.1 peak 786 volume 4.46790 ppm1 0.947 ppm2 4.066
 
! ############### hot_mothernoesy_072403.787 folded +
assi (attr store1 < 1.497 and attr store1 > 1.297 )
     ((attr store1 < 0.993 and attr store1 > 0.893 ) and 
      (bondedto (attr store1 < 117.214873623  and attr store1 > 116.014873623 ) or 
       bondedto (attr store1 < 69.475  and attr store1 > 68.275 ) or 
       bondedto (attr store1 < 21.7351263766  and attr store1 > 20.5351263766 ))) 
6 0.1 0.1 peak 787 volume 5.76220 ppm1 0.943 ppm2 1.397
 
! ############### hot_mothernoesy_072403.788 folded +
assi (attr store1 < 1.049 and attr store1 > 0.849 )
     ((attr store1 < 0.998 and attr store1 > 0.898 ) and 
      (bondedto (attr store1 < 117.221873623  and attr store1 > 116.021873623 ) or 
       bondedto (attr store1 < 69.482  and attr store1 > 68.282 ) or 
       bondedto (attr store1 < 21.7421263766  and attr store1 > 20.5421263766 ))) 
6 0.1 0.1 peak 788 volume 3445.33765 ppm1 0.948 ppm2 0.949
 
! ############### hot_mothernoesy_072403.789 folded +
assi (attr store1 < 2.185 and attr store1 > 1.985 )
     ((attr store1 < 0.979 and attr store1 > 0.879 ) and 
      (bondedto (attr store1 < 117.201873623  and attr store1 > 116.001873623 ) or 
       bondedto (attr store1 < 69.462  and attr store1 > 68.262 ) or 
       bondedto (attr store1 < 21.7221263766  and attr store1 > 20.5221263766 ))) 
6 0.1 0.1 peak 789 volume 12.60610 ppm1 0.929 ppm2 2.085
 
! ############### hot_mothernoesy_072403.790 folded -
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 1.007 and attr store1 > 0.907 ) and 
      (bondedto (attr store1 < 141.094810435  and attr store1 > 139.894810435 ) or 
       bondedto (attr store1 < 45.6150631883  and attr store1 > 44.4150631883 ))) 
6 0.1 0.1 peak 790 volume 4.9518 ppm1 0.957 ppm2 4.772
 
! ############### hot_mothernoesy_072403.791 folded +
assi (attr store1 < 1.901 and attr store1 > 1.701 )
     ((attr store1 < 1.058 and attr store1 > 0.958 ) and 
      (bondedto (attr store1 < 117.142873623  and attr store1 > 115.942873623 ) or 
       bondedto (attr store1 < 69.403  and attr store1 > 68.203 ) or 
       bondedto (attr store1 < 21.6631263766  and attr store1 > 20.4631263766 ))) 
6 0.1 0.1 peak 791 volume 4.05330 ppm1 1.008 ppm2 1.801
 
! ############### hot_mothernoesy_072403.792 folded +
assi (attr store1 < 2.016 and attr store1 > 1.816 )
     ((attr store1 < 1.047 and attr store1 > 0.947 ) and 
      (bondedto (attr store1 < 117.156873623  and attr store1 > 115.956873623 ) or 
       bondedto (attr store1 < 69.417  and attr store1 > 68.217 ) or 
       bondedto (attr store1 < 21.6771263766  and attr store1 > 20.4771263766 ))) 
6 0.1 0.1 peak 792 volume 6.60500 ppm1 0.997 ppm2 1.916
 
! ############### hot_mothernoesy_072403.793 folded +
assi (attr store1 < 1.49 and attr store1 > 1.29 )
     ((attr store1 < 1.017 and attr store1 > 0.917 ) and 
      (bondedto (attr store1 < 116.989873623  and attr store1 > 115.789873623 ) or 
       bondedto (attr store1 < 69.25  and attr store1 > 68.05 ) or 
       bondedto (attr store1 < 21.5101263766  and attr store1 > 20.3101263766 ))) 
6 0.1 0.1 peak 793 volume 6.45220 ppm1 0.967 ppm2 1.390
 
! ############### hot_mothernoesy_072403.794 folded +
assi (attr store1 < 0.831 and attr store1 > 0.631 )
     ((attr store1 < 1.024 and attr store1 > 0.924 ) and 
      (bondedto (attr store1 < 116.989873623  and attr store1 > 115.789873623 ) or 
       bondedto (attr store1 < 69.25  and attr store1 > 68.05 ) or 
       bondedto (attr store1 < 21.5101263766  and attr store1 > 20.3101263766 ))) 
6 0.1 0.1 peak 794 volume 7.37540 ppm1 0.974 ppm2 0.731
 
! ############### hot_mothernoesy_072403.795 folded +
assi (attr store1 < 1.076 and attr store1 > 0.876 )
     ((attr store1 < 1.026 and attr store1 > 0.926 ) and 
      (bondedto (attr store1 < 116.847873623  and attr store1 > 115.647873623 ) or 
       bondedto (attr store1 < 69.108  and attr store1 > 67.908 ) or 
       bondedto (attr store1 < 21.3681263766  and attr store1 > 20.1681263766 ))) 
6 0.1 0.1 peak 795 volume 4062.11133 ppm1 0.976 ppm2 0.976
 
! ############### hot_mothernoesy_072403.796 folded +
assi (attr store1 < 4.164 and attr store1 > 3.964 )
     ((attr store1 < 1.023 and attr store1 > 0.923 ) and 
      (bondedto (attr store1 < 116.856873623  and attr store1 > 115.656873623 ) or 
       bondedto (attr store1 < 69.117  and attr store1 > 67.917 ) or 
       bondedto (attr store1 < 21.3771263766  and attr store1 > 20.1771263766 ))) 
6 0.1 0.1 peak 796 volume 3.79640 ppm1 0.973 ppm2 4.064
 
! ############### hot_mothernoesy_072403.797 folded +
assi (attr store1 < 2.186 and attr store1 > 1.986 )
     ((attr store1 < 1.004 and attr store1 > 0.904 ) and 
      (bondedto (attr store1 < 116.829873623  and attr store1 > 115.629873623 ) or 
       bondedto (attr store1 < 69.09  and attr store1 > 67.89 ) or 
       bondedto (attr store1 < 21.3501263766  and attr store1 > 20.1501263766 ))) 
6 0.1 0.1 peak 797 volume 9.36150 ppm1 0.954 ppm2 2.086
 
! ############### hot_mothernoesy_072403.798 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 1.031 and attr store1 > 0.931 ) and 
      (bondedto (attr store1 < 140.707810435  and attr store1 > 139.507810435 ) or 
       bondedto (attr store1 < 45.2280631883  and attr store1 > 44.0280631883 ))) 
6 0.1 0.1 peak 798 volume 5.6928 ppm1 0.981 ppm2 4.773
 
! ############### hot_mothernoesy_072403.799 folded +
assi (attr store1 < 1.999 and attr store1 > 1.799 )
     ((attr store1 < 3.269 and attr store1 > 3.169 ) and 
      (bondedto (attr store1 < 116.517873623  and attr store1 > 115.317873623 ) or 
       bondedto (attr store1 < 68.778  and attr store1 > 67.578 ) or 
       bondedto (attr store1 < 21.0381263766  and attr store1 > 19.8381263766 ))) 
6 0.1 0.1 peak 799 volume 4.13930 ppm1 3.219 ppm2 1.899
 
! ############### hot_mothernoesy_072403.800 folded +
assi (attr store1 < 2.051 and attr store1 > 1.851 )
     ((attr store1 < 3.262 and attr store1 > 3.162 ) and 
      (bondedto (attr store1 < 116.592873623  and attr store1 > 115.392873623 ) or 
       bondedto (attr store1 < 68.853  and attr store1 > 67.653 ) or 
       bondedto (attr store1 < 21.1131263766  and attr store1 > 19.9131263766 ))) 
6 0.1 0.1 peak 800 volume 3.91840 ppm1 3.212 ppm2 1.951
 
! ############### hot_mothernoesy_072403.801 folded +
assi (attr store1 < 4.218 and attr store1 > 4.018 )
     ((attr store1 < 4.453 and attr store1 > 4.353 ) and 
      (bondedto (attr store1 < 116.459873623  and attr store1 > 115.259873623 ) or 
       bondedto (attr store1 < 68.72  and attr store1 > 67.52 ) or 
       bondedto (attr store1 < 20.9801263766  and attr store1 > 19.7801263766 ))) 
6 0.1 0.1 peak 801 volume 4.35380 ppm1 4.403 ppm2 4.118
 
! ############### hot_mothernoesy_072403.802 folded +
assi (attr store1 < 3.313 and attr store1 > 3.113 )
     ((attr store1 < 3.261 and attr store1 > 3.161 ) and 
      (bondedto (attr store1 < 116.344873623  and attr store1 > 115.144873623 ) or 
       bondedto (attr store1 < 68.605  and attr store1 > 67.405 ) or 
       bondedto (attr store1 < 20.8651263766  and attr store1 > 19.6651263766 ))) 
6 0.1 0.1 peak 802 volume 123.70400 ppm1 3.211 ppm2 3.213
 
! ############### hot_mothernoesy_072403.803 folded +
assi (attr store1 < 1.703 and attr store1 > 1.503 )
     ((attr store1 < 3.259 and attr store1 > 3.159 ) and 
      (bondedto (attr store1 < 116.387873623  and attr store1 > 115.187873623 ) or 
       bondedto (attr store1 < 68.648  and attr store1 > 67.448 ) or 
       bondedto (attr store1 < 20.9081263766  and attr store1 > 19.7081263766 ))) 
6 0.1 0.1 peak 803 volume 4.63590 ppm1 3.209 ppm2 1.603
 
! ############### hot_mothernoesy_072403.804 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 4.456 and attr store1 > 4.356 ) and 
      (bondedto (attr store1 < 116.267873623  and attr store1 > 115.067873623 ) or 
       bondedto (attr store1 < 68.528  and attr store1 > 67.328 ) or 
       bondedto (attr store1 < 20.7881263766  and attr store1 > 19.5881263766 ))) 
6 0.1 0.1 peak 804 volume 12.54300 ppm1 4.406 ppm2 4.774
 
! ############### hot_mothernoesy_072403.805 folded +
assi (attr store1 < 4.505 and attr store1 > 4.305 )
     ((attr store1 < 4.457 and attr store1 > 4.357 ) and 
      (bondedto (attr store1 < 116.267873623  and attr store1 > 115.067873623 ) or 
       bondedto (attr store1 < 68.528  and attr store1 > 67.328 ) or 
       bondedto (attr store1 < 20.7881263766  and attr store1 > 19.5881263766 ))) 
6 0.1 0.1 peak 805 volume 61.64980 ppm1 4.407 ppm2 4.405
 
! ############### hot_mothernoesy_072403.807 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 3.182 and attr store1 > 3.082 ) and 
      (bondedto (attr store1 < 140.048810435  and attr store1 > 138.848810435 ) or 
       bondedto (attr store1 < 44.5690631883  and attr store1 > 43.3690631883 ))) 
6 0.1 0.1 peak 807 volume 8.8359 ppm1 3.132 ppm2 4.773
 
! ############### hot_mothernoesy_072403.809 folded +
assi (attr store1 < 4.181 and attr store1 > 3.981 )
     ((attr store1 < 1.078 and attr store1 > 0.978 ) and 
      (bondedto (attr store1 < 116.119873623  and attr store1 > 114.919873623 ) or 
       bondedto (attr store1 < 68.38  and attr store1 > 67.18 ) or 
       bondedto (attr store1 < 20.6401263766  and attr store1 > 19.4401263766 ))) 
6 0.1 0.1 peak 809 volume 5.51940 ppm1 1.028 ppm2 4.081
 
! ############### hot_mothernoesy_072403.810 folded +
assi (attr store1 < 3.602 and attr store1 > 3.402 )
     ((attr store1 < 1.08 and attr store1 > 0.98 ) and 
      (bondedto (attr store1 < 116.082873623  and attr store1 > 114.882873623 ) or 
       bondedto (attr store1 < 68.343  and attr store1 > 67.143 ) or 
       bondedto (attr store1 < 20.6031263766  and attr store1 > 19.4031263766 ))) 
6 0.1 0.1 peak 810 volume 6.04150 ppm1 1.030 ppm2 3.502
 
! ############### hot_mothernoesy_072403.811 folded +
assi (attr store1 < 2.725 and attr store1 > 2.525 )
     ((attr store1 < 1.078 and attr store1 > 0.978 ) and 
      (bondedto (attr store1 < 116.126873623  and attr store1 > 114.926873623 ) or 
       bondedto (attr store1 < 68.387  and attr store1 > 67.187 ) or 
       bondedto (attr store1 < 20.6471263766  and attr store1 > 19.4471263766 ))) 
6 0.1 0.1 peak 811 volume 7.34450 ppm1 1.028 ppm2 2.625
 
! ############### hot_mothernoesy_072403.812 folded +
assi (attr store1 < 2.233 and attr store1 > 2.033 )
     ((attr store1 < 1.08 and attr store1 > 0.98 ) and 
      (bondedto (attr store1 < 116.099873623  and attr store1 > 114.899873623 ) or 
       bondedto (attr store1 < 68.36  and attr store1 > 67.16 ) or 
       bondedto (attr store1 < 20.6201263766  and attr store1 > 19.4201263766 ))) 
6 0.1 0.1 peak 812 volume 8.26750 ppm1 1.030 ppm2 2.133
 
! ############### hot_mothernoesy_072403.813 folded +
assi (attr store1 < 4.0 and attr store1 > 3.8 )
     ((attr store1 < 1.066 and attr store1 > 0.966 ) and 
      (bondedto (attr store1 < 116.125873623  and attr store1 > 114.925873623 ) or 
       bondedto (attr store1 < 68.386  and attr store1 > 67.186 ) or 
       bondedto (attr store1 < 20.6461263766  and attr store1 > 19.4461263766 ))) 
6 0.1 0.1 peak 813 volume 3.18370 ppm1 1.016 ppm2 3.900
 
! ############### hot_mothernoesy_072403.816 folded +
assi (attr store1 < 1.623 and attr store1 > 1.423 )
     ((attr store1 < 1.073 and attr store1 > 0.973 ) and 
      (bondedto (attr store1 < 116.101873623  and attr store1 > 114.901873623 ) or 
       bondedto (attr store1 < 68.362  and attr store1 > 67.162 ) or 
       bondedto (attr store1 < 20.6221263766  and attr store1 > 19.4221263766 ))) 
6 0.1 0.1 peak 816 volume 7.18780 ppm1 1.023 ppm2 1.523
 
! ############### hot_mothernoesy_072403.817 folded +
assi (attr store1 < 1.49 and attr store1 > 1.29 )
     ((attr store1 < 1.073 and attr store1 > 0.973 ) and 
      (bondedto (attr store1 < 116.082873623  and attr store1 > 114.882873623 ) or 
       bondedto (attr store1 < 68.343  and attr store1 > 67.143 ) or 
       bondedto (attr store1 < 20.6031263766  and attr store1 > 19.4031263766 ))) 
6 0.1 0.1 peak 817 volume 8.73380 ppm1 1.023 ppm2 1.390
 
! ############### hot_mothernoesy_072403.818 folded +
assi (attr store1 < 1.121 and attr store1 > 0.921 )
     ((attr store1 < 1.072 and attr store1 > 0.972 ) and 
      (bondedto (attr store1 < 116.080873623  and attr store1 > 114.880873623 ) or 
       bondedto (attr store1 < 68.341  and attr store1 > 67.141 ) or 
       bondedto (attr store1 < 20.6011263766  and attr store1 > 19.4011263766 ))) 
6 0.1 0.1 peak 818 volume 239.55830 ppm1 1.022 ppm2 1.021
 
! ############### hot_mothernoesy_072403.819 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 3.261 and attr store1 > 3.161 ) and 
      (bondedto (attr store1 < 139.654810435  and attr store1 > 138.454810435 ) or 
       bondedto (attr store1 < 44.1750631883  and attr store1 > 42.9750631883 ))) 
6 0.1 0.1 peak 819 volume 41.3999 ppm1 3.211 ppm2 4.773
 
! ############### hot_mothernoesy_072403.820 folded -
assi (attr store1 < 4.073 and attr store1 > 3.873 )
     ((attr store1 < 3.259 and attr store1 > 3.159 ) and 
      (bondedto (attr store1 < 139.644810435  and attr store1 > 138.444810435 ) or 
       bondedto (attr store1 < 44.1650631883  and attr store1 > 42.9650631883 ))) 
6 0.1 0.1 peak 820 volume 16.0161 ppm1 3.209 ppm2 3.973
 
! ############### hot_mothernoesy_072403.821 folded -
assi (attr store1 < 4.007 and attr store1 > 3.807 )
     ((attr store1 < 3.26 and attr store1 > 3.16 ) and 
      (bondedto (attr store1 < 139.644810435  and attr store1 > 138.444810435 ) or 
       bondedto (attr store1 < 44.1650631883  and attr store1 > 42.9650631883 ))) 
6 0.1 0.1 peak 821 volume 11.142 ppm1 3.210 ppm2 3.907
 
! ############### hot_mothernoesy_072403.822 folded -
assi (attr store1 < 3.312 and attr store1 > 3.112 )
     ((attr store1 < 3.261 and attr store1 > 3.161 ) and 
      (bondedto (attr store1 < 139.635810435  and attr store1 > 138.435810435 ) or 
       bondedto (attr store1 < 44.1560631883  and attr store1 > 42.9560631883 ))) 
6 0.1 0.1 peak 822 volume 1074.28015 ppm1 3.211 ppm2 3.212
 
! ############### hot_mothernoesy_072403.823 folded -
assi (attr store1 < 2.531 and attr store1 > 2.331 )
     ((attr store1 < 3.261 and attr store1 > 3.161 ) and 
      (bondedto (attr store1 < 139.643810435  and attr store1 > 138.443810435 ) or 
       bondedto (attr store1 < 44.1640631883  and attr store1 > 42.9640631883 ))) 
6 0.1 0.1 peak 823 volume 5.9765 ppm1 3.211 ppm2 2.431
 
! ############### hot_mothernoesy_072403.824 folded -
assi (attr store1 < 2.42 and attr store1 > 2.22 )
     ((attr store1 < 3.26 and attr store1 > 3.16 ) and 
      (bondedto (attr store1 < 139.649810435  and attr store1 > 138.449810435 ) or 
       bondedto (attr store1 < 44.1700631883  and attr store1 > 42.9700631883 ))) 
6 0.1 0.1 peak 824 volume 6.699 ppm1 3.210 ppm2 2.320
 
! ############### hot_mothernoesy_072403.825 folded -
assi (attr store1 < 2.022 and attr store1 > 1.822 )
     ((attr store1 < 3.262 and attr store1 > 3.162 ) and 
      (bondedto (attr store1 < 139.649810435  and attr store1 > 138.449810435 ) or 
       bondedto (attr store1 < 44.1700631883  and attr store1 > 42.9700631883 ))) 
6 0.1 0.1 peak 825 volume 59.1879 ppm1 3.212 ppm2 1.922
 
! ############### hot_mothernoesy_072403.826 folded -
assi (attr store1 < 1.848 and attr store1 > 1.648 )
     ((attr store1 < 3.259 and attr store1 > 3.159 ) and 
      (bondedto (attr store1 < 139.641810435  and attr store1 > 138.441810435 ) or 
       bondedto (attr store1 < 44.1620631883  and attr store1 > 42.9620631883 ))) 
6 0.1 0.1 peak 826 volume 36.8843 ppm1 3.209 ppm2 1.748
 
! ############### hot_mothernoesy_072403.827 folded -
assi (attr store1 < 1.697 and attr store1 > 1.497 )
     ((attr store1 < 3.26 and attr store1 > 3.16 ) and 
      (bondedto (attr store1 < 139.654810435  and attr store1 > 138.454810435 ) or 
       bondedto (attr store1 < 44.1750631883  and attr store1 > 42.9750631883 ))) 
6 0.1 0.1 peak 827 volume 43.7514 ppm1 3.210 ppm2 1.597
 
! ############### hot_mothernoesy_072403.828 folded -
assi (attr store1 < 1.522 and attr store1 > 1.322 )
     ((attr store1 < 3.108 and attr store1 > 3.008 ) and 
      (bondedto (attr store1 < 139.712810435  and attr store1 > 138.512810435 ) or 
       bondedto (attr store1 < 44.2330631883  and attr store1 > 43.0330631883 ))) 
6 0.1 0.1 peak 828 volume 3.5226 ppm1 3.058 ppm2 1.422
 
! ############### hot_mothernoesy_072403.829 folded -
assi (attr store1 < 1.52 and attr store1 > 1.32 )
     ((attr store1 < 1.471 and attr store1 > 1.371 ) and 
      (bondedto (attr store1 < 139.707810435  and attr store1 > 138.507810435 ) or 
       bondedto (attr store1 < 44.2280631883  and attr store1 > 43.0280631883 ))) 
6 0.1 0.1 peak 829 volume 1542.44861 ppm1 1.421 ppm2 1.420
 
! ############### hot_mothernoesy_072403.830 folded -
assi (attr store1 < 4.004 and attr store1 > 3.804 )
     ((attr store1 < 1.569 and attr store1 > 1.469 ) and 
      (bondedto (attr store1 < 139.453810435  and attr store1 > 138.253810435 ) or 
       bondedto (attr store1 < 43.9740631883  and attr store1 > 42.7740631883 ))) 
6 0.1 0.1 peak 830 volume 5.8339 ppm1 1.519 ppm2 3.904
 
! ############### hot_mothernoesy_072403.831 folded -
assi (attr store1 < 1.617 and attr store1 > 1.417 )
     ((attr store1 < 1.567 and attr store1 > 1.467 ) and 
      (bondedto (attr store1 < 139.468810435  and attr store1 > 138.268810435 ) or 
       bondedto (attr store1 < 43.9890631883  and attr store1 > 42.7890631883 ))) 
6 0.1 0.1 peak 831 volume 63.3216 ppm1 1.517 ppm2 1.517
 
! ############### hot_mothernoesy_072403.832 folded -
assi (attr store1 < 1.02 and attr store1 > 0.82 )
     ((attr store1 < 1.569 and attr store1 > 1.469 ) and 
      (bondedto (attr store1 < 139.484810435  and attr store1 > 138.284810435 ) or 
       bondedto (attr store1 < 44.0050631883  and attr store1 > 42.8050631883 ))) 
6 0.1 0.1 peak 832 volume 8.9066 ppm1 1.519 ppm2 0.920
 
! ############### hot_mothernoesy_072403.833 folded -
assi (attr store1 < 4.363 and attr store1 > 4.163 )
     ((attr store1 < 1.449 and attr store1 > 1.349 ) and 
      (bondedto (attr store1 < 139.430810435  and attr store1 > 138.230810435 ) or 
       bondedto (attr store1 < 43.9510631883  and attr store1 > 42.7510631883 ))) 
6 0.1 0.1 peak 833 volume 24.9392 ppm1 1.399 ppm2 4.263
 
! ############### hot_mothernoesy_072403.834 folded -
assi (attr store1 < 1.409 and attr store1 > 1.209 )
     ((attr store1 < 1.358 and attr store1 > 1.258 ) and 
      (bondedto (attr store1 < 139.355810435  and attr store1 > 138.155810435 ) or 
       bondedto (attr store1 < 43.8760631883  and attr store1 > 42.6760631883 ))) 
6 0.1 0.1 peak 834 volume 793.6369 ppm1 1.308 ppm2 1.309
 
! ############### hot_mothernoesy_072403.835 folded +
assi (attr store1 < 2.772 and attr store1 > 2.572 )
     ((attr store1 < 2.724 and attr store1 > 2.624 ) and 
      (bondedto (attr store1 < 115.416873623  and attr store1 > 114.216873623 ) or 
       bondedto (attr store1 < 67.677  and attr store1 > 66.477 ) or 
       bondedto (attr store1 < 19.9371263766  and attr store1 > 18.7371263766 ))) 
6 0.1 0.1 peak 835 volume 37.72850 ppm1 2.674 ppm2 2.672
 
! ############### hot_mothernoesy_072403.836 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 3.498 and attr store1 > 3.398 ) and 
      (bondedto (attr store1 < 139.265810435  and attr store1 > 138.065810435 ) or 
       bondedto (attr store1 < 43.7860631883  and attr store1 > 42.5860631883 ))) 
6 0.1 0.1 peak 836 volume 7.7394 ppm1 3.448 ppm2 4.773
 
! ############### hot_mothernoesy_072403.837 folded -
assi (attr store1 < 4.261 and attr store1 > 4.061 )
     ((attr store1 < 3.498 and attr store1 > 3.398 ) and 
      (bondedto (attr store1 < 139.282810435  and attr store1 > 138.082810435 ) or 
       bondedto (attr store1 < 43.8030631883  and attr store1 > 42.6030631883 ))) 
6 0.1 0.1 peak 837 volume 4.6972 ppm1 3.448 ppm2 4.161
 
! ############### hot_mothernoesy_072403.838 folded -
assi (attr store1 < 3.536 and attr store1 > 3.336 )
     ((attr store1 < 3.49 and attr store1 > 3.39 ) and 
      (bondedto (attr store1 < 139.275810435  and attr store1 > 138.075810435 ) or 
       bondedto (attr store1 < 43.7960631883  and attr store1 > 42.5960631883 ))) 
6 0.1 0.1 peak 838 volume 6.1122 ppm1 3.440 ppm2 3.436
 
! ############### hot_mothernoesy_072403.839 folded -
assi (attr store1 < 3.225 and attr store1 > 3.025 )
     ((attr store1 < 3.496 and attr store1 > 3.396 ) and 
      (bondedto (attr store1 < 139.263810435  and attr store1 > 138.063810435 ) or 
       bondedto (attr store1 < 43.7840631883  and attr store1 > 42.5840631883 ))) 
6 0.1 0.1 peak 839 volume 7.4908 ppm1 3.446 ppm2 3.125
 
! ############### hot_mothernoesy_072403.840 folded -
assi (attr store1 < 1.932 and attr store1 > 1.732 )
     ((attr store1 < 3.49 and attr store1 > 3.39 ) and 
      (bondedto (attr store1 < 139.275810435  and attr store1 > 138.075810435 ) or 
       bondedto (attr store1 < 43.7960631883  and attr store1 > 42.5960631883 ))) 
6 0.1 0.1 peak 840 volume 4.3298 ppm1 3.440 ppm2 1.832
 
! ############### hot_mothernoesy_072403.841 folded -
assi (attr store1 < 1.933 and attr store1 > 1.733 )
     ((attr store1 < 3.175 and attr store1 > 3.075 ) and 
      (bondedto (attr store1 < 139.327810435  and attr store1 > 138.127810435 ) or 
       bondedto (attr store1 < 43.8480631883  and attr store1 > 42.6480631883 ))) 
6 0.1 0.1 peak 841 volume 5.2747 ppm1 3.125 ppm2 1.833
 
! ############### hot_mothernoesy_072403.842 folded -
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 3.173 and attr store1 > 3.073 ) and 
      (bondedto (attr store1 < 139.300810435  and attr store1 > 138.100810435 ) or 
       bondedto (attr store1 < 43.8210631883  and attr store1 > 42.6210631883 ))) 
6 0.1 0.1 peak 842 volume 8.7365 ppm1 3.123 ppm2 4.774
 
! ############### hot_mothernoesy_072403.843 folded -
assi (attr store1 < 4.261 and attr store1 > 4.061 )
     ((attr store1 < 3.173 and attr store1 > 3.073 ) and 
      (bondedto (attr store1 < 139.282810435  and attr store1 > 138.082810435 ) or 
       bondedto (attr store1 < 43.8030631883  and attr store1 > 42.6030631883 ))) 
6 0.1 0.1 peak 843 volume 4.4137 ppm1 3.123 ppm2 4.161
 
! ############### hot_mothernoesy_072403.844 folded -
assi (attr store1 < 3.549 and attr store1 > 3.349 )
     ((attr store1 < 3.171 and attr store1 > 3.071 ) and 
      (bondedto (attr store1 < 139.276810435  and attr store1 > 138.076810435 ) or 
       bondedto (attr store1 < 43.7970631883  and attr store1 > 42.5970631883 ))) 
6 0.1 0.1 peak 844 volume 7.7298 ppm1 3.121 ppm2 3.449
 
! ############### hot_mothernoesy_072403.845 folded -
assi (attr store1 < 2.216 and attr store1 > 2.016 )
     ((attr store1 < 1.513 and attr store1 > 1.413 ) and 
      (bondedto (attr store1 < 139.271810435  and attr store1 > 138.071810435 ) or 
       bondedto (attr store1 < 43.7920631883  and attr store1 > 42.5920631883 ))) 
6 0.1 0.1 peak 845 volume 3.2724 ppm1 1.463 ppm2 2.116
 
! ############### hot_mothernoesy_072403.846 folded -
assi (attr store1 < 4.342 and attr store1 > 4.142 )
     ((attr store1 < 1.358 and attr store1 > 1.258 ) and 
      (bondedto (attr store1 < 139.339810435  and attr store1 > 138.139810435 ) or 
       bondedto (attr store1 < 43.8600631883  and attr store1 > 42.6600631883 ))) 
6 0.1 0.1 peak 846 volume 13.7959 ppm1 1.308 ppm2 4.242
 
! ############### hot_mothernoesy_072403.847 folded +
assi (attr store1 < 3.599 and attr store1 > 3.399 )
     ((attr store1 < 3.547 and attr store1 > 3.447 ) and 
      (bondedto (attr store1 < 115.376873623  and attr store1 > 114.176873623 ) or 
       bondedto (attr store1 < 67.637  and attr store1 > 66.437 ) or 
       bondedto (attr store1 < 19.8971263766  and attr store1 > 18.6971263766 ))) 
6 0.1 0.1 peak 847 volume 18.86120 ppm1 3.497 ppm2 3.499
 
! ############### hot_mothernoesy_072403.850 folded -
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 1.482 and attr store1 > 1.382 ) and 
      (bondedto (attr store1 < 139.229810435  and attr store1 > 138.029810435 ) or 
       bondedto (attr store1 < 43.7500631883  and attr store1 > 42.5500631883 ))) 
6 0.1 0.1 peak 850 volume 5.4906 ppm1 1.432 ppm2 4.774
 
! ############### hot_mothernoesy_072403.851 folded -
assi (attr store1 < 1.349 and attr store1 > 1.149 )
     ((attr store1 < 1.294 and attr store1 > 1.194 ) and 
      (bondedto (attr store1 < 139.227810435  and attr store1 > 138.027810435 ) or 
       bondedto (attr store1 < 43.7480631883  and attr store1 > 42.5480631883 ))) 
6 0.1 0.1 peak 851 volume 22.6634 ppm1 1.244 ppm2 1.249
 
! ############### hot_mothernoesy_072403.852 folded -
assi (attr store1 < 1.539 and attr store1 > 1.339 )
     ((attr store1 < 1.097 and attr store1 > 0.997 ) and 
      (bondedto (attr store1 < 139.208810435  and attr store1 > 138.008810435 ) or 
       bondedto (attr store1 < 43.7290631883  and attr store1 > 42.5290631883 ))) 
6 0.1 0.1 peak 852 volume 4.0505 ppm1 1.047 ppm2 1.439
 
! ############### hot_mothernoesy_072403.853 folded +
assi (attr store1 < 1.521 and attr store1 > 1.321 )
     ((attr store1 < 1.472 and attr store1 > 1.372 ) and 
      (bondedto (attr store1 < 115.278873623  and attr store1 > 114.078873623 ) or 
       bondedto (attr store1 < 67.539  and attr store1 > 66.339 ) or 
       bondedto (attr store1 < 19.7991263766  and attr store1 > 18.5991263766 ))) 
6 0.1 0.1 peak 853 volume 3455.28271 ppm1 1.422 ppm2 1.421
 
! ############### hot_mothernoesy_072403.854 folded -
assi (attr store1 < 4.139 and attr store1 > 3.939 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 139.161810435  and attr store1 > 137.961810435 ) or 
       bondedto (attr store1 < 43.6820631883  and attr store1 > 42.4820631883 ))) 
6 0.1 0.1 peak 854 volume 5.355 ppm1 1.465 ppm2 4.039
 
! ############### hot_mothernoesy_072403.855 folded -
assi (attr store1 < 3.023 and attr store1 > 2.823 )
     ((attr store1 < 1.514 and attr store1 > 1.414 ) and 
      (bondedto (attr store1 < 139.102810435  and attr store1 > 137.902810435 ) or 
       bondedto (attr store1 < 43.6230631883  and attr store1 > 42.4230631883 ))) 
6 0.1 0.1 peak 855 volume 6.2753 ppm1 1.464 ppm2 2.923
 
! ############### hot_mothernoesy_072403.856 folded -
assi (attr store1 < 1.571 and attr store1 > 1.371 )
     ((attr store1 < 1.516 and attr store1 > 1.416 ) and 
      (bondedto (attr store1 < 139.162810435  and attr store1 > 137.962810435 ) or 
       bondedto (attr store1 < 43.6830631883  and attr store1 > 42.4830631883 ))) 
6 0.1 0.1 peak 856 volume 75.9571 ppm1 1.466 ppm2 1.471
 
! ############### hot_mothernoesy_072403.857 folded -
assi (attr store1 < 4.069 and attr store1 > 3.869 )
     ((attr store1 < 1.397 and attr store1 > 1.297 ) and 
      (bondedto (attr store1 < 139.079810435  and attr store1 > 137.879810435 ) or 
       bondedto (attr store1 < 43.6000631883  and attr store1 > 42.4000631883 ))) 
6 0.1 0.1 peak 857 volume 3.8826 ppm1 1.347 ppm2 3.969
 
! ############### hot_mothernoesy_072403.858 folded -
assi (attr store1 < 1.05 and attr store1 > 0.85 )
     ((attr store1 < 1.396 and attr store1 > 1.296 ) and 
      (bondedto (attr store1 < 139.110810435  and attr store1 > 137.910810435 ) or 
       bondedto (attr store1 < 43.6310631883  and attr store1 > 42.4310631883 ))) 
6 0.1 0.1 peak 858 volume 5.0368 ppm1 1.346 ppm2 0.950
 
! ############### hot_mothernoesy_072403.859 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 4.168 and attr store1 > 4.068 ) and 
      (bondedto (attr store1 < 115.046873623  and attr store1 > 113.846873623 ) or 
       bondedto (attr store1 < 67.307  and attr store1 > 66.107 ) or 
       bondedto (attr store1 < 19.5671263766  and attr store1 > 18.3671263766 ))) 
6 0.1 0.1 peak 859 volume 3.81230 ppm1 4.118 ppm2 4.774
 
! ############### hot_mothernoesy_072403.860 folded +
assi (attr store1 < 2.492 and attr store1 > 2.292 )
     ((attr store1 < 4.166 and attr store1 > 4.066 ) and 
      (bondedto (attr store1 < 115.026873623  and attr store1 > 113.826873623 ) or 
       bondedto (attr store1 < 67.287  and attr store1 > 66.087 ) or 
       bondedto (attr store1 < 19.5471263766  and attr store1 > 18.3471263766 ))) 
6 0.1 0.1 peak 860 volume 3.54290 ppm1 4.116 ppm2 2.392
 
! ############### hot_mothernoesy_072403.861 folded +
assi (attr store1 < 2.252 and attr store1 > 2.052 )
     ((attr store1 < 4.168 and attr store1 > 4.068 ) and 
      (bondedto (attr store1 < 115.028873623  and attr store1 > 113.828873623 ) or 
       bondedto (attr store1 < 67.289  and attr store1 > 66.089 ) or 
       bondedto (attr store1 < 19.5491263766  and attr store1 > 18.3491263766 ))) 
6 0.1 0.1 peak 861 volume 3.32500 ppm1 4.118 ppm2 2.152
 
! ############### hot_mothernoesy_072403.863 folded +
assi (attr store1 < 1.967 and attr store1 > 1.767 )
     ((attr store1 < 1.572 and attr store1 > 1.472 ) and 
      (bondedto (attr store1 < 115.017873623  and attr store1 > 113.817873623 ) or 
       bondedto (attr store1 < 67.278  and attr store1 > 66.078 ) or 
       bondedto (attr store1 < 19.5381263766  and attr store1 > 18.3381263766 ))) 
6 0.1 0.1 peak 863 volume 3.79470 ppm1 1.522 ppm2 1.867
 
! ############### hot_mothernoesy_072403.864 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 1.565 and attr store1 > 1.465 ) and 
      (bondedto (attr store1 < 115.048873623  and attr store1 > 113.848873623 ) or 
       bondedto (attr store1 < 67.309  and attr store1 > 66.109 ) or 
       bondedto (attr store1 < 19.5691263766  and attr store1 > 18.3691263766 ))) 
6 0.1 0.1 peak 864 volume 4.91400 ppm1 1.515 ppm2 4.772
 
! ############### hot_mothernoesy_072403.865 folded +
assi (attr store1 < 4.593 and attr store1 > 4.393 )
     ((attr store1 < 1.57 and attr store1 > 1.47 ) and 
      (bondedto (attr store1 < 115.074873623  and attr store1 > 113.874873623 ) or 
       bondedto (attr store1 < 67.335  and attr store1 > 66.135 ) or 
       bondedto (attr store1 < 19.5951263766  and attr store1 > 18.3951263766 ))) 
6 0.1 0.1 peak 865 volume 4.54370 ppm1 1.520 ppm2 4.493
 
! ############### hot_mothernoesy_072403.866 folded +
assi (attr store1 < 3.998 and attr store1 > 3.798 )
     ((attr store1 < 1.569 and attr store1 > 1.469 ) and 
      (bondedto (attr store1 < 115.053873623  and attr store1 > 113.853873623 ) or 
       bondedto (attr store1 < 67.314  and attr store1 > 66.114 ) or 
       bondedto (attr store1 < 19.5741263766  and attr store1 > 18.3741263766 ))) 
6 0.1 0.1 peak 866 volume 20.16350 ppm1 1.519 ppm2 3.898
 
! ############### hot_mothernoesy_072403.867 folded +
assi (attr store1 < 2.417 and attr store1 > 2.217 )
     ((attr store1 < 1.568 and attr store1 > 1.468 ) and 
      (bondedto (attr store1 < 115.014873623  and attr store1 > 113.814873623 ) or 
       bondedto (attr store1 < 67.275  and attr store1 > 66.075 ) or 
       bondedto (attr store1 < 19.5351263766  and attr store1 > 18.3351263766 ))) 
6 0.1 0.1 peak 867 volume 3.39860 ppm1 1.518 ppm2 2.317
 
! ############### hot_mothernoesy_072403.868 folded +
assi (attr store1 < 2.21 and attr store1 > 2.01 )
     ((attr store1 < 1.57 and attr store1 > 1.47 ) and 
      (bondedto (attr store1 < 115.034873623  and attr store1 > 113.834873623 ) or 
       bondedto (attr store1 < 67.295  and attr store1 > 66.095 ) or 
       bondedto (attr store1 < 19.5551263766  and attr store1 > 18.3551263766 ))) 
6 0.1 0.1 peak 868 volume 7.19790 ppm1 1.520 ppm2 2.110
 
! ############### hot_mothernoesy_072403.869 folded +
assi (attr store1 < 1.619 and attr store1 > 1.419 )
     ((attr store1 < 1.569 and attr store1 > 1.469 ) and 
      (bondedto (attr store1 < 115.051873623  and attr store1 > 113.851873623 ) or 
       bondedto (attr store1 < 67.312  and attr store1 > 66.112 ) or 
       bondedto (attr store1 < 19.5721263766  and attr store1 > 18.3721263766 ))) 
6 0.1 0.1 peak 869 volume 214.06560 ppm1 1.519 ppm2 1.519
 
! ############### hot_mothernoesy_072403.870 folded +
assi (attr store1 < 1.035 and attr store1 > 0.835 )
     ((attr store1 < 1.569 and attr store1 > 1.469 ) and 
      (bondedto (attr store1 < 115.047873623  and attr store1 > 113.847873623 ) or 
       bondedto (attr store1 < 67.308  and attr store1 > 66.108 ) or 
       bondedto (attr store1 < 19.5681263766  and attr store1 > 18.3681263766 ))) 
6 0.1 0.1 peak 870 volume 32.42000 ppm1 1.519 ppm2 0.935
 
! ############### hot_mothernoesy_072403.871 folded +
assi (attr store1 < 4.696 and attr store1 > 4.496 )
     ((attr store1 < 1.442 and attr store1 > 1.342 ) and 
      (bondedto (attr store1 < 115.016873623  and attr store1 > 113.816873623 ) or 
       bondedto (attr store1 < 67.277  and attr store1 > 66.077 ) or 
       bondedto (attr store1 < 19.5371263766  and attr store1 > 18.3371263766 ))) 
6 0.1 0.1 peak 871 volume 5.17690 ppm1 1.392 ppm2 4.596
 
! ############### hot_mothernoesy_072403.872 folded -
assi (attr store1 < 3.166 and attr store1 > 2.966 )
     ((attr store1 < 3.322 and attr store1 > 3.222 ) and 
      (bondedto (attr store1 < 138.913810435  and attr store1 > 137.713810435 ) or 
       bondedto (attr store1 < 43.4340631883  and attr store1 > 42.2340631883 ))) 
6 0.1 0.1 peak 872 volume 4.7106 ppm1 3.272 ppm2 3.066
 
! ############### hot_mothernoesy_072403.873 folded -
assi (attr store1 < 3.358 and attr store1 > 3.158 )
     ((attr store1 < 3.125 and attr store1 > 3.025 ) and 
      (bondedto (attr store1 < 138.914810435  and attr store1 > 137.714810435 ) or 
       bondedto (attr store1 < 43.4350631883  and attr store1 > 42.2350631883 ))) 
6 0.1 0.1 peak 873 volume 4.8849 ppm1 3.075 ppm2 3.258
 
! ############### hot_mothernoesy_072403.874 folded -
assi (attr store1 < 2.596 and attr store1 > 2.396 )
     ((attr store1 < 2.74 and attr store1 > 2.64 ) and 
      (bondedto (attr store1 < 138.883810435  and attr store1 > 137.683810435 ) or 
       bondedto (attr store1 < 43.4040631883  and attr store1 > 42.2040631883 ))) 
6 0.1 0.1 peak 874 volume 12.7773 ppm1 2.690 ppm2 2.496
 
! ############### hot_mothernoesy_072403.875 folded -
assi (attr store1 < 2.79 and attr store1 > 2.59 )
     ((attr store1 < 2.547 and attr store1 > 2.447 ) and 
      (bondedto (attr store1 < 138.884810435  and attr store1 > 137.684810435 ) or 
       bondedto (attr store1 < 43.4050631883  and attr store1 > 42.2050631883 ))) 
6 0.1 0.1 peak 875 volume 11.8613 ppm1 2.497 ppm2 2.690
 
! ############### hot_mothernoesy_072403.876 folded -
assi (attr store1 < 2.594 and attr store1 > 2.394 )
     ((attr store1 < 2.547 and attr store1 > 2.447 ) and 
      (bondedto (attr store1 < 138.895810435  and attr store1 > 137.695810435 ) or 
       bondedto (attr store1 < 43.4160631883  and attr store1 > 42.2160631883 ))) 
6 0.1 0.1 peak 876 volume 20.1108 ppm1 2.497 ppm2 2.494
 
! ############### hot_mothernoesy_072403.877 folded -
assi (attr store1 < 4.594 and attr store1 > 4.394 )
     ((attr store1 < 1.099 and attr store1 > 0.999 ) and 
      (bondedto (attr store1 < 138.945810435  and attr store1 > 137.745810435 ) or 
       bondedto (attr store1 < 43.4660631883  and attr store1 > 42.2660631883 ))) 
6 0.1 0.1 peak 877 volume 5.0661 ppm1 1.049 ppm2 4.494
 
! ############### hot_mothernoesy_072403.878 folded -
assi (attr store1 < 2.514 and attr store1 > 2.314 )
     ((attr store1 < 1.093 and attr store1 > 0.993 ) and 
      (bondedto (attr store1 < 138.950810435  and attr store1 > 137.750810435 ) or 
       bondedto (attr store1 < 43.4710631883  and attr store1 > 42.2710631883 ))) 
6 0.1 0.1 peak 878 volume 4.1346 ppm1 1.043 ppm2 2.414
 
! ############### hot_mothernoesy_072403.879 folded -
assi (attr store1 < 2.166 and attr store1 > 1.966 )
     ((attr store1 < 1.093 and attr store1 > 0.993 ) and 
      (bondedto (attr store1 < 138.942810435  and attr store1 > 137.742810435 ) or 
       bondedto (attr store1 < 43.4630631883  and attr store1 > 42.2630631883 ))) 
6 0.1 0.1 peak 879 volume 6.2912 ppm1 1.043 ppm2 2.066
 
! ############### hot_mothernoesy_072403.880 folded -
assi (attr store1 < 2.056 and attr store1 > 1.856 )
     ((attr store1 < 1.096 and attr store1 > 0.996 ) and 
      (bondedto (attr store1 < 138.932810435  and attr store1 > 137.732810435 ) or 
       bondedto (attr store1 < 43.4530631883  and attr store1 > 42.2530631883 ))) 
6 0.1 0.1 peak 880 volume 8.5017 ppm1 1.046 ppm2 1.956
 
! ############### hot_mothernoesy_072403.881 folded -
assi (attr store1 < 1.598 and attr store1 > 1.398 )
     ((attr store1 < 1.097 and attr store1 > 0.997 ) and 
      (bondedto (attr store1 < 138.952810435  and attr store1 > 137.752810435 ) or 
       bondedto (attr store1 < 43.4730631883  and attr store1 > 42.2730631883 ))) 
6 0.1 0.1 peak 881 volume 5.3072 ppm1 1.047 ppm2 1.498
 
! ############### hot_mothernoesy_072403.882 folded -
assi (attr store1 < 1.145 and attr store1 > 0.945 )
     ((attr store1 < 1.093 and attr store1 > 0.993 ) and 
      (bondedto (attr store1 < 138.935810435  and attr store1 > 137.735810435 ) or 
       bondedto (attr store1 < 43.4560631883  and attr store1 > 42.2560631883 ))) 
6 0.1 0.1 peak 882 volume 111.0532 ppm1 1.043 ppm2 1.045
 
! ############### hot_mothernoesy_072403.883 folded -
assi (attr store1 < 0.979 and attr store1 > 0.779 )
     ((attr store1 < 1.095 and attr store1 > 0.995 ) and 
      (bondedto (attr store1 < 138.940810435  and attr store1 > 137.740810435 ) or 
       bondedto (attr store1 < 43.4610631883  and attr store1 > 42.2610631883 ))) 
6 0.1 0.1 peak 883 volume 16.9856 ppm1 1.045 ppm2 0.879
 
! ############### hot_mothernoesy_072403.884 folded -
assi (attr store1 < 1.545 and attr store1 > 1.345 )
     ((attr store1 < 1.088 and attr store1 > 0.988 ) and 
      (bondedto (attr store1 < 138.966810435  and attr store1 > 137.766810435 ) or 
       bondedto (attr store1 < 43.4870631883  and attr store1 > 42.2870631883 ))) 
6 0.1 0.1 peak 884 volume 4.3747 ppm1 1.038 ppm2 1.445
 
! ############### hot_mothernoesy_072403.885 folded +
assi (attr store1 < 4.209 and attr store1 > 4.009 )
     ((attr store1 < 4.162 and attr store1 > 4.062 ) and 
      (bondedto (attr store1 < 114.993873623  and attr store1 > 113.793873623 ) or 
       bondedto (attr store1 < 67.254  and attr store1 > 66.054 ) or 
       bondedto (attr store1 < 19.5141263766  and attr store1 > 18.3141263766 ))) 
6 0.1 0.1 peak 885 volume 39.12960 ppm1 4.112 ppm2 4.109
 
! ############### hot_mothernoesy_072403.886 folded +
assi (attr store1 < 3.098 and attr store1 > 2.898 )
     ((attr store1 < 4.16 and attr store1 > 4.06 ) and 
      (bondedto (attr store1 < 114.973873623  and attr store1 > 113.773873623 ) or 
       bondedto (attr store1 < 67.234  and attr store1 > 66.034 ) or 
       bondedto (attr store1 < 19.4941263766  and attr store1 > 18.2941263766 ))) 
6 0.1 0.1 peak 886 volume 3.50580 ppm1 4.110 ppm2 2.998
 
! ############### hot_mothernoesy_072403.887 folded +
assi (attr store1 < 1.918 and attr store1 > 1.718 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 114.965873623  and attr store1 > 113.765873623 ) or 
       bondedto (attr store1 < 67.226  and attr store1 > 66.026 ) or 
       bondedto (attr store1 < 19.4861263766  and attr store1 > 18.2861263766 ))) 
6 0.1 0.1 peak 887 volume 3.92890 ppm1 1.526 ppm2 1.818
 
! ############### hot_mothernoesy_072403.888 folded +
assi (attr store1 < 4.637 and attr store1 > 4.437 )
     ((attr store1 < 1.462 and attr store1 > 1.362 ) and 
      (bondedto (attr store1 < 114.986873623  and attr store1 > 113.786873623 ) or 
       bondedto (attr store1 < 67.247  and attr store1 > 66.047 ) or 
       bondedto (attr store1 < 19.5071263766  and attr store1 > 18.3071263766 ))) 
6 0.1 0.1 peak 888 volume 6.69380 ppm1 1.412 ppm2 4.537
 
! ############### hot_mothernoesy_072403.889 folded +
assi (attr store1 < 1.979 and attr store1 > 1.779 )
     ((attr store1 < 1.455 and attr store1 > 1.355 ) and 
      (bondedto (attr store1 < 114.970873623  and attr store1 > 113.770873623 ) or 
       bondedto (attr store1 < 67.231  and attr store1 > 66.031 ) or 
       bondedto (attr store1 < 19.4911263766  and attr store1 > 18.2911263766 ))) 
6 0.1 0.1 peak 889 volume 7.03600 ppm1 1.405 ppm2 1.879
 
! ############### hot_mothernoesy_072403.890 folded +
assi (attr store1 < 1.114 and attr store1 > 0.914 )
     ((attr store1 < 1.456 and attr store1 > 1.356 ) and 
      (bondedto (attr store1 < 114.975873623  and attr store1 > 113.775873623 ) or 
       bondedto (attr store1 < 67.236  and attr store1 > 66.036 ) or 
       bondedto (attr store1 < 19.4961263766  and attr store1 > 18.2961263766 ))) 
6 0.1 0.1 peak 890 volume 4.65440 ppm1 1.406 ppm2 1.014
 
! ############### hot_mothernoesy_072403.891 folded +
assi (attr store1 < 1.001 and attr store1 > 0.801 )
     ((attr store1 < 1.458 and attr store1 > 1.358 ) and 
      (bondedto (attr store1 < 114.961873623  and attr store1 > 113.761873623 ) or 
       bondedto (attr store1 < 67.222  and attr store1 > 66.022 ) or 
       bondedto (attr store1 < 19.4821263766  and attr store1 > 18.2821263766 ))) 
6 0.1 0.1 peak 891 volume 9.15710 ppm1 1.408 ppm2 0.901
 
! ############### hot_mothernoesy_072403.892 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 1.444 and attr store1 > 1.344 ) and 
      (bondedto (attr store1 < 114.986873623  and attr store1 > 113.786873623 ) or 
       bondedto (attr store1 < 67.247  and attr store1 > 66.047 ) or 
       bondedto (attr store1 < 19.5071263766  and attr store1 > 18.3071263766 ))) 
6 0.1 0.1 peak 892 volume 8.36640 ppm1 1.394 ppm2 4.774
 
! ############### hot_mothernoesy_072403.893 folded +
assi (attr store1 < 4.364 and attr store1 > 4.164 )
     ((attr store1 < 1.454 and attr store1 > 1.354 ) and 
      (bondedto (attr store1 < 114.990873623  and attr store1 > 113.790873623 ) or 
       bondedto (attr store1 < 67.251  and attr store1 > 66.051 ) or 
       bondedto (attr store1 < 19.5111263766  and attr store1 > 18.3111263766 ))) 
6 0.1 0.1 peak 893 volume 79.92190 ppm1 1.404 ppm2 4.264
 
! ############### hot_mothernoesy_072403.894 folded +
assi (attr store1 < 2.804 and attr store1 > 2.604 )
     ((attr store1 < 1.443 and attr store1 > 1.343 ) and 
      (bondedto (attr store1 < 115.006873623  and attr store1 > 113.806873623 ) or 
       bondedto (attr store1 < 67.267  and attr store1 > 66.067 ) or 
       bondedto (attr store1 < 19.5271263766  and attr store1 > 18.3271263766 ))) 
6 0.1 0.1 peak 894 volume 3.86930 ppm1 1.393 ppm2 2.704
 
! ############### hot_mothernoesy_072403.895 folded +
assi (attr store1 < 2.383 and attr store1 > 2.183 )
     ((attr store1 < 1.445 and attr store1 > 1.345 ) and 
      (bondedto (attr store1 < 114.972873623  and attr store1 > 113.772873623 ) or 
       bondedto (attr store1 < 67.233  and attr store1 > 66.033 ) or 
       bondedto (attr store1 < 19.4931263766  and attr store1 > 18.2931263766 ))) 
6 0.1 0.1 peak 895 volume 3.59820 ppm1 1.395 ppm2 2.283
 
! ############### hot_mothernoesy_072403.896 folded +
assi (attr store1 < 2.2 and attr store1 > 2.0 )
     ((attr store1 < 1.443 and attr store1 > 1.343 ) and 
      (bondedto (attr store1 < 114.965873623  and attr store1 > 113.765873623 ) or 
       bondedto (attr store1 < 67.226  and attr store1 > 66.026 ) or 
       bondedto (attr store1 < 19.4861263766  and attr store1 > 18.2861263766 ))) 
6 0.1 0.1 peak 896 volume 6.36900 ppm1 1.393 ppm2 2.100
 
! ############### hot_mothernoesy_072403.897 folded +
assi (attr store1 < 1.888 and attr store1 > 1.688 )
     ((attr store1 < 1.442 and attr store1 > 1.342 ) and 
      (bondedto (attr store1 < 114.981873623  and attr store1 > 113.781873623 ) or 
       bondedto (attr store1 < 67.242  and attr store1 > 66.042 ) or 
       bondedto (attr store1 < 19.5021263766  and attr store1 > 18.3021263766 ))) 
6 0.1 0.1 peak 897 volume 7.30230 ppm1 1.392 ppm2 1.788
 
! ############### hot_mothernoesy_072403.898 folded +
assi (attr store1 < 4.344 and attr store1 > 4.144 )
     ((attr store1 < 1.358 and attr store1 > 1.258 ) and 
      (bondedto (attr store1 < 114.959873623  and attr store1 > 113.759873623 ) or 
       bondedto (attr store1 < 67.22  and attr store1 > 66.02 ) or 
       bondedto (attr store1 < 19.4801263766  and attr store1 > 18.2801263766 ))) 
6 0.1 0.1 peak 898 volume 43.74210 ppm1 1.308 ppm2 4.244
 
! ############### hot_mothernoesy_072403.899 folded +
assi (attr store1 < 1.409 and attr store1 > 1.209 )
     ((attr store1 < 1.359 and attr store1 > 1.259 ) and 
      (bondedto (attr store1 < 114.943873623  and attr store1 > 113.743873623 ) or 
       bondedto (attr store1 < 67.204  and attr store1 > 66.004 ) or 
       bondedto (attr store1 < 19.4641263766  and attr store1 > 18.2641263766 ))) 
6 0.1 0.1 peak 899 volume 2434.01465 ppm1 1.309 ppm2 1.309
 
! ############### hot_mothernoesy_072403.901 folded +
assi (attr store1 < 4.175 and attr store1 > 3.975 )
     ((attr store1 < 4.124 and attr store1 > 4.024 ) and 
      (bondedto (attr store1 < 114.890873623  and attr store1 > 113.690873623 ) or 
       bondedto (attr store1 < 67.151  and attr store1 > 65.951 ) or 
       bondedto (attr store1 < 19.4111263766  and attr store1 > 18.2111263766 ))) 
6 0.1 0.1 peak 901 volume 39.59300 ppm1 4.074 ppm2 4.075
 
! ############### hot_mothernoesy_072403.902 folded +
assi (attr store1 < 4.01 and attr store1 > 3.81 )
     ((attr store1 < 4.12 and attr store1 > 4.02 ) and 
      (bondedto (attr store1 < 114.848873623  and attr store1 > 113.648873623 ) or 
       bondedto (attr store1 < 67.109  and attr store1 > 65.909 ) or 
       bondedto (attr store1 < 19.3691263766  and attr store1 > 18.1691263766 ))) 
6 0.1 0.1 peak 902 volume 3.50830 ppm1 4.070 ppm2 3.910
 
! ############### hot_mothernoesy_072403.906 folded +
assi (attr store1 < 3.155 and attr store1 > 2.955 )
     ((attr store1 < 3.953 and attr store1 > 3.853 ) and 
      (bondedto (attr store1 < 114.879873623  and attr store1 > 113.679873623 ) or 
       bondedto (attr store1 < 67.14  and attr store1 > 65.94 ) or 
       bondedto (attr store1 < 19.4001263766  and attr store1 > 18.2001263766 ))) 
6 0.1 0.1 peak 906 volume 5.67510 ppm1 3.903 ppm2 3.055
 
! ############### hot_mothernoesy_072403.907 folded +
assi (attr store1 < 4.12 and attr store1 > 3.92 )
     ((attr store1 < 1.461 and attr store1 > 1.361 ) and 
      (bondedto (attr store1 < 114.882873623  and attr store1 > 113.682873623 ) or 
       bondedto (attr store1 < 67.143  and attr store1 > 65.943 ) or 
       bondedto (attr store1 < 19.4031263766  and attr store1 > 18.2031263766 ))) 
6 0.1 0.1 peak 907 volume 6.37400 ppm1 1.411 ppm2 4.020
 
! ############### hot_mothernoesy_072403.908 folded +
assi (attr store1 < 3.124 and attr store1 > 2.924 )
     ((attr store1 < 1.438 and attr store1 > 1.338 ) and 
      (bondedto (attr store1 < 114.899873623  and attr store1 > 113.699873623 ) or 
       bondedto (attr store1 < 67.16  and attr store1 > 65.96 ) or 
       bondedto (attr store1 < 19.4201263766  and attr store1 > 18.2201263766 ))) 
6 0.1 0.1 peak 908 volume 4.94620 ppm1 1.388 ppm2 3.024
 
! ############### hot_mothernoesy_072403.909 folded +
assi (attr store1 < 4.007 and attr store1 > 3.807 )
     ((attr store1 < 3.957 and attr store1 > 3.857 ) and 
      (bondedto (attr store1 < 114.806873623  and attr store1 > 113.606873623 ) or 
       bondedto (attr store1 < 67.067  and attr store1 > 65.867 ) or 
       bondedto (attr store1 < 19.3271263766  and attr store1 > 18.1271263766 ))) 
6 0.1 0.1 peak 909 volume 44.21780 ppm1 3.907 ppm2 3.907
 
! ############### hot_mothernoesy_072403.913 folded +
assi (attr store1 < 3.996 and attr store1 > 3.796 )
     ((attr store1 < 1.518 and attr store1 > 1.418 ) and 
      (bondedto (attr store1 < 114.759873623  and attr store1 > 113.559873623 ) or 
       bondedto (attr store1 < 67.02  and attr store1 > 65.82 ) or 
       bondedto (attr store1 < 19.2801263766  and attr store1 > 18.0801263766 ))) 
6 0.1 0.1 peak 913 volume 6.26980 ppm1 1.468 ppm2 3.896
 
! ############### hot_mothernoesy_072403.915 folded +
assi (attr store1 < 2.418 and attr store1 > 2.218 )
     ((attr store1 < 1.517 and attr store1 > 1.417 ) and 
      (bondedto (attr store1 < 114.740873623  and attr store1 > 113.540873623 ) or 
       bondedto (attr store1 < 67.001  and attr store1 > 65.801 ) or 
       bondedto (attr store1 < 19.2611263766  and attr store1 > 18.0611263766 ))) 
6 0.1 0.1 peak 915 volume 4.78620 ppm1 1.467 ppm2 2.318
 
! ############### hot_mothernoesy_072403.916 folded +
assi (attr store1 < 2.219 and attr store1 > 2.019 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 114.737873623  and attr store1 > 113.537873623 ) or 
       bondedto (attr store1 < 66.998  and attr store1 > 65.798 ) or 
       bondedto (attr store1 < 19.2581263766  and attr store1 > 18.0581263766 ))) 
6 0.1 0.1 peak 916 volume 10.93190 ppm1 1.465 ppm2 2.119
 
! ############### hot_mothernoesy_072403.917 folded +
assi (attr store1 < 2.073 and attr store1 > 1.873 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 114.737873623  and attr store1 > 113.537873623 ) or 
       bondedto (attr store1 < 66.998  and attr store1 > 65.798 ) or 
       bondedto (attr store1 < 19.2581263766  and attr store1 > 18.0581263766 ))) 
6 0.1 0.1 peak 917 volume 10.57810 ppm1 1.465 ppm2 1.973
 
! ############### hot_mothernoesy_072403.918 folded +
assi (attr store1 < 1.562 and attr store1 > 1.362 )
     ((attr store1 < 1.514 and attr store1 > 1.414 ) and 
      (bondedto (attr store1 < 114.741873623  and attr store1 > 113.541873623 ) or 
       bondedto (attr store1 < 67.002  and attr store1 > 65.802 ) or 
       bondedto (attr store1 < 19.2621263766  and attr store1 > 18.0621263766 ))) 
6 0.1 0.1 peak 918 volume 285.90991 ppm1 1.464 ppm2 1.462
 
! ############### hot_mothernoesy_072403.919 folded +
assi (attr store1 < 0.829 and attr store1 > 0.629 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 114.761873623  and attr store1 > 113.561873623 ) or 
       bondedto (attr store1 < 67.022  and attr store1 > 65.822 ) or 
       bondedto (attr store1 < 19.2821263766  and attr store1 > 18.0821263766 ))) 
6 0.1 0.1 peak 919 volume 4.21830 ppm1 1.465 ppm2 0.729
 
! ############### hot_mothernoesy_072403.920 folded +
assi (attr store1 < 4.141 and attr store1 > 3.941 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 114.732873623  and attr store1 > 113.532873623 ) or 
       bondedto (attr store1 < 66.993  and attr store1 > 65.793 ) or 
       bondedto (attr store1 < 19.2531263766  and attr store1 > 18.0531263766 ))) 
6 0.1 0.1 peak 920 volume 18.84740 ppm1 1.465 ppm2 4.041
 
! ############### hot_mothernoesy_072403.921 folded +
assi (attr store1 < 3.311 and attr store1 > 3.111 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 114.721873623  and attr store1 > 113.521873623 ) or 
       bondedto (attr store1 < 66.982  and attr store1 > 65.782 ) or 
       bondedto (attr store1 < 19.2421263766  and attr store1 > 18.0421263766 ))) 
6 0.1 0.1 peak 921 volume 4.74630 ppm1 1.465 ppm2 3.211
 
! ############### hot_mothernoesy_072403.922 folded +
assi (attr store1 < 2.54 and attr store1 > 2.34 )
     ((attr store1 < 1.517 and attr store1 > 1.417 ) and 
      (bondedto (attr store1 < 114.731873623  and attr store1 > 113.531873623 ) or 
       bondedto (attr store1 < 66.992  and attr store1 > 65.792 ) or 
       bondedto (attr store1 < 19.2521263766  and attr store1 > 18.0521263766 ))) 
6 0.1 0.1 peak 922 volume 4.88840 ppm1 1.467 ppm2 2.440
 
! ############### hot_mothernoesy_072403.923 folded -
assi (attr store1 < 3.265 and attr store1 > 3.065 )
     ((attr store1 < 2.934 and attr store1 > 2.834 ) and 
      (bondedto (attr store1 < 138.522810435  and attr store1 > 137.322810435 ) or 
       bondedto (attr store1 < 43.0430631883  and attr store1 > 41.8430631883 ))) 
6 0.1 0.1 peak 923 volume 4.4703 ppm1 2.884 ppm2 3.165
 
! ############### hot_mothernoesy_072403.924 folded -
assi (attr store1 < 2.985 and attr store1 > 2.785 )
     ((attr store1 < 2.935 and attr store1 > 2.835 ) and 
      (bondedto (attr store1 < 138.538810435  and attr store1 > 137.338810435 ) or 
       bondedto (attr store1 < 43.0590631883  and attr store1 > 41.8590631883 ))) 
6 0.1 0.1 peak 924 volume 49.5374 ppm1 2.885 ppm2 2.885
 
! ############### hot_mothernoesy_072403.925 folded -
assi (attr store1 < 1.995 and attr store1 > 1.795 )
     ((attr store1 < 2.932 and attr store1 > 2.832 ) and 
      (bondedto (attr store1 < 138.537810435  and attr store1 > 137.337810435 ) or 
       bondedto (attr store1 < 43.0580631883  and attr store1 > 41.8580631883 ))) 
6 0.1 0.1 peak 925 volume 7.2356 ppm1 2.882 ppm2 1.895
 
! ############### hot_mothernoesy_072403.926 folded -
assi (attr store1 < 1.62 and attr store1 > 1.42 )
     ((attr store1 < 2.933 and attr store1 > 2.833 ) and 
      (bondedto (attr store1 < 138.537810435  and attr store1 > 137.337810435 ) or 
       bondedto (attr store1 < 43.0580631883  and attr store1 > 41.8580631883 ))) 
6 0.1 0.1 peak 926 volume 7.8309 ppm1 2.883 ppm2 1.520
 
! ############### hot_mothernoesy_072403.927 folded -
assi (attr store1 < 1.096 and attr store1 > 0.896 )
     ((attr store1 < 2.934 and attr store1 > 2.834 ) and 
      (bondedto (attr store1 < 138.538810435  and attr store1 > 137.338810435 ) or 
       bondedto (attr store1 < 43.0590631883  and attr store1 > 41.8590631883 ))) 
6 0.1 0.1 peak 927 volume 21.1351 ppm1 2.884 ppm2 0.996
 
! ############### hot_mothernoesy_072403.928 folded -
assi (attr store1 < 3.87 and attr store1 > 3.67 )
     ((attr store1 < 1.296 and attr store1 > 1.196 ) and 
      (bondedto (attr store1 < 138.545810435  and attr store1 > 137.345810435 ) or 
       bondedto (attr store1 < 43.0660631883  and attr store1 > 41.8660631883 ))) 
6 0.1 0.1 peak 928 volume 4.1253 ppm1 1.246 ppm2 3.770
 
! ############### hot_mothernoesy_072403.929 folded +
assi (attr store1 < 2.386 and attr store1 > 2.186 )
     ((attr store1 < 1.405 and attr store1 > 1.305 ) and 
      (bondedto (attr store1 < 114.605873623  and attr store1 > 113.405873623 ) or 
       bondedto (attr store1 < 66.866  and attr store1 > 65.666 ) or 
       bondedto (attr store1 < 19.1261263766  and attr store1 > 17.9261263766 ))) 
6 0.1 0.1 peak 929 volume 3.15620 ppm1 1.355 ppm2 2.286
 
! ############### hot_mothernoesy_072403.930 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 1.402 and attr store1 > 1.302 ) and 
      (bondedto (attr store1 < 114.612873623  and attr store1 > 113.412873623 ) or 
       bondedto (attr store1 < 66.873  and attr store1 > 65.673 ) or 
       bondedto (attr store1 < 19.1331263766  and attr store1 > 17.9331263766 ))) 
6 0.1 0.1 peak 930 volume 4.35770 ppm1 1.352 ppm2 4.772
 
! ############### hot_mothernoesy_072403.931 folded +
assi (attr store1 < 4.074 and attr store1 > 3.874 )
     ((attr store1 < 1.401 and attr store1 > 1.301 ) and 
      (bondedto (attr store1 < 114.615873623  and attr store1 > 113.415873623 ) or 
       bondedto (attr store1 < 66.876  and attr store1 > 65.676 ) or 
       bondedto (attr store1 < 19.1361263766  and attr store1 > 17.9361263766 ))) 
6 0.1 0.1 peak 931 volume 13.98340 ppm1 1.351 ppm2 3.974
 
! ############### hot_mothernoesy_072403.933 folded +
assi (attr store1 < 2.734 and attr store1 > 2.534 )
     ((attr store1 < 1.399 and attr store1 > 1.299 ) and 
      (bondedto (attr store1 < 114.623873623  and attr store1 > 113.423873623 ) or 
       bondedto (attr store1 < 66.884  and attr store1 > 65.684 ) or 
       bondedto (attr store1 < 19.1441263766  and attr store1 > 17.9441263766 ))) 
6 0.1 0.1 peak 933 volume 6.64430 ppm1 1.349 ppm2 2.634
 
! ############### hot_mothernoesy_072403.934 folded +
assi (attr store1 < 1.975 and attr store1 > 1.775 )
     ((attr store1 < 1.401 and attr store1 > 1.301 ) and 
      (bondedto (attr store1 < 114.608873623  and attr store1 > 113.408873623 ) or 
       bondedto (attr store1 < 66.869  and attr store1 > 65.669 ) or 
       bondedto (attr store1 < 19.1291263766  and attr store1 > 17.9291263766 ))) 
6 0.1 0.1 peak 934 volume 6.13810 ppm1 1.351 ppm2 1.875
 
! ############### hot_mothernoesy_072403.935 folded +
assi (attr store1 < 1.044 and attr store1 > 0.844 )
     ((attr store1 < 1.399 and attr store1 > 1.299 ) and 
      (bondedto (attr store1 < 114.615873623  and attr store1 > 113.415873623 ) or 
       bondedto (attr store1 < 66.876  and attr store1 > 65.676 ) or 
       bondedto (attr store1 < 19.1361263766  and attr store1 > 17.9361263766 ))) 
6 0.1 0.1 peak 935 volume 14.22530 ppm1 1.349 ppm2 0.944
 
! ############### hot_mothernoesy_072403.937 folded +
assi (attr store1 < 4.137 and attr store1 > 3.937 )
     ((attr store1 < 1.095 and attr store1 > 0.995 ) and 
      (bondedto (attr store1 < 114.547873623  and attr store1 > 113.347873623 ) or 
       bondedto (attr store1 < 66.808  and attr store1 > 65.608 ) or 
       bondedto (attr store1 < 19.0681263766  and attr store1 > 17.8681263766 ))) 
6 0.1 0.1 peak 937 volume 7.40670 ppm1 1.045 ppm2 4.037
 
! ############### hot_mothernoesy_072403.938 folded +
assi (attr store1 < 2.436 and attr store1 > 2.236 )
     ((attr store1 < 1.094 and attr store1 > 0.994 ) and 
      (bondedto (attr store1 < 114.567873623  and attr store1 > 113.367873623 ) or 
       bondedto (attr store1 < 66.828  and attr store1 > 65.628 ) or 
       bondedto (attr store1 < 19.0881263766  and attr store1 > 17.8881263766 ))) 
6 0.1 0.1 peak 938 volume 15.23560 ppm1 1.044 ppm2 2.336
 
! ############### hot_mothernoesy_072403.939 folded +
assi (attr store1 < 2.164 and attr store1 > 1.964 )
     ((attr store1 < 1.096 and attr store1 > 0.996 ) and 
      (bondedto (attr store1 < 114.558873623  and attr store1 > 113.358873623 ) or 
       bondedto (attr store1 < 66.819  and attr store1 > 65.619 ) or 
       bondedto (attr store1 < 19.0791263766  and attr store1 > 17.8791263766 ))) 
6 0.1 0.1 peak 939 volume 21.89330 ppm1 1.046 ppm2 2.064
 
! ############### hot_mothernoesy_072403.941 folded +
assi (attr store1 < 1.472 and attr store1 > 1.272 )
     ((attr store1 < 1.096 and attr store1 > 0.996 ) and 
      (bondedto (attr store1 < 114.567873623  and attr store1 > 113.367873623 ) or 
       bondedto (attr store1 < 66.828  and attr store1 > 65.628 ) or 
       bondedto (attr store1 < 19.0881263766  and attr store1 > 17.8881263766 ))) 
6 0.1 0.1 peak 941 volume 3.52360 ppm1 1.046 ppm2 1.372
 
! ############### hot_mothernoesy_072403.942 folded +
assi (attr store1 < 1.145 and attr store1 > 0.945 )
     ((attr store1 < 1.096 and attr store1 > 0.996 ) and 
      (bondedto (attr store1 < 114.561873623  and attr store1 > 113.361873623 ) or 
       bondedto (attr store1 < 66.822  and attr store1 > 65.622 ) or 
       bondedto (attr store1 < 19.0821263766  and attr store1 > 17.8821263766 ))) 
6 0.1 0.1 peak 942 volume 385.02261 ppm1 1.046 ppm2 1.045
 
! ############### hot_mothernoesy_072403.944 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 2.934 and attr store1 > 2.834 ) and 
      (bondedto (attr store1 < 138.486810435  and attr store1 > 137.286810435 ) or 
       bondedto (attr store1 < 43.0070631883  and attr store1 > 41.8070631883 ))) 
6 0.1 0.1 peak 944 volume 18.841 ppm1 2.884 ppm2 4.773
 
! ############### hot_mothernoesy_072403.945 folded +
assi (attr store1 < 1.585 and attr store1 > 1.385 )
     ((attr store1 < 1.096 and attr store1 > 0.996 ) and 
      (bondedto (attr store1 < 114.516873623  and attr store1 > 113.316873623 ) or 
       bondedto (attr store1 < 66.777  and attr store1 > 65.577 ) or 
       bondedto (attr store1 < 19.0371263766  and attr store1 > 17.8371263766 ))) 
6 0.1 0.1 peak 945 volume 18.09480 ppm1 1.046 ppm2 1.485
 
! ############### hot_mothernoesy_072403.946 folded +
assi (attr store1 < 3.632 and attr store1 > 3.432 )
     ((attr store1 < 3.582 and attr store1 > 3.482 ) and 
      (bondedto (attr store1 < 114.367873623  and attr store1 > 113.167873623 ) or 
       bondedto (attr store1 < 66.628  and attr store1 > 65.428 ) or 
       bondedto (attr store1 < 18.8881263766  and attr store1 > 17.6881263766 ))) 
6 0.1 0.1 peak 946 volume 38.76700 ppm1 3.532 ppm2 3.532
 
! ############### hot_mothernoesy_072403.947 folded +
assi (attr store1 < 2.169 and attr store1 > 1.969 )
     ((attr store1 < 3.583 and attr store1 > 3.483 ) and 
      (bondedto (attr store1 < 114.381873623  and attr store1 > 113.181873623 ) or 
       bondedto (attr store1 < 66.642  and attr store1 > 65.442 ) or 
       bondedto (attr store1 < 18.9021263766  and attr store1 > 17.7021263766 ))) 
6 0.1 0.1 peak 947 volume 4.73500 ppm1 3.533 ppm2 2.069
 
! ############### hot_mothernoesy_072403.948 folded +
assi (attr store1 < 2.041 and attr store1 > 1.841 )
     ((attr store1 < 3.582 and attr store1 > 3.482 ) and 
      (bondedto (attr store1 < 114.378873623  and attr store1 > 113.178873623 ) or 
       bondedto (attr store1 < 66.639  and attr store1 > 65.439 ) or 
       bondedto (attr store1 < 18.8991263766  and attr store1 > 17.6991263766 ))) 
6 0.1 0.1 peak 948 volume 3.48360 ppm1 3.532 ppm2 1.941
 
! ############### hot_mothernoesy_072403.950 folded -
assi (attr store1 < 1.951 and attr store1 > 1.751 )
     ((attr store1 < 3.099 and attr store1 > 2.999 ) and 
      (bondedto (attr store1 < 138.265810435  and attr store1 > 137.065810435 ) or 
       bondedto (attr store1 < 42.7860631883  and attr store1 > 41.5860631883 ))) 
6 0.1 0.1 peak 950 volume 5.1631 ppm1 3.049 ppm2 1.851
 
! ############### hot_mothernoesy_072403.951 folded -
assi (attr store1 < 1.838 and attr store1 > 1.638 )
     ((attr store1 < 3.092 and attr store1 > 2.992 ) and 
      (bondedto (attr store1 < 138.253810435  and attr store1 > 137.053810435 ) or 
       bondedto (attr store1 < 42.7740631883  and attr store1 > 41.5740631883 ))) 
6 0.1 0.1 peak 951 volume 39.0055 ppm1 3.042 ppm2 1.738
 
! ############### hot_mothernoesy_072403.952 folded -
assi (attr store1 < 3.128 and attr store1 > 2.928 )
     ((attr store1 < 3.077 and attr store1 > 2.977 ) and 
      (bondedto (attr store1 < 138.281810435  and attr store1 > 137.081810435 ) or 
       bondedto (attr store1 < 42.8020631883  and attr store1 > 41.6020631883 ))) 
6 0.1 0.1 peak 952 volume 7404.57861 ppm1 3.027 ppm2 3.028
 
! ############### hot_mothernoesy_072403.953 folded +
assi (attr store1 < 2.406 and attr store1 > 2.206 )
     ((attr store1 < 3.581 and attr store1 > 3.481 ) and 
      (bondedto (attr store1 < 114.353873623  and attr store1 > 113.153873623 ) or 
       bondedto (attr store1 < 66.614  and attr store1 > 65.414 ) or 
       bondedto (attr store1 < 18.8741263766  and attr store1 > 17.6741263766 ))) 
6 0.1 0.1 peak 953 volume 5.49810 ppm1 3.531 ppm2 2.306
 
! ############### hot_mothernoesy_072403.955 folded -
assi (attr store1 < 3.058 and attr store1 > 2.858 )
     ((attr store1 < 3.008 and attr store1 > 2.908 ) and 
      (bondedto (attr store1 < 138.176810435  and attr store1 > 136.976810435 ) or 
       bondedto (attr store1 < 42.6970631883  and attr store1 > 41.4970631883 ))) 
6 0.1 0.1 peak 955 volume 1548.98828 ppm1 2.958 ppm2 2.958
 
! ############### hot_mothernoesy_072403.956 folded -
assi (attr store1 < 1.979 and attr store1 > 1.779 )
     ((attr store1 < 3.006 and attr store1 > 2.906 ) and 
      (bondedto (attr store1 < 138.187810435  and attr store1 > 136.987810435 ) or 
       bondedto (attr store1 < 42.7080631883  and attr store1 > 41.5080631883 ))) 
6 0.1 0.1 peak 956 volume 5.3235 ppm1 2.956 ppm2 1.879
 
! ############### hot_mothernoesy_072403.957 folded -
assi (attr store1 < 1.896 and attr store1 > 1.696 )
     ((attr store1 < 3.007 and attr store1 > 2.907 ) and 
      (bondedto (attr store1 < 138.183810435  and attr store1 > 136.983810435 ) or 
       bondedto (attr store1 < 42.7040631883  and attr store1 > 41.5040631883 ))) 
6 0.1 0.1 peak 957 volume 5.0891 ppm1 2.957 ppm2 1.796
 
! ############### hot_mothernoesy_072403.958 folded -
assi (attr store1 < 1.742 and attr store1 > 1.542 )
     ((attr store1 < 3.008 and attr store1 > 2.908 ) and 
      (bondedto (attr store1 < 138.183810435  and attr store1 > 136.983810435 ) or 
       bondedto (attr store1 < 42.7040631883  and attr store1 > 41.5040631883 ))) 
6 0.1 0.1 peak 958 volume 46.0517 ppm1 2.958 ppm2 1.642
 
! ############### hot_mothernoesy_072403.959 folded -
assi (attr store1 < 1.578 and attr store1 > 1.378 )
     ((attr store1 < 3.008 and attr store1 > 2.908 ) and 
      (bondedto (attr store1 < 138.188810435  and attr store1 > 136.988810435 ) or 
       bondedto (attr store1 < 42.7090631883  and attr store1 > 41.5090631883 ))) 
6 0.1 0.1 peak 959 volume 17.5738 ppm1 2.958 ppm2 1.478
 
! ############### hot_mothernoesy_072403.960 folded -
assi (attr store1 < 1.242 and attr store1 > 1.042 )
     ((attr store1 < 3.007 and attr store1 > 2.907 ) and 
      (bondedto (attr store1 < 138.191810435  and attr store1 > 136.991810435 ) or 
       bondedto (attr store1 < 42.7120631883  and attr store1 > 41.5120631883 ))) 
6 0.1 0.1 peak 960 volume 4.2194 ppm1 2.957 ppm2 1.142
 
! ############### hot_mothernoesy_072403.962 folded -
assi (attr store1 < 2.01 and attr store1 > 1.81 )
     ((attr store1 < 2.094 and attr store1 > 1.994 ) and 
      (bondedto (attr store1 < 138.166810435  and attr store1 > 136.966810435 ) or 
       bondedto (attr store1 < 42.6870631883  and attr store1 > 41.4870631883 ))) 
6 0.1 0.1 peak 962 volume 6.0844 ppm1 2.044 ppm2 1.910
 
! ############### hot_mothernoesy_072403.964 folded -
assi (attr store1 < 1.785 and attr store1 > 1.585 )
     ((attr store1 < 2.089 and attr store1 > 1.989 ) and 
      (bondedto (attr store1 < 138.143810435  and attr store1 > 136.943810435 ) or 
       bondedto (attr store1 < 42.6640631883  and attr store1 > 41.4640631883 ))) 
6 0.1 0.1 peak 964 volume 3.541 ppm1 2.039 ppm2 1.685
 
! ############### hot_mothernoesy_072403.966 folded -
assi (attr store1 < 4.164 and attr store1 > 3.964 )
     ((attr store1 < 1.73 and attr store1 > 1.63 ) and 
      (bondedto (attr store1 < 138.152810435  and attr store1 > 136.952810435 ) or 
       bondedto (attr store1 < 42.6730631883  and attr store1 > 41.4730631883 ))) 
6 0.1 0.1 peak 966 volume 8.4467 ppm1 1.680 ppm2 4.064
 
! ############### hot_mothernoesy_072403.967 folded +
assi (attr store1 < 2.695 and attr store1 > 2.495 )
     ((attr store1 < 2.853 and attr store1 > 2.753 ) and 
      (bondedto (attr store1 < 114.251873623  and attr store1 > 113.051873623 ) or 
       bondedto (attr store1 < 66.512  and attr store1 > 65.312 ) or 
       bondedto (attr store1 < 18.7721263766  and attr store1 > 17.5721263766 ))) 
6 0.1 0.1 peak 967 volume 9.41750 ppm1 2.803 ppm2 2.595
 
! ############### hot_mothernoesy_072403.968 folded +
assi (attr store1 < 2.701 and attr store1 > 2.501 )
     ((attr store1 < 2.65 and attr store1 > 2.55 ) and 
      (bondedto (attr store1 < 114.261873623  and attr store1 > 113.061873623 ) or 
       bondedto (attr store1 < 66.522  and attr store1 > 65.322 ) or 
       bondedto (attr store1 < 18.7821263766  and attr store1 > 17.5821263766 ))) 
6 0.1 0.1 peak 968 volume 28.95400 ppm1 2.600 ppm2 2.601
 
! ############### hot_mothernoesy_072403.969 folded -
assi (attr store1 < 2.142 and attr store1 > 1.942 )
     ((attr store1 < 2.085 and attr store1 > 1.985 ) and 
      (bondedto (attr store1 < 138.112810435  and attr store1 > 136.912810435 ) or 
       bondedto (attr store1 < 42.6330631883  and attr store1 > 41.4330631883 ))) 
6 0.1 0.1 peak 969 volume 13.5657 ppm1 2.035 ppm2 2.042
 
! ############### hot_mothernoesy_072403.971 folded -
assi (attr store1 < 4.148 and attr store1 > 3.948 )
     ((attr store1 < 1.844 and attr store1 > 1.744 ) and 
      (bondedto (attr store1 < 138.100810435  and attr store1 > 136.900810435 ) or 
       bondedto (attr store1 < 42.6210631883  and attr store1 > 41.4210631883 ))) 
6 0.1 0.1 peak 971 volume 4.8511 ppm1 1.794 ppm2 4.048
 
! ############### hot_mothernoesy_072403.972 folded -
assi (attr store1 < 1.688 and attr store1 > 1.488 )
     ((attr store1 < 1.733 and attr store1 > 1.633 ) and 
      (bondedto (attr store1 < 138.068810435  and attr store1 > 136.868810435 ) or 
       bondedto (attr store1 < 42.5890631883  and attr store1 > 41.3890631883 ))) 
6 0.1 0.1 peak 972 volume 12.0418 ppm1 1.683 ppm2 1.588
 
! ############### hot_mothernoesy_072403.973 folded -
assi (attr store1 < 1.778 and attr store1 > 1.578 )
     ((attr store1 < 1.726 and attr store1 > 1.626 ) and 
      (bondedto (attr store1 < 138.129810435  and attr store1 > 136.929810435 ) or 
       bondedto (attr store1 < 42.6500631883  and attr store1 > 41.4500631883 ))) 
6 0.1 0.1 peak 973 volume 54.1092 ppm1 1.676 ppm2 1.678
 
! ############### hot_mothernoesy_072403.974 folded +
assi (attr store1 < 2.848 and attr store1 > 2.648 )
     ((attr store1 < 2.798 and attr store1 > 2.698 ) and 
      (bondedto (attr store1 < 114.128873623  and attr store1 > 112.928873623 ) or 
       bondedto (attr store1 < 66.389  and attr store1 > 65.189 ) or 
       bondedto (attr store1 < 18.6491263766  and attr store1 > 17.4491263766 ))) 
6 0.1 0.1 peak 974 volume 141.17220 ppm1 2.748 ppm2 2.748
 
! ############### hot_mothernoesy_072403.975 folded +
assi (attr store1 < 4.875 and attr store1 > 4.675 )
     ((attr store1 < 1.295 and attr store1 > 1.195 ) and 
      (bondedto (attr store1 < 114.133873623  and attr store1 > 112.933873623 ) or 
       bondedto (attr store1 < 66.394  and attr store1 > 65.194 ) or 
       bondedto (attr store1 < 18.6541263766  and attr store1 > 17.4541263766 ))) 
6 0.1 0.1 peak 975 volume 3.43980 ppm1 1.245 ppm2 4.775
 
! ############### hot_mothernoesy_072403.977 folded +
assi (attr store1 < 4.143 and attr store1 > 3.943 )
     ((attr store1 < 1.296 and attr store1 > 1.196 ) and 
      (bondedto (attr store1 < 114.097873623  and attr store1 > 112.897873623 ) or 
       bondedto (attr store1 < 66.358  and attr store1 > 65.158 ) or 
       bondedto (attr store1 < 18.6181263766  and attr store1 > 17.4181263766 ))) 
6 0.1 0.1 peak 977 volume 3.34830 ppm1 1.246 ppm2 4.043
 
! ############### hot_mothernoesy_072403.978 folded +
assi (attr store1 < 4.003 and attr store1 > 3.803 )
     ((attr store1 < 1.297 and attr store1 > 1.197 ) and 
      (bondedto (attr store1 < 114.120873623  and attr store1 > 112.920873623 ) or 
       bondedto (attr store1 < 66.381  and attr store1 > 65.181 ) or 
       bondedto (attr store1 < 18.6411263766  and attr store1 > 17.4411263766 ))) 
6 0.1 0.1 peak 978 volume 9.60860 ppm1 1.247 ppm2 3.903
 
! ############### hot_mothernoesy_072403.980 folded +
assi (attr store1 < 3.27 and attr store1 > 3.07 )
     ((attr store1 < 1.295 and attr store1 > 1.195 ) and 
      (bondedto (attr store1 < 114.116873623  and attr store1 > 112.916873623 ) or 
       bondedto (attr store1 < 66.377  and attr store1 > 65.177 ) or 
       bondedto (attr store1 < 18.6371263766  and attr store1 > 17.4371263766 ))) 
6 0.1 0.1 peak 980 volume 5.18800 ppm1 1.245 ppm2 3.170
 
! ############### hot_mothernoesy_072403.981 folded +
assi (attr store1 < 1.948 and attr store1 > 1.748 )
     ((attr store1 < 1.296 and attr store1 > 1.196 ) and 
      (bondedto (attr store1 < 114.113873623  and attr store1 > 112.913873623 ) or 
       bondedto (attr store1 < 66.374  and attr store1 > 65.174 ) or 
       bondedto (attr store1 < 18.6341263766  and attr store1 > 17.4341263766 ))) 
6 0.1 0.1 peak 981 volume 7.61030 ppm1 1.246 ppm2 1.848
 
! ############### hot_mothernoesy_072403.983 folded +
assi (attr store1 < 1.655 and attr store1 > 1.455 )
     ((attr store1 < 1.297 and attr store1 > 1.197 ) and 
      (bondedto (attr store1 < 114.119873623  and attr store1 > 112.919873623 ) or 
       bondedto (attr store1 < 66.38  and attr store1 > 65.18 ) or 
       bondedto (attr store1 < 18.6401263766  and attr store1 > 17.4401263766 ))) 
6 0.1 0.1 peak 983 volume 8.99640 ppm1 1.247 ppm2 1.555
 
! ############### hot_mothernoesy_072403.984 folded +
assi (attr store1 < 1.346 and attr store1 > 1.146 )
     ((attr store1 < 1.297 and attr store1 > 1.197 ) and 
      (bondedto (attr store1 < 114.109873623  and attr store1 > 112.909873623 ) or 
       bondedto (attr store1 < 66.37  and attr store1 > 65.17 ) or 
       bondedto (attr store1 < 18.6301263766  and attr store1 > 17.4301263766 ))) 
6 0.1 0.1 peak 984 volume 142.06360 ppm1 1.247 ppm2 1.246
 
! ############### hot_mothernoesy_072403.985 folded +
assi (attr store1 < 1.05 and attr store1 > 0.85 )
     ((attr store1 < 1.296 and attr store1 > 1.196 ) and 
      (bondedto (attr store1 < 114.109873623  and attr store1 > 112.909873623 ) or 
       bondedto (attr store1 < 66.37  and attr store1 > 65.17 ) or 
       bondedto (attr store1 < 18.6301263766  and attr store1 > 17.4301263766 ))) 
6 0.1 0.1 peak 985 volume 12.38270 ppm1 1.246 ppm2 0.950
 
! ############### hot_mothernoesy_072403.986 folded +
assi (attr store1 < 0.877 and attr store1 > 0.677 )
     ((attr store1 < 1.296 and attr store1 > 1.196 ) and 
      (bondedto (attr store1 < 114.127873623  and attr store1 > 112.927873623 ) or 
       bondedto (attr store1 < 66.388  and attr store1 > 65.188 ) or 
       bondedto (attr store1 < 18.6481263766  and attr store1 > 17.4481263766 ))) 
6 0.1 0.1 peak 986 volume 5.38990 ppm1 1.246 ppm2 0.777
 
! ############### hot_mothernoesy_072403.987 folded -
assi (attr store1 < 4.202 and attr store1 > 4.002 )
     ((attr store1 < 1.825 and attr store1 > 1.725 ) and 
      (bondedto (attr store1 < 137.992810435  and attr store1 > 136.792810435 ) or 
       bondedto (attr store1 < 42.5130631883  and attr store1 > 41.3130631883 ))) 
6 0.1 0.1 peak 987 volume 4.6801 ppm1 1.775 ppm2 4.102
 
! ############### hot_mothernoesy_072403.988 folded -
assi (attr store1 < 1.085 and attr store1 > 0.885 )
     ((attr store1 < 1.712 and attr store1 > 1.612 ) and 
      (bondedto (attr store1 < 138.018810435  and attr store1 > 136.818810435 ) or 
       bondedto (attr store1 < 42.5390631883  and attr store1 > 41.3390631883 ))) 
6 0.1 0.1 peak 988 volume 12.1201 ppm1 1.662 ppm2 0.985
 
! ############### hot_mothernoesy_072403.991 folded +
assi (attr store1 < 2.74 and attr store1 > 2.54 )
     ((attr store1 < 2.8 and attr store1 > 2.7 ) and 
      (bondedto (attr store1 < 114.072873623  and attr store1 > 112.872873623 ) or 
       bondedto (attr store1 < 66.333  and attr store1 > 65.133 ) or 
       bondedto (attr store1 < 18.5931263766  and attr store1 > 17.3931263766 ))) 
6 0.1 0.1 peak 991 volume 53.87900 ppm1 2.750 ppm2 2.640
 
! ############### hot_mothernoesy_072403.992 folded +
assi (attr store1 < 2.847 and attr store1 > 2.647 )
     ((attr store1 < 2.688 and attr store1 > 2.588 ) and 
      (bondedto (attr store1 < 114.055873623  and attr store1 > 112.855873623 ) or 
       bondedto (attr store1 < 66.316  and attr store1 > 65.116 ) or 
       bondedto (attr store1 < 18.5761263766  and attr store1 > 17.3761263766 ))) 
6 0.1 0.1 peak 992 volume 57.48200 ppm1 2.638 ppm2 2.747
 
! ############### hot_mothernoesy_072403.993 folded +
assi (attr store1 < 2.748 and attr store1 > 2.548 )
     ((attr store1 < 2.564 and attr store1 > 2.464 ) and 
      (bondedto (attr store1 < 114.009873623  and attr store1 > 112.809873623 ) or 
       bondedto (attr store1 < 66.27  and attr store1 > 65.07 ) or 
       bondedto (attr store1 < 18.5301263766  and attr store1 > 17.3301263766 ))) 
6 0.1 0.1 peak 993 volume 20.20050 ppm1 2.514 ppm2 2.648
 
! ############### hot_mothernoesy_072403.994 folded -
assi (attr store1 < 1.0 and attr store1 > 0.8 )
     ((attr store1 < 1.926 and attr store1 > 1.826 ) and 
      (bondedto (attr store1 < 137.907810435  and attr store1 > 136.707810435 ) or 
       bondedto (attr store1 < 42.4280631883  and attr store1 > 41.2280631883 ))) 
6 0.1 0.1 peak 994 volume 8.8159 ppm1 1.876 ppm2 0.900
 
! ############### hot_mothernoesy_072403.995 folded -
assi (attr store1 < 4.383 and attr store1 > 4.183 )
     ((attr store1 < 1.852 and attr store1 > 1.752 ) and 
      (bondedto (attr store1 < 137.874810435  and attr store1 > 136.674810435 ) or 
       bondedto (attr store1 < 42.3950631883  and attr store1 > 41.1950631883 ))) 
6 0.1 0.1 peak 995 volume 6.7118 ppm1 1.802 ppm2 4.283
 
! ############### hot_mothernoesy_072403.996 folded -
assi (attr store1 < 1.752 and attr store1 > 1.552 )
     ((attr store1 < 1.851 and attr store1 > 1.751 ) and 
      (bondedto (attr store1 < 137.926810435  and attr store1 > 136.726810435 ) or 
       bondedto (attr store1 < 42.4470631883  and attr store1 > 41.2470631883 ))) 
6 0.1 0.1 peak 996 volume 23.21 ppm1 1.801 ppm2 1.652
 
! ############### hot_mothernoesy_072403.997 folded -
assi (attr store1 < 1.089 and attr store1 > 0.889 )
     ((attr store1 < 1.851 and attr store1 > 1.751 ) and 
      (bondedto (attr store1 < 137.916810435  and attr store1 > 136.716810435 ) or 
       bondedto (attr store1 < 42.4370631883  and attr store1 > 41.2370631883 ))) 
6 0.1 0.1 peak 997 volume 23.3329 ppm1 1.801 ppm2 0.989
 
! ############### hot_mothernoesy_072403.998 folded -
assi (attr store1 < 0.909 and attr store1 > 0.709 )
     ((attr store1 < 1.813 and attr store1 > 1.713 ) and 
      (bondedto (attr store1 < 137.912810435  and attr store1 > 136.712810435 ) or 
       bondedto (attr store1 < 42.4330631883  and attr store1 > 41.2330631883 ))) 
6 0.1 0.1 peak 998 volume 10.1625 ppm1 1.763 ppm2 0.809
 
! ############### hot_mothernoesy_072403.999 folded -
assi (attr store1 < 4.378 and attr store1 > 4.178 )
     ((attr store1 < 1.703 and attr store1 > 1.603 ) and 
      (bondedto (attr store1 < 137.919810435  and attr store1 > 136.719810435 ) or 
       bondedto (attr store1 < 42.4400631883  and attr store1 > 41.2400631883 ))) 
6 0.1 0.1 peak 999 volume 5.5323 ppm1 1.653 ppm2 4.278
 
! ############### hot_mothernoesy_072403.1000 folded -
assi (attr store1 < 1.906 and attr store1 > 1.706 )
     ((attr store1 < 1.701 and attr store1 > 1.601 ) and 
      (bondedto (attr store1 < 137.917810435  and attr store1 > 136.717810435 ) or 
       bondedto (attr store1 < 42.4380631883  and attr store1 > 41.2380631883 ))) 
6 0.1 0.1 peak 1000 volume 25.0357 ppm1 1.651 ppm2 1.806
 
! ############### hot_mothernoesy_072403.1001 folded -
assi (attr store1 < 1.003 and attr store1 > 0.803 )
     ((attr store1 < 1.701 and attr store1 > 1.601 ) and 
      (bondedto (attr store1 < 137.899810435  and attr store1 > 136.699810435 ) or 
       bondedto (attr store1 < 42.4200631883  and attr store1 > 41.2200631883 ))) 
6 0.1 0.1 peak 1001 volume 6.7725 ppm1 1.651 ppm2 0.903
 
! ############### hot_mothernoesy_072403.1002 folded -
assi (attr store1 < 4.374 and attr store1 > 4.174 )
     ((attr store1 < 1.623 and attr store1 > 1.523 ) and 
      (bondedto (attr store1 < 137.902810435  and attr store1 > 136.702810435 ) or 
       bondedto (attr store1 < 42.4230631883  and attr store1 > 41.2230631883 ))) 
6 0.1 0.1 peak 1002 volume 3.3296 ppm1 1.573 ppm2 4.274
 
! ############### hot_mothernoesy_072403.1003 folded -
assi (attr store1 < 4.212 and attr store1 > 4.012 )
     ((attr store1 < 1.62 and attr store1 > 1.52 ) and 
      (bondedto (attr store1 < 137.933810435  and attr store1 > 136.733810435 ) or 
       bondedto (attr store1 < 42.4540631883  and attr store1 > 41.2540631883 ))) 
6 0.1 0.1 peak 1003 volume 6.0056 ppm1 1.570 ppm2 4.112
 
! ############### hot_mothernoesy_072403.1004 folded -
assi (attr store1 < 0.907 and attr store1 > 0.707 )
     ((attr store1 < 1.622 and attr store1 > 1.522 ) and 
      (bondedto (attr store1 < 137.929810435  and attr store1 > 136.729810435 ) or 
       bondedto (attr store1 < 42.4500631883  and attr store1 > 41.2500631883 ))) 
6 0.1 0.1 peak 1004 volume 13.4141 ppm1 1.572 ppm2 0.807
 
! ############### hot_mothernoesy_072403.1005 folded -
assi (attr store1 < 4.124 and attr store1 > 3.924 )
     ((attr store1 < 0.951 and attr store1 > 0.851 ) and 
      (bondedto (attr store1 < 137.920810435  and attr store1 > 136.720810435 ) or 
       bondedto (attr store1 < 42.4410631883  and attr store1 > 41.2410631883 ))) 
6 0.1 0.1 peak 1005 volume 6.7822 ppm1 0.901 ppm2 4.024
 
! ############### hot_mothernoesy_072403.1006 folded -
assi (attr store1 < 1.973 and attr store1 > 1.773 )
     ((attr store1 < 0.952 and attr store1 > 0.852 ) and 
      (bondedto (attr store1 < 137.923810435  and attr store1 > 136.723810435 ) or 
       bondedto (attr store1 < 42.4440631883  and attr store1 > 41.2440631883 ))) 
6 0.1 0.1 peak 1006 volume 11.6949 ppm1 0.902 ppm2 1.873
 
! ############### hot_mothernoesy_072403.1007 folded -
assi (attr store1 < 1.54 and attr store1 > 1.34 )
     ((attr store1 < 0.951 and attr store1 > 0.851 ) and 
      (bondedto (attr store1 < 137.942810435  and attr store1 > 136.742810435 ) or 
       bondedto (attr store1 < 42.4630631883  and attr store1 > 41.2630631883 ))) 
6 0.1 0.1 peak 1007 volume 5.1926 ppm1 0.901 ppm2 1.440
 
! ############### hot_mothernoesy_072403.1008 folded -
assi (attr store1 < 1.282 and attr store1 > 1.082 )
     ((attr store1 < 0.95 and attr store1 > 0.85 ) and 
      (bondedto (attr store1 < 137.930810435  and attr store1 > 136.730810435 ) or 
       bondedto (attr store1 < 42.4510631883  and attr store1 > 41.2510631883 ))) 
6 0.1 0.1 peak 1008 volume 6.0835 ppm1 0.900 ppm2 1.182
 
! ############### hot_mothernoesy_072403.1009 folded -
assi (attr store1 < 1.001 and attr store1 > 0.801 )
     ((attr store1 < 0.952 and attr store1 > 0.852 ) and 
      (bondedto (attr store1 < 137.936810435  and attr store1 > 136.736810435 ) or 
       bondedto (attr store1 < 42.4570631883  and attr store1 > 41.2570631883 ))) 
6 0.1 0.1 peak 1009 volume 799.37653 ppm1 0.902 ppm2 0.901
 
! ############### hot_mothernoesy_072403.1010 folded +
assi (attr store1 < 2.773 and attr store1 > 2.573 )
     ((attr store1 < 2.724 and attr store1 > 2.624 ) and 
      (bondedto (attr store1 < 113.915873623  and attr store1 > 112.715873623 ) or 
       bondedto (attr store1 < 66.176  and attr store1 > 64.976 ) or 
       bondedto (attr store1 < 18.4361263766  and attr store1 > 17.2361263766 ))) 
6 0.1 0.1 peak 1010 volume 173.19740 ppm1 2.674 ppm2 2.673
 
! ############### hot_mothernoesy_072403.1011 folded -
assi (attr store1 < 4.763 and attr store1 > 4.563 )
     ((attr store1 < 1.855 and attr store1 > 1.755 ) and 
      (bondedto (attr store1 < 137.791810435  and attr store1 > 136.591810435 ) or 
       bondedto (attr store1 < 42.3120631883  and attr store1 > 41.1120631883 ))) 
6 0.1 0.1 peak 1011 volume 4.6184 ppm1 1.805 ppm2 4.663
 
! ############### hot_mothernoesy_072403.1012 folded -
assi (attr store1 < 1.905 and attr store1 > 1.705 )
     ((attr store1 < 1.854 and attr store1 > 1.754 ) and 
      (bondedto (attr store1 < 137.846810435  and attr store1 > 136.646810435 ) or 
       bondedto (attr store1 < 42.3670631883  and attr store1 > 41.1670631883 ))) 
6 0.1 0.1 peak 1012 volume 52.2266 ppm1 1.804 ppm2 1.805
 
! ############### hot_mothernoesy_072403.1013 folded -
assi (attr store1 < 1.667 and attr store1 > 1.467 )
     ((attr store1 < 1.851 and attr store1 > 1.751 ) and 
      (bondedto (attr store1 < 137.786810435  and attr store1 > 136.586810435 ) or 
       bondedto (attr store1 < 42.3070631883  and attr store1 > 41.1070631883 ))) 
6 0.1 0.1 peak 1013 volume 28.9301 ppm1 1.801 ppm2 1.567
 
! ############### hot_mothernoesy_072403.1014 folded -
assi (attr store1 < 1.901 and attr store1 > 1.701 )
     ((attr store1 < 1.616 and attr store1 > 1.516 ) and 
      (bondedto (attr store1 < 137.799810435  and attr store1 > 136.599810435 ) or 
       bondedto (attr store1 < 42.3200631883  and attr store1 > 41.1200631883 ))) 
6 0.1 0.1 peak 1014 volume 27.0273 ppm1 1.566 ppm2 1.801
 
! ############### hot_mothernoesy_072403.1015 folded -
assi (attr store1 < 1.667 and attr store1 > 1.467 )
     ((attr store1 < 1.618 and attr store1 > 1.518 ) and 
      (bondedto (attr store1 < 137.815810435  and attr store1 > 136.615810435 ) or 
       bondedto (attr store1 < 42.3360631883  and attr store1 > 41.1360631883 ))) 
6 0.1 0.1 peak 1015 volume 42.3475 ppm1 1.568 ppm2 1.567
 
! ############### hot_mothernoesy_072403.1016 folded -
assi (attr store1 < 1.09 and attr store1 > 0.89 )
     ((attr store1 < 1.616 and attr store1 > 1.516 ) and 
      (bondedto (attr store1 < 137.801810435  and attr store1 > 136.601810435 ) or 
       bondedto (attr store1 < 42.3220631883  and attr store1 > 41.1220631883 ))) 
6 0.1 0.1 peak 1016 volume 11.3543 ppm1 1.566 ppm2 0.990
 
! ############### hot_mothernoesy_072403.1017 folded -
assi (attr store1 < 1.012 and attr store1 > 0.812 )
     ((attr store1 < 1.617 and attr store1 > 1.517 ) and 
      (bondedto (attr store1 < 137.770810435  and attr store1 > 136.570810435 ) or 
       bondedto (attr store1 < 42.2910631883  and attr store1 > 41.0910631883 ))) 
6 0.1 0.1 peak 1017 volume 8.0992 ppm1 1.567 ppm2 0.912
 
! ############### hot_mothernoesy_072403.1018 folded -
assi (attr store1 < 4.758 and attr store1 > 4.558 )
     ((attr store1 < 1.614 and attr store1 > 1.514 ) and 
      (bondedto (attr store1 < 137.754810435  and attr store1 > 136.554810435 ) or 
       bondedto (attr store1 < 42.2750631883  and attr store1 > 41.0750631883 ))) 
6 0.1 0.1 peak 1018 volume 5.3783 ppm1 1.564 ppm2 4.658
 
! ############### hot_mothernoesy_072403.1019 folded -
assi (attr store1 < 3.709 and attr store1 > 3.509 )
     ((attr store1 < 1.612 and attr store1 > 1.512 ) and 
      (bondedto (attr store1 < 137.729810435  and attr store1 > 136.529810435 ) or 
       bondedto (attr store1 < 42.2500631883  and attr store1 > 41.0500631883 ))) 
6 0.1 0.1 peak 1019 volume 3.9218 ppm1 1.562 ppm2 3.609
 
! ############### hot_mothernoesy_072403.1020 folded +
assi (attr store1 < 2.018 and attr store1 > 1.818 )
     ((attr store1 < 1.729 and attr store1 > 1.629 ) and 
      (bondedto (attr store1 < 113.726873623  and attr store1 > 112.526873623 ) or 
       bondedto (attr store1 < 65.987  and attr store1 > 64.787 ) or 
       bondedto (attr store1 < 18.2471263766  and attr store1 > 17.0471263766 ))) 
6 0.1 0.1 peak 1020 volume 5.06810 ppm1 1.679 ppm2 1.918
 
! ############### hot_mothernoesy_072403.1021 folded +
assi (attr store1 < 1.779 and attr store1 > 1.579 )
     ((attr store1 < 1.729 and attr store1 > 1.629 ) and 
      (bondedto (attr store1 < 113.734873623  and attr store1 > 112.534873623 ) or 
       bondedto (attr store1 < 65.995  and attr store1 > 64.795 ) or 
       bondedto (attr store1 < 18.2551263766  and attr store1 > 17.0551263766 ))) 
6 0.1 0.1 peak 1021 volume 193.59599 ppm1 1.679 ppm2 1.679
 
! ############### hot_mothernoesy_072403.1022 folded +
assi (attr store1 < 1.65 and attr store1 > 1.45 )
     ((attr store1 < 1.729 and attr store1 > 1.629 ) and 
      (bondedto (attr store1 < 113.711873623  and attr store1 > 112.511873623 ) or 
       bondedto (attr store1 < 65.972  and attr store1 > 64.772 ) or 
       bondedto (attr store1 < 18.2321263766  and attr store1 > 17.0321263766 ))) 
6 0.1 0.1 peak 1022 volume 10.11250 ppm1 1.679 ppm2 1.550
 
! ############### hot_mothernoesy_072403.1025 folded +
assi (attr store1 < 1.546 and attr store1 > 1.346 )
     ((attr store1 < 1.724 and attr store1 > 1.624 ) and 
      (bondedto (attr store1 < 113.727873623  and attr store1 > 112.527873623 ) or 
       bondedto (attr store1 < 65.988  and attr store1 > 64.788 ) or 
       bondedto (attr store1 < 18.2481263766  and attr store1 > 17.0481263766 ))) 
6 0.1 0.1 peak 1025 volume 6.18810 ppm1 1.674 ppm2 1.446
 
! ############### hot_mothernoesy_072403.1026 folded +
assi (attr store1 < 1.502 and attr store1 > 1.302 )
     ((attr store1 < 1.723 and attr store1 > 1.623 ) and 
      (bondedto (attr store1 < 113.734873623  and attr store1 > 112.534873623 ) or 
       bondedto (attr store1 < 65.995  and attr store1 > 64.795 ) or 
       bondedto (attr store1 < 18.2551263766  and attr store1 > 17.0551263766 ))) 
6 0.1 0.1 peak 1026 volume 6.25590 ppm1 1.673 ppm2 1.402
 
! ############### hot_mothernoesy_072403.1029 folded -
assi (attr store1 < 5.005 and attr store1 > 4.805 )
     ((attr store1 < 2.852 and attr store1 > 2.752 ) and 
      (bondedto (attr store1 < 137.584810435  and attr store1 > 136.384810435 ) or 
       bondedto (attr store1 < 42.1050631883  and attr store1 > 40.9050631883 ))) 
6 0.1 0.1 peak 1029 volume 9.9407 ppm1 2.802 ppm2 4.905
 
! ############### hot_mothernoesy_072403.1030 folded -
assi (attr store1 < 3.931 and attr store1 > 3.731 )
     ((attr store1 < 2.856 and attr store1 > 2.756 ) and 
      (bondedto (attr store1 < 137.598810435  and attr store1 > 136.398810435 ) or 
       bondedto (attr store1 < 42.1190631883  and attr store1 > 40.9190631883 ))) 
6 0.1 0.1 peak 1030 volume 4.0822 ppm1 2.806 ppm2 3.831
 
! ############### hot_mothernoesy_072403.1031 folded -
assi (attr store1 < 2.905 and attr store1 > 2.705 )
     ((attr store1 < 2.855 and attr store1 > 2.755 ) and 
      (bondedto (attr store1 < 137.578810435  and attr store1 > 136.378810435 ) or 
       bondedto (attr store1 < 42.0990631883  and attr store1 > 40.8990631883 ))) 
6 0.1 0.1 peak 1031 volume 194.0777 ppm1 2.805 ppm2 2.805
 
! ############### hot_mothernoesy_072403.1032 folded -
assi (attr store1 < 2.69 and attr store1 > 2.49 )
     ((attr store1 < 2.855 and attr store1 > 2.755 ) and 
      (bondedto (attr store1 < 137.588810435  and attr store1 > 136.388810435 ) or 
       bondedto (attr store1 < 42.1090631883  and attr store1 > 40.9090631883 ))) 
6 0.1 0.1 peak 1032 volume 125.9691 ppm1 2.805 ppm2 2.590
 
! ############### hot_mothernoesy_072403.1033 folded -
assi (attr store1 < 5.006 and attr store1 > 4.806 )
     ((attr store1 < 2.641 and attr store1 > 2.541 ) and 
      (bondedto (attr store1 < 137.580810435  and attr store1 > 136.380810435 ) or 
       bondedto (attr store1 < 42.1010631883  and attr store1 > 40.9010631883 ))) 
6 0.1 0.1 peak 1033 volume 11.7841 ppm1 2.591 ppm2 4.906
 
! ############### hot_mothernoesy_072403.1034 folded -
assi (attr store1 < 2.904 and attr store1 > 2.704 )
     ((attr store1 < 2.642 and attr store1 > 2.542 ) and 
      (bondedto (attr store1 < 137.589810435  and attr store1 > 136.389810435 ) or 
       bondedto (attr store1 < 42.1100631883  and attr store1 > 40.9100631883 ))) 
6 0.1 0.1 peak 1034 volume 122.4234 ppm1 2.592 ppm2 2.804
 
! ############### hot_mothernoesy_072403.1036 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 2.391 and attr store1 > 2.291 ) and 
      (bondedto (attr store1 < 137.643810435  and attr store1 > 136.443810435 ) or 
       bondedto (attr store1 < 42.1640631883  and attr store1 > 40.9640631883 ))) 
6 0.1 0.1 peak 1036 volume 33.1312 ppm1 2.341 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1037 folded -
assi (attr store1 < 2.441 and attr store1 > 2.241 )
     ((attr store1 < 2.392 and attr store1 > 2.292 ) and 
      (bondedto (attr store1 < 137.648810435  and attr store1 > 136.448810435 ) or 
       bondedto (attr store1 < 42.1690631883  and attr store1 > 40.9690631883 ))) 
6 0.1 0.1 peak 1037 volume 221.84821 ppm1 2.342 ppm2 2.341
 
! ############### hot_mothernoesy_072403.1041 folded -
assi (attr store1 < 1.007 and attr store1 > 0.807 )
     ((attr store1 < 1.864 and attr store1 > 1.764 ) and 
      (bondedto (attr store1 < 137.651810435  and attr store1 > 136.451810435 ) or 
       bondedto (attr store1 < 42.1720631883  and attr store1 > 40.9720631883 ))) 
6 0.1 0.1 peak 1041 volume 12.5457 ppm1 1.814 ppm2 0.907
 
! ############### hot_mothernoesy_072403.1042 folded +
assi (attr store1 < 2.156 and attr store1 > 1.956 )
     ((attr store1 < 1.729 and attr store1 > 1.629 ) and 
      (bondedto (attr store1 < 113.680873623  and attr store1 > 112.480873623 ) or 
       bondedto (attr store1 < 65.941  and attr store1 > 64.741 ) or 
       bondedto (attr store1 < 18.2011263766  and attr store1 > 17.0011263766 ))) 
6 0.1 0.1 peak 1042 volume 4.83600 ppm1 1.679 ppm2 2.056
 
! ############### hot_mothernoesy_072403.1043 folded -
assi (attr store1 < 2.848 and attr store1 > 2.648 )
     ((attr store1 < 2.797 and attr store1 > 2.697 ) and 
      (bondedto (attr store1 < 137.552810435  and attr store1 > 136.352810435 ) or 
       bondedto (attr store1 < 42.0730631883  and attr store1 > 40.8730631883 ))) 
6 0.1 0.1 peak 1043 volume 831.91461 ppm1 2.747 ppm2 2.748
 
! ############### hot_mothernoesy_072403.1044 folded -
assi (attr store1 < 3.726 and attr store1 > 3.526 )
     ((attr store1 < 1.082 and attr store1 > 0.982 ) and 
      (bondedto (attr store1 < 137.530810435  and attr store1 > 136.330810435 ) or 
       bondedto (attr store1 < 42.0510631883  and attr store1 > 40.8510631883 ))) 
6 0.1 0.1 peak 1044 volume 3.3063 ppm1 1.032 ppm2 3.626
 
! ############### hot_mothernoesy_072403.1045 folded -
assi (attr store1 < 1.658 and attr store1 > 1.458 )
     ((attr store1 < 1.08 and attr store1 > 0.98 ) and 
      (bondedto (attr store1 < 137.539810435  and attr store1 > 136.339810435 ) or 
       bondedto (attr store1 < 42.0600631883  and attr store1 > 40.8600631883 ))) 
6 0.1 0.1 peak 1045 volume 5.431 ppm1 1.030 ppm2 1.558
 
! ############### hot_mothernoesy_072403.1046 folded -
assi (attr store1 < 1.117 and attr store1 > 0.917 )
     ((attr store1 < 1.072 and attr store1 > 0.972 ) and 
      (bondedto (attr store1 < 137.542810435  and attr store1 > 136.342810435 ) or 
       bondedto (attr store1 < 42.0630631883  and attr store1 > 40.8630631883 ))) 
6 0.1 0.1 peak 1046 volume 55.1997 ppm1 1.022 ppm2 1.017
 
! ############### hot_mothernoesy_072403.1047 folded +
assi (attr store1 < 4.36 and attr store1 > 4.16 )
     ((attr store1 < 0.95 and attr store1 > 0.85 ) and 
      (bondedto (attr store1 < 113.550873623  and attr store1 > 112.350873623 ) or 
       bondedto (attr store1 < 65.811  and attr store1 > 64.611 ) or 
       bondedto (attr store1 < 18.0711263766  and attr store1 > 16.8711263766 ))) 
6 0.1 0.1 peak 1047 volume 3.91860 ppm1 0.900 ppm2 4.260
 
! ############### hot_mothernoesy_072403.1048 folded +
assi (attr store1 < 4.124 and attr store1 > 3.924 )
     ((attr store1 < 0.951 and attr store1 > 0.851 ) and 
      (bondedto (attr store1 < 113.559873623  and attr store1 > 112.359873623 ) or 
       bondedto (attr store1 < 65.82  and attr store1 > 64.62 ) or 
       bondedto (attr store1 < 18.0801263766  and attr store1 > 16.8801263766 ))) 
6 0.1 0.1 peak 1048 volume 24.17090 ppm1 0.901 ppm2 4.024
 
! ############### hot_mothernoesy_072403.1049 folded +
assi (attr store1 < 1.976 and attr store1 > 1.776 )
     ((attr store1 < 0.949 and attr store1 > 0.849 ) and 
      (bondedto (attr store1 < 113.559873623  and attr store1 > 112.359873623 ) or 
       bondedto (attr store1 < 65.82  and attr store1 > 64.62 ) or 
       bondedto (attr store1 < 18.0801263766  and attr store1 > 16.8801263766 ))) 
6 0.1 0.1 peak 1049 volume 34.55730 ppm1 0.899 ppm2 1.876
 
! ############### hot_mothernoesy_072403.1050 folded +
assi (attr store1 < 1.543 and attr store1 > 1.343 )
     ((attr store1 < 0.95 and attr store1 > 0.85 ) and 
      (bondedto (attr store1 < 113.554873623  and attr store1 > 112.354873623 ) or 
       bondedto (attr store1 < 65.815  and attr store1 > 64.615 ) or 
       bondedto (attr store1 < 18.0751263766  and attr store1 > 16.8751263766 ))) 
6 0.1 0.1 peak 1050 volume 16.96490 ppm1 0.900 ppm2 1.443
 
! ############### hot_mothernoesy_072403.1051 folded +
assi (attr store1 < 1.28 and attr store1 > 1.08 )
     ((attr store1 < 0.951 and attr store1 > 0.851 ) and 
      (bondedto (attr store1 < 113.557873623  and attr store1 > 112.357873623 ) or 
       bondedto (attr store1 < 65.818  and attr store1 > 64.618 ) or 
       bondedto (attr store1 < 18.0781263766  and attr store1 > 16.8781263766 ))) 
6 0.1 0.1 peak 1051 volume 21.57360 ppm1 0.901 ppm2 1.180
 
! ############### hot_mothernoesy_072403.1052 folded +
assi (attr store1 < 1.181 and attr store1 > 0.981 )
     ((attr store1 < 0.952 and attr store1 > 0.852 ) and 
      (bondedto (attr store1 < 113.554873623  and attr store1 > 112.354873623 ) or 
       bondedto (attr store1 < 65.815  and attr store1 > 64.615 ) or 
       bondedto (attr store1 < 18.0751263766  and attr store1 > 16.8751263766 ))) 
6 0.1 0.1 peak 1052 volume 7.47510 ppm1 0.902 ppm2 1.081
 
! ############### hot_mothernoesy_072403.1053 folded +
assi (attr store1 < 0.999 and attr store1 > 0.799 )
     ((attr store1 < 0.951 and attr store1 > 0.851 ) and 
      (bondedto (attr store1 < 113.549873623  and attr store1 > 112.349873623 ) or 
       bondedto (attr store1 < 65.81  and attr store1 > 64.61 ) or 
       bondedto (attr store1 < 18.0701263766  and attr store1 > 16.8701263766 ))) 
6 0.1 0.1 peak 1053 volume 2328.83130 ppm1 0.901 ppm2 0.899
 
! ############### hot_mothernoesy_072403.1054 folded -
assi (attr store1 < 2.739 and attr store1 > 2.539 )
     ((attr store1 < 2.8 and attr store1 > 2.7 ) and 
      (bondedto (attr store1 < 137.316810435  and attr store1 > 136.116810435 ) or 
       bondedto (attr store1 < 41.8370631883  and attr store1 > 40.6370631883 ))) 
6 0.1 0.1 peak 1054 volume 381.07471 ppm1 2.750 ppm2 2.639
 
! ############### hot_mothernoesy_072403.1055 folded -
assi (attr store1 < 4.728 and attr store1 > 4.528 )
     ((attr store1 < 2.796 and attr store1 > 2.696 ) and 
      (bondedto (attr store1 < 137.335810435  and attr store1 > 136.135810435 ) or 
       bondedto (attr store1 < 41.8560631883  and attr store1 > 40.6560631883 ))) 
6 0.1 0.1 peak 1055 volume 7.8221 ppm1 2.746 ppm2 4.628
 
! ############### hot_mothernoesy_072403.1056 folded -
assi (attr store1 < 0.977 and attr store1 > 0.777 )
     ((attr store1 < 2.699 and attr store1 > 2.599 ) and 
      (bondedto (attr store1 < 137.312810435  and attr store1 > 136.112810435 ) or 
       bondedto (attr store1 < 41.8330631883  and attr store1 > 40.6330631883 ))) 
6 0.1 0.1 peak 1056 volume 3.2088 ppm1 2.649 ppm2 0.877
 
! ############### hot_mothernoesy_072403.1057 folded -
assi (attr store1 < 4.728 and attr store1 > 4.528 )
     ((attr store1 < 2.688 and attr store1 > 2.588 ) and 
      (bondedto (attr store1 < 137.327810435  and attr store1 > 136.127810435 ) or 
       bondedto (attr store1 < 41.8480631883  and attr store1 > 40.6480631883 ))) 
6 0.1 0.1 peak 1057 volume 14.7995 ppm1 2.638 ppm2 4.628
 
! ############### hot_mothernoesy_072403.1058 folded -
assi (attr store1 < 2.848 and attr store1 > 2.648 )
     ((attr store1 < 2.688 and attr store1 > 2.588 ) and 
      (bondedto (attr store1 < 137.308810435  and attr store1 > 136.108810435 ) or 
       bondedto (attr store1 < 41.8290631883  and attr store1 > 40.6290631883 ))) 
6 0.1 0.1 peak 1058 volume 387.98999 ppm1 2.638 ppm2 2.748
 
! ############### hot_mothernoesy_072403.1059 folded -
assi (attr store1 < 2.775 and attr store1 > 2.575 )
     ((attr store1 < 2.725 and attr store1 > 2.625 ) and 
      (bondedto (attr store1 < 137.211810435  and attr store1 > 136.011810435 ) or 
       bondedto (attr store1 < 41.7320631883  and attr store1 > 40.5320631883 ))) 
6 0.1 0.1 peak 1059 volume 1468.24048 ppm1 2.675 ppm2 2.675
 
! ############### hot_mothernoesy_072403.1060 folded -
assi (attr store1 < 2.614 and attr store1 > 2.414 )
     ((attr store1 < 2.697 and attr store1 > 2.597 ) and 
      (bondedto (attr store1 < 137.214810435  and attr store1 > 136.014810435 ) or 
       bondedto (attr store1 < 41.7350631883  and attr store1 > 40.5350631883 ))) 
6 0.1 0.1 peak 1060 volume 157.19901 ppm1 2.647 ppm2 2.514
 
! ############### hot_mothernoesy_072403.1061 folded -
assi (attr store1 < 4.637 and attr store1 > 4.437 )
     ((attr store1 < 2.565 and attr store1 > 2.465 ) and 
      (bondedto (attr store1 < 137.220810435  and attr store1 > 136.020810435 ) or 
       bondedto (attr store1 < 41.7410631883  and attr store1 > 40.5410631883 ))) 
6 0.1 0.1 peak 1061 volume 12.4958 ppm1 2.515 ppm2 4.537
 
! ############### hot_mothernoesy_072403.1062 folded -
assi (attr store1 < 2.746 and attr store1 > 2.546 )
     ((attr store1 < 2.564 and attr store1 > 2.464 ) and 
      (bondedto (attr store1 < 137.205810435  and attr store1 > 136.005810435 ) or 
       bondedto (attr store1 < 41.7260631883  and attr store1 > 40.5260631883 ))) 
6 0.1 0.1 peak 1062 volume 155.8226 ppm1 2.514 ppm2 2.646
 
! ############### hot_mothernoesy_072403.1063 folded -
assi (attr store1 < 2.614 and attr store1 > 2.414 )
     ((attr store1 < 2.567 and attr store1 > 2.467 ) and 
      (bondedto (attr store1 < 137.217810435  and attr store1 > 136.017810435 ) or 
       bondedto (attr store1 < 41.7380631883  and attr store1 > 40.5380631883 ))) 
6 0.1 0.1 peak 1063 volume 170.3826 ppm1 2.517 ppm2 2.514
 
! ############### hot_mothernoesy_072403.1064 folded -
assi (attr store1 < 4.677 and attr store1 > 4.477 )
     ((attr store1 < 2.727 and attr store1 > 2.627 ) and 
      (bondedto (attr store1 < 137.203810435  and attr store1 > 136.003810435 ) or 
       bondedto (attr store1 < 41.7240631883  and attr store1 > 40.5240631883 ))) 
6 0.1 0.1 peak 1064 volume 23.2348 ppm1 2.677 ppm2 4.577
 
! ############### hot_mothernoesy_072403.1065 folded +
assi (attr store1 < 2.306 and attr store1 > 2.106 )
     ((attr store1 < 4.247 and attr store1 > 4.147 ) and 
      (bondedto (attr store1 < 113.198873623  and attr store1 > 111.998873623 ) or 
       bondedto (attr store1 < 65.459  and attr store1 > 64.259 ) or 
       bondedto (attr store1 < 17.7191263766  and attr store1 > 16.5191263766 ))) 
6 0.1 0.1 peak 1065 volume 11.00690 ppm1 4.197 ppm2 2.206
 
! ############### hot_mothernoesy_072403.1066 folded +
assi (attr store1 < 2.192 and attr store1 > 1.992 )
     ((attr store1 < 4.244 and attr store1 > 4.144 ) and 
      (bondedto (attr store1 < 113.234873623  and attr store1 > 112.034873623 ) or 
       bondedto (attr store1 < 65.495  and attr store1 > 64.295 ) or 
       bondedto (attr store1 < 17.7551263766  and attr store1 > 16.5551263766 ))) 
6 0.1 0.1 peak 1066 volume 5.21670 ppm1 4.194 ppm2 2.092
 
! ############### hot_mothernoesy_072403.1067 folded +
assi (attr store1 < 1.99 and attr store1 > 1.79 )
     ((attr store1 < 4.248 and attr store1 > 4.148 ) and 
      (bondedto (attr store1 < 113.195873623  and attr store1 > 111.995873623 ) or 
       bondedto (attr store1 < 65.456  and attr store1 > 64.256 ) or 
       bondedto (attr store1 < 17.7161263766  and attr store1 > 16.5161263766 ))) 
6 0.1 0.1 peak 1067 volume 7.86800 ppm1 4.198 ppm2 1.890
 
! ############### hot_mothernoesy_072403.1068 folded +
assi (attr store1 < 1.126 and attr store1 > 0.926 )
     ((attr store1 < 4.245 and attr store1 > 4.145 ) and 
      (bondedto (attr store1 < 113.194873623  and attr store1 > 111.994873623 ) or 
       bondedto (attr store1 < 65.455  and attr store1 > 64.255 ) or 
       bondedto (attr store1 < 17.7151263766  and attr store1 > 16.5151263766 ))) 
6 0.1 0.1 peak 1068 volume 5.17810 ppm1 4.195 ppm2 1.026
 
! ############### hot_mothernoesy_072403.1069 folded +
assi (attr store1 < 4.294 and attr store1 > 4.094 )
     ((attr store1 < 4.241 and attr store1 > 4.141 ) and 
      (bondedto (attr store1 < 113.195873623  and attr store1 > 111.995873623 ) or 
       bondedto (attr store1 < 65.456  and attr store1 > 64.256 ) or 
       bondedto (attr store1 < 17.7161263766  and attr store1 > 16.5161263766 ))) 
6 0.1 0.1 peak 1069 volume 33.07370 ppm1 4.191 ppm2 4.194
 
! ############### hot_mothernoesy_072403.1070 folded +
assi (attr store1 < 2.179 and attr store1 > 1.979 )
     ((attr store1 < 1.087 and attr store1 > 0.987 ) and 
      (bondedto (attr store1 < 113.150873623  and attr store1 > 111.950873623 ) or 
       bondedto (attr store1 < 65.411  and attr store1 > 64.211 ) or 
       bondedto (attr store1 < 17.6711263766  and attr store1 > 16.4711263766 ))) 
6 0.1 0.1 peak 1070 volume 4.33920 ppm1 1.037 ppm2 2.079
 
! ############### hot_mothernoesy_072403.1071 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 1.078 and attr store1 > 0.978 ) and 
      (bondedto (attr store1 < 113.120873623  and attr store1 > 111.920873623 ) or 
       bondedto (attr store1 < 65.381  and attr store1 > 64.181 ) or 
       bondedto (attr store1 < 17.6411263766  and attr store1 > 16.4411263766 ))) 
6 0.1 0.1 peak 1071 volume 6.87020 ppm1 1.028 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1075 folded +
assi (attr store1 < 2.982 and attr store1 > 2.782 )
     ((attr store1 < 1.08 and attr store1 > 0.98 ) and 
      (bondedto (attr store1 < 113.112873623  and attr store1 > 111.912873623 ) or 
       bondedto (attr store1 < 65.373  and attr store1 > 64.173 ) or 
       bondedto (attr store1 < 17.6331263766  and attr store1 > 16.4331263766 ))) 
6 0.1 0.1 peak 1075 volume 5.04680 ppm1 1.030 ppm2 2.882
 
! ############### hot_mothernoesy_072403.1076 folded +
assi (attr store1 < 2.034 and attr store1 > 1.834 )
     ((attr store1 < 1.084 and attr store1 > 0.984 ) and 
      (bondedto (attr store1 < 113.093873623  and attr store1 > 111.893873623 ) or 
       bondedto (attr store1 < 65.354  and attr store1 > 64.154 ) or 
       bondedto (attr store1 < 17.6141263766  and attr store1 > 16.4141263766 ))) 
6 0.1 0.1 peak 1076 volume 10.26870 ppm1 1.034 ppm2 1.934
 
! ############### hot_mothernoesy_072403.1077 folded +
assi (attr store1 < 1.999 and attr store1 > 1.799 )
     ((attr store1 < 1.081 and attr store1 > 0.981 ) and 
      (bondedto (attr store1 < 113.116873623  and attr store1 > 111.916873623 ) or 
       bondedto (attr store1 < 65.377  and attr store1 > 64.177 ) or 
       bondedto (attr store1 < 17.6371263766  and attr store1 > 16.4371263766 ))) 
6 0.1 0.1 peak 1077 volume 9.51170 ppm1 1.031 ppm2 1.899
 
! ############### hot_mothernoesy_072403.1079 folded +
assi (attr store1 < 1.127 and attr store1 > 0.927 )
     ((attr store1 < 1.081 and attr store1 > 0.981 ) and 
      (bondedto (attr store1 < 113.125873623  and attr store1 > 111.925873623 ) or 
       bondedto (attr store1 < 65.386  and attr store1 > 64.186 ) or 
       bondedto (attr store1 < 17.6461263766  and attr store1 > 16.4461263766 ))) 
6 0.1 0.1 peak 1079 volume 251.65320 ppm1 1.031 ppm2 1.027
 
! ############### hot_mothernoesy_072403.1080 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 4.222 and attr store1 > 4.122 ) and 
      (bondedto (attr store1 < 112.605873623  and attr store1 > 111.405873623 ) or 
       bondedto (attr store1 < 64.866  and attr store1 > 63.666 ) or 
       bondedto (attr store1 < 17.1261263766  and attr store1 > 15.9261263766 ))) 
6 0.1 0.1 peak 1080 volume 13.53160 ppm1 4.172 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1081 folded +
assi (attr store1 < 4.553 and attr store1 > 4.353 )
     ((attr store1 < 4.223 and attr store1 > 4.123 ) and 
      (bondedto (attr store1 < 112.617873623  and attr store1 > 111.417873623 ) or 
       bondedto (attr store1 < 64.878  and attr store1 > 63.678 ) or 
       bondedto (attr store1 < 17.1381263766  and attr store1 > 15.9381263766 ))) 
6 0.1 0.1 peak 1081 volume 16.92550 ppm1 4.173 ppm2 4.453
 
! ############### hot_mothernoesy_072403.1082 folded +
assi (attr store1 < 4.271 and attr store1 > 4.071 )
     ((attr store1 < 4.222 and attr store1 > 4.122 ) and 
      (bondedto (attr store1 < 112.614873623  and attr store1 > 111.414873623 ) or 
       bondedto (attr store1 < 64.875  and attr store1 > 63.675 ) or 
       bondedto (attr store1 < 17.1351263766  and attr store1 > 15.9351263766 ))) 
6 0.1 0.1 peak 1082 volume 45.34420 ppm1 4.172 ppm2 4.171
 
! ############### hot_mothernoesy_072403.1083 folded +
assi (attr store1 < 4.096 and attr store1 > 3.896 )
     ((attr store1 < 4.223 and attr store1 > 4.123 ) and 
      (bondedto (attr store1 < 112.612873623  and attr store1 > 111.412873623 ) or 
       bondedto (attr store1 < 64.873  and attr store1 > 63.673 ) or 
       bondedto (attr store1 < 17.1331263766  and attr store1 > 15.9331263766 ))) 
6 0.1 0.1 peak 1083 volume 43.71570 ppm1 4.173 ppm2 3.996
 
! ############### hot_mothernoesy_072403.1084 folded +
assi (attr store1 < 4.097 and attr store1 > 3.897 )
     ((attr store1 < 4.052 and attr store1 > 3.952 ) and 
      (bondedto (attr store1 < 112.610873623  and attr store1 > 111.410873623 ) or 
       bondedto (attr store1 < 64.871  and attr store1 > 63.671 ) or 
       bondedto (attr store1 < 17.1311263766  and attr store1 > 15.9311263766 ))) 
6 0.1 0.1 peak 1084 volume 51.54240 ppm1 4.002 ppm2 3.997
 
! ############### hot_mothernoesy_072403.1085 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 4.045 and attr store1 > 3.945 ) and 
      (bondedto (attr store1 < 112.613873623  and attr store1 > 111.413873623 ) or 
       bondedto (attr store1 < 64.874  and attr store1 > 63.674 ) or 
       bondedto (attr store1 < 17.1341263766  and attr store1 > 15.9341263766 ))) 
6 0.1 0.1 peak 1085 volume 14.90880 ppm1 3.995 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1086 folded +
assi (attr store1 < 4.553 and attr store1 > 4.353 )
     ((attr store1 < 4.047 and attr store1 > 3.947 ) and 
      (bondedto (attr store1 < 112.611873623  and attr store1 > 111.411873623 ) or 
       bondedto (attr store1 < 64.872  and attr store1 > 63.672 ) or 
       bondedto (attr store1 < 17.1321263766  and attr store1 > 15.9321263766 ))) 
6 0.1 0.1 peak 1086 volume 15.78410 ppm1 3.997 ppm2 4.453
 
! ############### hot_mothernoesy_072403.1087 folded +
assi (attr store1 < 4.272 and attr store1 > 4.072 )
     ((attr store1 < 4.046 and attr store1 > 3.946 ) and 
      (bondedto (attr store1 < 112.615873623  and attr store1 > 111.415873623 ) or 
       bondedto (attr store1 < 64.876  and attr store1 > 63.676 ) or 
       bondedto (attr store1 < 17.1361263766  and attr store1 > 15.9361263766 ))) 
6 0.1 0.1 peak 1087 volume 41.35520 ppm1 3.996 ppm2 4.172
 
! ############### hot_mothernoesy_072403.1088 folded -
assi (attr store1 < 2.845 and attr store1 > 2.645 )
     ((attr store1 < 2.793 and attr store1 > 2.693 ) and 
      (bondedto (attr store1 < 136.476810435  and attr store1 > 135.276810435 ) or 
       bondedto (attr store1 < 40.9970631883  and attr store1 > 39.7970631883 ))) 
6 0.1 0.1 peak 1088 volume 52.9068 ppm1 2.743 ppm2 2.745
 
! ############### hot_mothernoesy_072403.1089 folded +
assi (attr store1 < 3.985 and attr store1 > 3.785 )
     ((attr store1 < 4.217 and attr store1 > 4.117 ) and 
      (bondedto (attr store1 < 112.555873623  and attr store1 > 111.355873623 ) or 
       bondedto (attr store1 < 64.816  and attr store1 > 63.616 ) or 
       bondedto (attr store1 < 17.0761263766  and attr store1 > 15.8761263766 ))) 
6 0.1 0.1 peak 1089 volume 4.35350 ppm1 4.167 ppm2 3.885
 
! ############### hot_mothernoesy_072403.1090 folded +
assi (attr store1 < 2.221 and attr store1 > 2.021 )
     ((attr store1 < 4.221 and attr store1 > 4.121 ) and 
      (bondedto (attr store1 < 112.556873623  and attr store1 > 111.356873623 ) or 
       bondedto (attr store1 < 64.817  and attr store1 > 63.617 ) or 
       bondedto (attr store1 < 17.0771263766  and attr store1 > 15.8771263766 ))) 
6 0.1 0.1 peak 1090 volume 3.38920 ppm1 4.171 ppm2 2.121
 
! ############### hot_mothernoesy_072403.1091 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 3.922 and attr store1 > 3.822 ) and 
      (bondedto (attr store1 < 112.535873623  and attr store1 > 111.335873623 ) or 
       bondedto (attr store1 < 64.796  and attr store1 > 63.596 ) or 
       bondedto (attr store1 < 17.0561263766  and attr store1 > 15.8561263766 ))) 
6 0.1 0.1 peak 1091 volume 15.27200 ppm1 3.872 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1092 folded +
assi (attr store1 < 4.607 and attr store1 > 4.407 )
     ((attr store1 < 3.923 and attr store1 > 3.823 ) and 
      (bondedto (attr store1 < 112.538873623  and attr store1 > 111.338873623 ) or 
       bondedto (attr store1 < 64.799  and attr store1 > 63.599 ) or 
       bondedto (attr store1 < 17.0591263766  and attr store1 > 15.8591263766 ))) 
6 0.1 0.1 peak 1092 volume 38.78110 ppm1 3.873 ppm2 4.507
 
! ############### hot_mothernoesy_072403.1093 folded +
assi (attr store1 < 4.263 and attr store1 > 4.063 )
     ((attr store1 < 3.924 and attr store1 > 3.824 ) and 
      (bondedto (attr store1 < 112.553873623  and attr store1 > 111.353873623 ) or 
       bondedto (attr store1 < 64.814  and attr store1 > 63.614 ) or 
       bondedto (attr store1 < 17.0741263766  and attr store1 > 15.8741263766 ))) 
6 0.1 0.1 peak 1093 volume 3.91550 ppm1 3.874 ppm2 4.163
 
! ############### hot_mothernoesy_072403.1094 folded +
assi (attr store1 < 3.973 and attr store1 > 3.773 )
     ((attr store1 < 3.923 and attr store1 > 3.823 ) and 
      (bondedto (attr store1 < 112.537873623  and attr store1 > 111.337873623 ) or 
       bondedto (attr store1 < 64.798  and attr store1 > 63.598 ) or 
       bondedto (attr store1 < 17.0581263766  and attr store1 > 15.8581263766 ))) 
6 0.1 0.1 peak 1094 volume 1031.90845 ppm1 3.873 ppm2 3.873
 
! ############### hot_mothernoesy_072403.1095 folded +
assi (attr store1 < 3.727 and attr store1 > 3.527 )
     ((attr store1 < 3.921 and attr store1 > 3.821 ) and 
      (bondedto (attr store1 < 112.521873623  and attr store1 > 111.321873623 ) or 
       bondedto (attr store1 < 64.782  and attr store1 > 63.582 ) or 
       bondedto (attr store1 < 17.0421263766  and attr store1 > 15.8421263766 ))) 
6 0.1 0.1 peak 1095 volume 4.11760 ppm1 3.871 ppm2 3.627
 
! ############### hot_mothernoesy_072403.1096 folded -
assi (attr store1 < 4.183 and attr store1 > 3.983 )
     ((attr store1 < 4.125 and attr store1 > 4.025 ) and 
      (bondedto (attr store1 < 136.370810435  and attr store1 > 135.170810435 ) or 
       bondedto (attr store1 < 40.8910631883  and attr store1 > 39.6910631883 ))) 
6 0.1 0.1 peak 1096 volume 8.5653 ppm1 4.075 ppm2 4.083
 
! ############### hot_mothernoesy_072403.1097 folded -
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 2.886 and attr store1 > 2.786 ) and 
      (bondedto (attr store1 < 136.382810435  and attr store1 > 135.182810435 ) or 
       bondedto (attr store1 < 40.9030631883  and attr store1 > 39.7030631883 ))) 
6 0.1 0.1 peak 1097 volume 5.8241 ppm1 2.836 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1099 folded -
assi (attr store1 < 1.03 and attr store1 > 0.83 )
     ((attr store1 < 2.87 and attr store1 > 2.77 ) and 
      (bondedto (attr store1 < 136.391810435  and attr store1 > 135.191810435 ) or 
       bondedto (attr store1 < 40.9120631883  and attr store1 > 39.7120631883 ))) 
6 0.1 0.1 peak 1099 volume 3.9415 ppm1 2.820 ppm2 0.930
 
! ############### hot_mothernoesy_072403.1100 folded -
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 2.778 and attr store1 > 2.678 ) and 
      (bondedto (attr store1 < 136.369810435  and attr store1 > 135.169810435 ) or 
       bondedto (attr store1 < 40.8900631883  and attr store1 > 39.6900631883 ))) 
6 0.1 0.1 peak 1100 volume 4.6593 ppm1 2.728 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1102 folded -
assi (attr store1 < 1.031 and attr store1 > 0.831 )
     ((attr store1 < 2.573 and attr store1 > 2.473 ) and 
      (bondedto (attr store1 < 136.388810435  and attr store1 > 135.188810435 ) or 
       bondedto (attr store1 < 40.9090631883  and attr store1 > 39.7090631883 ))) 
6 0.1 0.1 peak 1102 volume 4.004 ppm1 2.523 ppm2 0.931
 
! ############### hot_mothernoesy_072403.1103 folded -
assi (attr store1 < 2.229 and attr store1 > 2.029 )
     ((attr store1 < 3.012 and attr store1 > 2.912 ) and 
      (bondedto (attr store1 < 136.299810435  and attr store1 > 135.099810435 ) or 
       bondedto (attr store1 < 40.8200631883  and attr store1 > 39.6200631883 ))) 
6 0.1 0.1 peak 1103 volume 4.2734 ppm1 2.962 ppm2 2.129
 
! ############### hot_mothernoesy_072403.1104 folded -
assi (attr store1 < 2.849 and attr store1 > 2.649 )
     ((attr store1 < 2.895 and attr store1 > 2.795 ) and 
      (bondedto (attr store1 < 136.313810435  and attr store1 > 135.113810435 ) or 
       bondedto (attr store1 < 40.8340631883  and attr store1 > 39.6340631883 ))) 
6 0.1 0.1 peak 1104 volume 20.0178 ppm1 2.845 ppm2 2.749
 
! ############### hot_mothernoesy_072403.1105 folded -
assi (attr store1 < 4.648 and attr store1 > 4.448 )
     ((attr store1 < 2.877 and attr store1 > 2.777 ) and 
      (bondedto (attr store1 < 136.361810435  and attr store1 > 135.161810435 ) or 
       bondedto (attr store1 < 40.8820631883  and attr store1 > 39.6820631883 ))) 
6 0.1 0.1 peak 1105 volume 4.2729 ppm1 2.827 ppm2 4.548
 
! ############### hot_mothernoesy_072403.1106 folded -
assi (attr store1 < 2.936 and attr store1 > 2.736 )
     ((attr store1 < 2.878 and attr store1 > 2.778 ) and 
      (bondedto (attr store1 < 136.347810435  and attr store1 > 135.147810435 ) or 
       bondedto (attr store1 < 40.8680631883  and attr store1 > 39.6680631883 ))) 
6 0.1 0.1 peak 1106 volume 24.8243 ppm1 2.828 ppm2 2.836
 
! ############### hot_mothernoesy_072403.1107 folded -
assi (attr store1 < 2.942 and attr store1 > 2.742 )
     ((attr store1 < 2.795 and attr store1 > 2.695 ) and 
      (bondedto (attr store1 < 136.305810435  and attr store1 > 135.105810435 ) or 
       bondedto (attr store1 < 40.8260631883  and attr store1 > 39.6260631883 ))) 
6 0.1 0.1 peak 1107 volume 16.3027 ppm1 2.745 ppm2 2.842
 
! ############### hot_mothernoesy_072403.1108 folded -
assi (attr store1 < 2.93 and attr store1 > 2.73 )
     ((attr store1 < 2.645 and attr store1 > 2.545 ) and 
      (bondedto (attr store1 < 136.336810435  and attr store1 > 135.136810435 ) or 
       bondedto (attr store1 < 40.8570631883  and attr store1 > 39.6570631883 ))) 
6 0.1 0.1 peak 1108 volume 14.7279 ppm1 2.595 ppm2 2.830
 
! ############### hot_mothernoesy_072403.1109 folded -
assi (attr store1 < 4.643 and attr store1 > 4.443 )
     ((attr store1 < 2.569 and attr store1 > 2.469 ) and 
      (bondedto (attr store1 < 136.363810435  and attr store1 > 135.163810435 ) or 
       bondedto (attr store1 < 40.8840631883  and attr store1 > 39.6840631883 ))) 
6 0.1 0.1 peak 1109 volume 5.9765 ppm1 2.519 ppm2 4.543
 
! ############### hot_mothernoesy_072403.1110 folded -
assi (attr store1 < 4.332 and attr store1 > 4.132 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 136.305810435  and attr store1 > 135.105810435 ) or 
       bondedto (attr store1 < 40.8260631883  and attr store1 > 39.6260631883 ))) 
6 0.1 0.1 peak 1110 volume 5.6055 ppm1 2.126 ppm2 4.232
 
! ############### hot_mothernoesy_072403.1111 folded -
assi (attr store1 < 4.154 and attr store1 > 3.954 )
     ((attr store1 < 2.177 and attr store1 > 2.077 ) and 
      (bondedto (attr store1 < 136.314810435  and attr store1 > 135.114810435 ) or 
       bondedto (attr store1 < 40.8350631883  and attr store1 > 39.6350631883 ))) 
6 0.1 0.1 peak 1111 volume 3.4281 ppm1 2.127 ppm2 4.054
 
! ############### hot_mothernoesy_072403.1112 folded -
assi (attr store1 < 3.052 and attr store1 > 2.852 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 136.300810435  and attr store1 > 135.100810435 ) or 
       bondedto (attr store1 < 40.8210631883  and attr store1 > 39.6210631883 ))) 
6 0.1 0.1 peak 1112 volume 11.5234 ppm1 2.126 ppm2 2.952
 
! ############### hot_mothernoesy_072403.1113 folded -
assi (attr store1 < 2.499 and attr store1 > 2.299 )
     ((attr store1 < 2.177 and attr store1 > 2.077 ) and 
      (bondedto (attr store1 < 136.301810435  and attr store1 > 135.101810435 ) or 
       bondedto (attr store1 < 40.8220631883  and attr store1 > 39.6220631883 ))) 
6 0.1 0.1 peak 1113 volume 7.6398 ppm1 2.127 ppm2 2.399
 
! ############### hot_mothernoesy_072403.1114 folded -
assi (attr store1 < 2.226 and attr store1 > 2.026 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 136.300810435  and attr store1 > 135.100810435 ) or 
       bondedto (attr store1 < 40.8210631883  and attr store1 > 39.6210631883 ))) 
6 0.1 0.1 peak 1114 volume 875.61493 ppm1 2.126 ppm2 2.126
 
! ############### hot_mothernoesy_072403.1115 folded -
assi (attr store1 < 1.973 and attr store1 > 1.773 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 136.310810435  and attr store1 > 135.110810435 ) or 
       bondedto (attr store1 < 40.8310631883  and attr store1 > 39.6310631883 ))) 
6 0.1 0.1 peak 1115 volume 5.263 ppm1 2.126 ppm2 1.873
 
! ############### hot_mothernoesy_072403.1116 folded -
assi (attr store1 < 1.577 and attr store1 > 1.377 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 136.298810435  and attr store1 > 135.098810435 ) or 
       bondedto (attr store1 < 40.8190631883  and attr store1 > 39.6190631883 ))) 
6 0.1 0.1 peak 1116 volume 10.0493 ppm1 2.126 ppm2 1.477
 
! ############### hot_mothernoesy_072403.1117 folded -
assi (attr store1 < 0.997 and attr store1 > 0.797 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 136.303810435  and attr store1 > 135.103810435 ) or 
       bondedto (attr store1 < 40.8240631883  and attr store1 > 39.6240631883 ))) 
6 0.1 0.1 peak 1117 volume 11.0287 ppm1 2.126 ppm2 0.897
 
! ############### hot_mothernoesy_072403.1118 folded +
assi (attr store1 < 4.505 and attr store1 > 4.305 )
     ((attr store1 < 4.456 and attr store1 > 4.356 ) and 
      (bondedto (attr store1 < 112.092873623  and attr store1 > 110.892873623 ) or 
       bondedto (attr store1 < 64.353  and attr store1 > 63.153 ) or 
       bondedto (attr store1 < 16.6131263766  and attr store1 > 15.4131263766 ))) 
6 0.1 0.1 peak 1118 volume 647.57507 ppm1 4.406 ppm2 4.405
 
! ############### hot_mothernoesy_072403.1119 folded +
assi (attr store1 < 4.031 and attr store1 > 3.831 )
     ((attr store1 < 4.455 and attr store1 > 4.355 ) and 
      (bondedto (attr store1 < 112.097873623  and attr store1 > 110.897873623 ) or 
       bondedto (attr store1 < 64.358  and attr store1 > 63.158 ) or 
       bondedto (attr store1 < 16.6181263766  and attr store1 > 15.4181263766 ))) 
6 0.1 0.1 peak 1119 volume 4.89290 ppm1 4.405 ppm2 3.931
 
! ############### hot_mothernoesy_072403.1120 folded +
assi (attr store1 < 3.932 and attr store1 > 3.732 )
     ((attr store1 < 4.455 and attr store1 > 4.355 ) and 
      (bondedto (attr store1 < 112.107873623  and attr store1 > 110.907873623 ) or 
       bondedto (attr store1 < 64.368  and attr store1 > 63.168 ) or 
       bondedto (attr store1 < 16.6281263766  and attr store1 > 15.4281263766 ))) 
6 0.1 0.1 peak 1120 volume 3.63510 ppm1 4.405 ppm2 3.832
 
! ############### hot_mothernoesy_072403.1121 folded +
assi (attr store1 < 2.404 and attr store1 > 2.204 )
     ((attr store1 < 4.456 and attr store1 > 4.356 ) and 
      (bondedto (attr store1 < 112.106873623  and attr store1 > 110.906873623 ) or 
       bondedto (attr store1 < 64.367  and attr store1 > 63.167 ) or 
       bondedto (attr store1 < 16.6271263766  and attr store1 > 15.4271263766 ))) 
6 0.1 0.1 peak 1121 volume 36.91880 ppm1 4.406 ppm2 2.304
 
! ############### hot_mothernoesy_072403.1122 folded +
assi (attr store1 < 2.139 and attr store1 > 1.939 )
     ((attr store1 < 4.456 and attr store1 > 4.356 ) and 
      (bondedto (attr store1 < 112.097873623  and attr store1 > 110.897873623 ) or 
       bondedto (attr store1 < 64.358  and attr store1 > 63.158 ) or 
       bondedto (attr store1 < 16.6181263766  and attr store1 > 15.4181263766 ))) 
6 0.1 0.1 peak 1122 volume 13.96080 ppm1 4.406 ppm2 2.039
 
! ############### hot_mothernoesy_072403.1123 folded +
assi (attr store1 < 2.011 and attr store1 > 1.811 )
     ((attr store1 < 4.455 and attr store1 > 4.355 ) and 
      (bondedto (attr store1 < 112.094873623  and attr store1 > 110.894873623 ) or 
       bondedto (attr store1 < 64.355  and attr store1 > 63.155 ) or 
       bondedto (attr store1 < 16.6151263766  and attr store1 > 15.4151263766 ))) 
6 0.1 0.1 peak 1123 volume 15.71940 ppm1 4.405 ppm2 1.911
 
! ############### hot_mothernoesy_072403.1124 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 2.174 and attr store1 > 2.074 ) and 
      (bondedto (attr store1 < 112.032873623  and attr store1 > 110.832873623 ) or 
       bondedto (attr store1 < 64.293  and attr store1 > 63.093 ) or 
       bondedto (attr store1 < 16.5531263766  and attr store1 > 15.3531263766 ))) 
6 0.1 0.1 peak 1124 volume 6.83250 ppm1 2.124 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1125 folded +
assi (attr store1 < 4.329 and attr store1 > 4.129 )
     ((attr store1 < 2.177 and attr store1 > 2.077 ) and 
      (bondedto (attr store1 < 112.031873623  and attr store1 > 110.831873623 ) or 
       bondedto (attr store1 < 64.292  and attr store1 > 63.092 ) or 
       bondedto (attr store1 < 16.5521263766  and attr store1 > 15.3521263766 ))) 
6 0.1 0.1 peak 1125 volume 15.53440 ppm1 2.127 ppm2 4.229
 
! ############### hot_mothernoesy_072403.1126 folded +
assi (attr store1 < 2.226 and attr store1 > 2.026 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 112.030873623  and attr store1 > 110.830873623 ) or 
       bondedto (attr store1 < 64.291  and attr store1 > 63.091 ) or 
       bondedto (attr store1 < 16.5511263766  and attr store1 > 15.3511263766 ))) 
6 0.1 0.1 peak 1126 volume 2432.55249 ppm1 2.126 ppm2 2.126
 
! ############### hot_mothernoesy_072403.1127 folded +
assi (attr store1 < 1.575 and attr store1 > 1.375 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 112.030873623  and attr store1 > 110.830873623 ) or 
       bondedto (attr store1 < 64.291  and attr store1 > 63.091 ) or 
       bondedto (attr store1 < 16.5511263766  and attr store1 > 15.3511263766 ))) 
6 0.1 0.1 peak 1127 volume 28.27640 ppm1 2.126 ppm2 1.475
 
! ############### hot_mothernoesy_072403.1128 folded +
assi (attr store1 < 1.433 and attr store1 > 1.233 )
     ((attr store1 < 2.174 and attr store1 > 2.074 ) and 
      (bondedto (attr store1 < 112.031873623  and attr store1 > 110.831873623 ) or 
       bondedto (attr store1 < 64.292  and attr store1 > 63.092 ) or 
       bondedto (attr store1 < 16.5521263766  and attr store1 > 15.3521263766 ))) 
6 0.1 0.1 peak 1128 volume 6.03700 ppm1 2.124 ppm2 1.333
 
! ############### hot_mothernoesy_072403.1129 folded +
assi (attr store1 < 0.998 and attr store1 > 0.798 )
     ((attr store1 < 2.177 and attr store1 > 2.077 ) and 
      (bondedto (attr store1 < 112.030873623  and attr store1 > 110.830873623 ) or 
       bondedto (attr store1 < 64.291  and attr store1 > 63.091 ) or 
       bondedto (attr store1 < 16.5511263766  and attr store1 > 15.3511263766 ))) 
6 0.1 0.1 peak 1129 volume 31.64380 ppm1 2.127 ppm2 0.898
 
! ############### hot_mothernoesy_072403.1130 folded +
assi (attr store1 < 4.141 and attr store1 > 3.941 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 112.027873623  and attr store1 > 110.827873623 ) or 
       bondedto (attr store1 < 64.288  and attr store1 > 63.088 ) or 
       bondedto (attr store1 < 16.5481263766  and attr store1 > 15.3481263766 ))) 
6 0.1 0.1 peak 1130 volume 10.31430 ppm1 2.126 ppm2 4.041
 
! ############### hot_mothernoesy_072403.1131 folded +
assi (attr store1 < 4.003 and attr store1 > 3.803 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 112.019873623  and attr store1 > 110.819873623 ) or 
       bondedto (attr store1 < 64.28  and attr store1 > 63.08 ) or 
       bondedto (attr store1 < 16.5401263766  and attr store1 > 15.3401263766 ))) 
6 0.1 0.1 peak 1131 volume 5.06690 ppm1 2.126 ppm2 3.903
 
! ############### hot_mothernoesy_072403.1132 folded +
assi (attr store1 < 3.317 and attr store1 > 3.117 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 112.028873623  and attr store1 > 110.828873623 ) or 
       bondedto (attr store1 < 64.289  and attr store1 > 63.089 ) or 
       bondedto (attr store1 < 16.5491263766  and attr store1 > 15.3491263766 ))) 
6 0.1 0.1 peak 1132 volume 5.36790 ppm1 2.126 ppm2 3.217
 
! ############### hot_mothernoesy_072403.1133 folded +
assi (attr store1 < 3.057 and attr store1 > 2.857 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 112.029873623  and attr store1 > 110.829873623 ) or 
       bondedto (attr store1 < 64.29  and attr store1 > 63.09 ) or 
       bondedto (attr store1 < 16.5501263766  and attr store1 > 15.3501263766 ))) 
6 0.1 0.1 peak 1133 volume 31.64560 ppm1 2.126 ppm2 2.957
 
! ############### hot_mothernoesy_072403.1134 folded +
assi (attr store1 < 2.718 and attr store1 > 2.518 )
     ((attr store1 < 2.175 and attr store1 > 2.075 ) and 
      (bondedto (attr store1 < 111.989873623  and attr store1 > 110.789873623 ) or 
       bondedto (attr store1 < 64.25  and attr store1 > 63.05 ) or 
       bondedto (attr store1 < 16.5101263766  and attr store1 > 15.3101263766 ))) 
6 0.1 0.1 peak 1134 volume 3.26440 ppm1 2.125 ppm2 2.618
 
! ############### hot_mothernoesy_072403.1135 folded +
assi (attr store1 < 2.676 and attr store1 > 2.476 )
     ((attr store1 < 2.173 and attr store1 > 2.073 ) and 
      (bondedto (attr store1 < 112.011873623  and attr store1 > 110.811873623 ) or 
       bondedto (attr store1 < 64.272  and attr store1 > 63.072 ) or 
       bondedto (attr store1 < 16.5321263766  and attr store1 > 15.3321263766 ))) 
6 0.1 0.1 peak 1135 volume 3.56370 ppm1 2.123 ppm2 2.576
 
! ############### hot_mothernoesy_072403.1136 folded +
assi (attr store1 < 2.476 and attr store1 > 2.276 )
     ((attr store1 < 2.175 and attr store1 > 2.075 ) and 
      (bondedto (attr store1 < 112.023873623  and attr store1 > 110.823873623 ) or 
       bondedto (attr store1 < 64.284  and attr store1 > 63.084 ) or 
       bondedto (attr store1 < 16.5441263766  and attr store1 > 15.3441263766 ))) 
6 0.1 0.1 peak 1136 volume 21.90600 ppm1 2.125 ppm2 2.376
 
! ############### hot_mothernoesy_072403.1137 folded +
assi (attr store1 < 2.419 and attr store1 > 2.219 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 112.026873623  and attr store1 > 110.826873623 ) or 
       bondedto (attr store1 < 64.287  and attr store1 > 63.087 ) or 
       bondedto (attr store1 < 16.5471263766  and attr store1 > 15.3471263766 ))) 
6 0.1 0.1 peak 1137 volume 21.66520 ppm1 2.126 ppm2 2.319
 
! ############### hot_mothernoesy_072403.1138 folded +
assi (attr store1 < 2.041 and attr store1 > 1.841 )
     ((attr store1 < 2.175 and attr store1 > 2.075 ) and 
      (bondedto (attr store1 < 112.024873623  and attr store1 > 110.824873623 ) or 
       bondedto (attr store1 < 64.285  and attr store1 > 63.085 ) or 
       bondedto (attr store1 < 16.5451263766  and attr store1 > 15.3451263766 ))) 
6 0.1 0.1 peak 1138 volume 18.00110 ppm1 2.125 ppm2 1.941
 
! ############### hot_mothernoesy_072403.1139 folded +
assi (attr store1 < 1.976 and attr store1 > 1.776 )
     ((attr store1 < 2.175 and attr store1 > 2.075 ) and 
      (bondedto (attr store1 < 112.025873623  and attr store1 > 110.825873623 ) or 
       bondedto (attr store1 < 64.286  and attr store1 > 63.086 ) or 
       bondedto (attr store1 < 16.5461263766  and attr store1 > 15.3461263766 ))) 
6 0.1 0.1 peak 1139 volume 15.55520 ppm1 2.125 ppm2 1.876
 
! ############### hot_mothernoesy_072403.1140 folded +
assi (attr store1 < 1.766 and attr store1 > 1.566 )
     ((attr store1 < 2.174 and attr store1 > 2.074 ) and 
      (bondedto (attr store1 < 111.997873623  and attr store1 > 110.797873623 ) or 
       bondedto (attr store1 < 64.258  and attr store1 > 63.058 ) or 
       bondedto (attr store1 < 16.5181263766  and attr store1 > 15.3181263766 ))) 
6 0.1 0.1 peak 1140 volume 5.15020 ppm1 2.124 ppm2 1.666
 
! ############### hot_mothernoesy_072403.1141 folded +
assi (attr store1 < 1.34 and attr store1 > 1.14 )
     ((attr store1 < 2.175 and attr store1 > 2.075 ) and 
      (bondedto (attr store1 < 112.010873623  and attr store1 > 110.810873623 ) or 
       bondedto (attr store1 < 64.271  and attr store1 > 63.071 ) or 
       bondedto (attr store1 < 16.5311263766  and attr store1 > 15.3311263766 ))) 
6 0.1 0.1 peak 1141 volume 4.99500 ppm1 2.125 ppm2 1.240
 
! ############### hot_mothernoesy_072403.1142 folded -
assi (attr store1 < 1.111 and attr store1 > 0.911 )
     ((attr store1 < 1.603 and attr store1 > 1.503 ) and 
      (bondedto (attr store1 < 135.754810435  and attr store1 > 134.554810435 ) or 
       bondedto (attr store1 < 40.2750631883  and attr store1 > 39.0750631883 ))) 
6 0.1 0.1 peak 1142 volume 9.7153 ppm1 1.553 ppm2 1.011
 
! ############### hot_mothernoesy_072403.1143 folded -
assi (attr store1 < 1.659 and attr store1 > 1.459 )
     ((attr store1 < 1.598 and attr store1 > 1.498 ) and 
      (bondedto (attr store1 < 135.769810435  and attr store1 > 134.569810435 ) or 
       bondedto (attr store1 < 40.2900631883  and attr store1 > 39.0900631883 ))) 
6 0.1 0.1 peak 1143 volume 9.1113 ppm1 1.548 ppm2 1.559
 
! ############### hot_mothernoesy_072403.1144 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 4.214 and attr store1 > 4.114 ) and 
      (bondedto (attr store1 < 111.783873623  and attr store1 > 110.583873623 ) or 
       bondedto (attr store1 < 64.044  and attr store1 > 62.844 ) or 
       bondedto (attr store1 < 16.3041263766  and attr store1 > 15.1041263766 ))) 
6 0.1 0.1 peak 1144 volume 5.33790 ppm1 4.164 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1145 folded +
assi (attr store1 < 4.401 and attr store1 > 4.201 )
     ((attr store1 < 4.211 and attr store1 > 4.111 ) and 
      (bondedto (attr store1 < 111.787873623  and attr store1 > 110.587873623 ) or 
       bondedto (attr store1 < 64.048  and attr store1 > 62.848 ) or 
       bondedto (attr store1 < 16.3081263766  and attr store1 > 15.1081263766 ))) 
6 0.1 0.1 peak 1145 volume 6.95370 ppm1 4.161 ppm2 4.301
 
! ############### hot_mothernoesy_072403.1146 folded +
assi (attr store1 < 4.266 and attr store1 > 4.066 )
     ((attr store1 < 4.212 and attr store1 > 4.112 ) and 
      (bondedto (attr store1 < 111.828873623  and attr store1 > 110.628873623 ) or 
       bondedto (attr store1 < 64.089  and attr store1 > 62.889 ) or 
       bondedto (attr store1 < 16.3491263766  and attr store1 > 15.1491263766 ))) 
6 0.1 0.1 peak 1146 volume 14.91830 ppm1 4.162 ppm2 4.166
 
! ############### hot_mothernoesy_072403.1147 folded +
assi (attr store1 < 4.123 and attr store1 > 3.923 )
     ((attr store1 < 4.213 and attr store1 > 4.113 ) and 
      (bondedto (attr store1 < 111.765873623  and attr store1 > 110.565873623 ) or 
       bondedto (attr store1 < 64.026  and attr store1 > 62.826 ) or 
       bondedto (attr store1 < 16.2861263766  and attr store1 > 15.0861263766 ))) 
6 0.1 0.1 peak 1147 volume 13.44050 ppm1 4.163 ppm2 4.023
 
! ############### hot_mothernoesy_072403.1148 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 4.071 and attr store1 > 3.971 ) and 
      (bondedto (attr store1 < 111.780873623  and attr store1 > 110.580873623 ) or 
       bondedto (attr store1 < 64.041  and attr store1 > 62.841 ) or 
       bondedto (attr store1 < 16.3011263766  and attr store1 > 15.1011263766 ))) 
6 0.1 0.1 peak 1148 volume 5.42750 ppm1 4.021 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1149 folded +
assi (attr store1 < 4.406 and attr store1 > 4.206 )
     ((attr store1 < 4.07 and attr store1 > 3.97 ) and 
      (bondedto (attr store1 < 111.769873623  and attr store1 > 110.569873623 ) or 
       bondedto (attr store1 < 64.03  and attr store1 > 62.83 ) or 
       bondedto (attr store1 < 16.2901263766  and attr store1 > 15.0901263766 ))) 
6 0.1 0.1 peak 1149 volume 9.46490 ppm1 4.020 ppm2 4.306
 
! ############### hot_mothernoesy_072403.1150 folded +
assi (attr store1 < 4.266 and attr store1 > 4.066 )
     ((attr store1 < 4.071 and attr store1 > 3.971 ) and 
      (bondedto (attr store1 < 111.764873623  and attr store1 > 110.564873623 ) or 
       bondedto (attr store1 < 64.025  and attr store1 > 62.825 ) or 
       bondedto (attr store1 < 16.2851263766  and attr store1 > 15.0851263766 ))) 
6 0.1 0.1 peak 1150 volume 13.93320 ppm1 4.021 ppm2 4.166
 
! ############### hot_mothernoesy_072403.1151 folded +
assi (attr store1 < 1.912 and attr store1 > 1.712 )
     ((attr store1 < 4.413 and attr store1 > 4.313 ) and 
      (bondedto (attr store1 < 111.695873623  and attr store1 > 110.495873623 ) or 
       bondedto (attr store1 < 63.956  and attr store1 > 62.756 ) or 
       bondedto (attr store1 < 16.2161263766  and attr store1 > 15.0161263766 ))) 
6 0.1 0.1 peak 1151 volume 6.15980 ppm1 4.363 ppm2 1.812
 
! ############### hot_mothernoesy_072403.1152 folded +
assi (attr store1 < 2.146 and attr store1 > 1.946 )
     ((attr store1 < 4.411 and attr store1 > 4.311 ) and 
      (bondedto (attr store1 < 111.665873623  and attr store1 > 110.465873623 ) or 
       bondedto (attr store1 < 63.926  and attr store1 > 62.726 ) or 
       bondedto (attr store1 < 16.1861263766  and attr store1 > 14.9861263766 ))) 
6 0.1 0.1 peak 1152 volume 5.20010 ppm1 4.361 ppm2 2.046
 
! ############### hot_mothernoesy_072403.1153 folded +
assi (attr store1 < 4.118 and attr store1 > 3.918 )
     ((attr store1 < 4.067 and attr store1 > 3.967 ) and 
      (bondedto (attr store1 < 111.702873623  and attr store1 > 110.502873623 ) or 
       bondedto (attr store1 < 63.963  and attr store1 > 62.763 ) or 
       bondedto (attr store1 < 16.2231263766  and attr store1 > 15.0231263766 ))) 
6 0.1 0.1 peak 1153 volume 21.11320 ppm1 4.017 ppm2 4.018
 
! ############### hot_mothernoesy_072403.1154 folded +
assi (attr store1 < 2.574 and attr store1 > 2.374 )
     ((attr store1 < 4.412 and attr store1 > 4.312 ) and 
      (bondedto (attr store1 < 111.650873623  and attr store1 > 110.450873623 ) or 
       bondedto (attr store1 < 63.911  and attr store1 > 62.711 ) or 
       bondedto (attr store1 < 16.1711263766  and attr store1 > 14.9711263766 ))) 
6 0.1 0.1 peak 1154 volume 8.31770 ppm1 4.362 ppm2 2.474
 
! ############### hot_mothernoesy_072403.1155 folded +
assi (attr store1 < 2.221 and attr store1 > 2.021 )
     ((attr store1 < 4.415 and attr store1 > 4.315 ) and 
      (bondedto (attr store1 < 111.643873623  and attr store1 > 110.443873623 ) or 
       bondedto (attr store1 < 63.904  and attr store1 > 62.704 ) or 
       bondedto (attr store1 < 16.1641263766  and attr store1 > 14.9641263766 ))) 
6 0.1 0.1 peak 1155 volume 6.26550 ppm1 4.365 ppm2 2.121
 
! ############### hot_mothernoesy_072403.1156 folded +
assi (attr store1 < 3.969 and attr store1 > 3.769 )
     ((attr store1 < 3.921 and attr store1 > 3.821 ) and 
      (bondedto (attr store1 < 111.598873623  and attr store1 > 110.398873623 ) or 
       bondedto (attr store1 < 63.859  and attr store1 > 62.659 ) or 
       bondedto (attr store1 < 16.1191263766  and attr store1 > 14.9191263766 ))) 
6 0.1 0.1 peak 1156 volume 12.93610 ppm1 3.871 ppm2 3.869
 
! ############### hot_mothernoesy_072403.1157 folded +
assi (attr store1 < 3.217 and attr store1 > 3.017 )
     ((attr store1 < 3.167 and attr store1 > 3.067 ) and 
      (bondedto (attr store1 < 111.596873623  and attr store1 > 110.396873623 ) or 
       bondedto (attr store1 < 63.857  and attr store1 > 62.657 ) or 
       bondedto (attr store1 < 16.1171263766  and attr store1 > 14.9171263766 ))) 
6 0.1 0.1 peak 1157 volume 24.40630 ppm1 3.117 ppm2 3.117
 
! ############### hot_mothernoesy_072403.1158 folded +
assi (attr store1 < 3.097 and attr store1 > 2.897 )
     ((attr store1 < 3.167 and attr store1 > 3.067 ) and 
      (bondedto (attr store1 < 111.616873623  and attr store1 > 110.416873623 ) or 
       bondedto (attr store1 < 63.877  and attr store1 > 62.677 ) or 
       bondedto (attr store1 < 16.1371263766  and attr store1 > 14.9371263766 ))) 
6 0.1 0.1 peak 1158 volume 25.23350 ppm1 3.117 ppm2 2.997
 
! ############### hot_mothernoesy_072403.1159 folded +
assi (attr store1 < 3.218 and attr store1 > 3.018 )
     ((attr store1 < 3.05 and attr store1 > 2.95 ) and 
      (bondedto (attr store1 < 111.629873623  and attr store1 > 110.429873623 ) or 
       bondedto (attr store1 < 63.89  and attr store1 > 62.69 ) or 
       bondedto (attr store1 < 16.1501263766  and attr store1 > 14.9501263766 ))) 
6 0.1 0.1 peak 1159 volume 25.29810 ppm1 3.000 ppm2 3.118
 
! ############### hot_mothernoesy_072403.1160 folded +
assi (attr store1 < 2.667 and attr store1 > 2.467 )
     ((attr store1 < 2.753 and attr store1 > 2.653 ) and 
      (bondedto (attr store1 < 111.463873623  and attr store1 > 110.263873623 ) or 
       bondedto (attr store1 < 63.724  and attr store1 > 62.524 ) or 
       bondedto (attr store1 < 15.9841263766  and attr store1 > 14.7841263766 ))) 
6 0.1 0.1 peak 1160 volume 17.10380 ppm1 2.703 ppm2 2.567
 
! ############### hot_mothernoesy_072403.1161 folded +
assi (attr store1 < 2.802 and attr store1 > 2.602 )
     ((attr store1 < 2.618 and attr store1 > 2.518 ) and 
      (bondedto (attr store1 < 111.424873623  and attr store1 > 110.224873623 ) or 
       bondedto (attr store1 < 63.685  and attr store1 > 62.485 ) or 
       bondedto (attr store1 < 15.9451263766  and attr store1 > 14.7451263766 ))) 
6 0.1 0.1 peak 1161 volume 18.23510 ppm1 2.568 ppm2 2.702
 
! ############### hot_mothernoesy_072403.1162 folded +
assi (attr store1 < 2.666 and attr store1 > 2.466 )
     ((attr store1 < 2.622 and attr store1 > 2.522 ) and 
      (bondedto (attr store1 < 111.429873623  and attr store1 > 110.229873623 ) or 
       bondedto (attr store1 < 63.69  and attr store1 > 62.49 ) or 
       bondedto (attr store1 < 15.9501263766  and attr store1 > 14.7501263766 ))) 
6 0.1 0.1 peak 1162 volume 17.57790 ppm1 2.572 ppm2 2.566
 
! ############### hot_mothernoesy_072403.1163 folded +
assi (attr store1 < 1.977 and attr store1 > 1.777 )
     ((attr store1 < 1.924 and attr store1 > 1.824 ) and 
      (bondedto (attr store1 < 111.389873623  and attr store1 > 110.189873623 ) or 
       bondedto (attr store1 < 63.65  and attr store1 > 62.45 ) or 
       bondedto (attr store1 < 15.9101263766  and attr store1 > 14.7101263766 ))) 
6 0.1 0.1 peak 1163 volume 34.75460 ppm1 1.874 ppm2 1.877
 
! ############### hot_mothernoesy_072403.1164 folded +
assi (attr store1 < 0.993 and attr store1 > 0.793 )
     ((attr store1 < 1.928 and attr store1 > 1.828 ) and 
      (bondedto (attr store1 < 111.412873623  and attr store1 > 110.212873623 ) or 
       bondedto (attr store1 < 63.673  and attr store1 > 62.473 ) or 
       bondedto (attr store1 < 15.9331263766  and attr store1 > 14.7331263766 ))) 
6 0.1 0.1 peak 1164 volume 5.67150 ppm1 1.878 ppm2 0.893
 
! ############### hot_mothernoesy_072403.1165 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 4.506 and attr store1 > 4.406 ) and 
      (bondedto (attr store1 < 111.303873623  and attr store1 > 110.103873623 ) or 
       bondedto (attr store1 < 63.564  and attr store1 > 62.364 ) or 
       bondedto (attr store1 < 15.8241263766  and attr store1 > 14.6241263766 ))) 
6 0.1 0.1 peak 1165 volume 7.77240 ppm1 4.456 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1166 folded +
assi (attr store1 < 4.723 and attr store1 > 4.523 )
     ((attr store1 < 4.506 and attr store1 > 4.406 ) and 
      (bondedto (attr store1 < 111.331873623  and attr store1 > 110.131873623 ) or 
       bondedto (attr store1 < 63.592  and attr store1 > 62.392 ) or 
       bondedto (attr store1 < 15.8521263766  and attr store1 > 14.6521263766 ))) 
6 0.1 0.1 peak 1166 volume 3.66340 ppm1 4.456 ppm2 4.623
 
! ############### hot_mothernoesy_072403.1167 folded +
assi (attr store1 < 4.558 and attr store1 > 4.358 )
     ((attr store1 < 4.508 and attr store1 > 4.408 ) and 
      (bondedto (attr store1 < 111.323873623  and attr store1 > 110.123873623 ) or 
       bondedto (attr store1 < 63.584  and attr store1 > 62.384 ) or 
       bondedto (attr store1 < 15.8441263766  and attr store1 > 14.6441263766 ))) 
6 0.1 0.1 peak 1167 volume 167.71519 ppm1 4.458 ppm2 4.458
 
! ############### hot_mothernoesy_072403.1169 folded +
assi (attr store1 < 2.424 and attr store1 > 2.224 )
     ((attr store1 < 4.508 and attr store1 > 4.408 ) and 
      (bondedto (attr store1 < 111.327873623  and attr store1 > 110.127873623 ) or 
       bondedto (attr store1 < 63.588  and attr store1 > 62.388 ) or 
       bondedto (attr store1 < 15.8481263766  and attr store1 > 14.6481263766 ))) 
6 0.1 0.1 peak 1169 volume 25.89810 ppm1 4.458 ppm2 2.324
 
! ############### hot_mothernoesy_072403.1170 folded +
assi (attr store1 < 2.145 and attr store1 > 1.945 )
     ((attr store1 < 4.508 and attr store1 > 4.408 ) and 
      (bondedto (attr store1 < 111.327873623  and attr store1 > 110.127873623 ) or 
       bondedto (attr store1 < 63.588  and attr store1 > 62.388 ) or 
       bondedto (attr store1 < 15.8481263766  and attr store1 > 14.6481263766 ))) 
6 0.1 0.1 peak 1170 volume 10.26100 ppm1 4.458 ppm2 2.045
 
! ############### hot_mothernoesy_072403.1172 folded -
assi (attr store1 < 0.259 and attr store1 > 0.059 )
     ((attr store1 < 1.039 and attr store1 > 0.939 ) and 
      (bondedto (attr store1 < 134.993810435  and attr store1 > 133.793810435 ) or 
       bondedto (attr store1 < 39.5140631883  and attr store1 > 38.3140631883 ))) 
6 0.1 0.1 peak 1172 volume 4.6655 ppm1 0.989 ppm2 0.159
 
! ############### hot_mothernoesy_072403.1173 folded -
assi (attr store1 < 1.558 and attr store1 > 1.358 )
     ((attr store1 < 1.033 and attr store1 > 0.933 ) and 
      (bondedto (attr store1 < 135.009810435  and attr store1 > 133.809810435 ) or 
       bondedto (attr store1 < 39.5300631883  and attr store1 > 38.3300631883 ))) 
6 0.1 0.1 peak 1173 volume 4.484 ppm1 0.983 ppm2 1.458
 
! ############### hot_mothernoesy_072403.1174 folded -
assi (attr store1 < 1.67 and attr store1 > 1.47 )
     ((attr store1 < 1.036 and attr store1 > 0.936 ) and 
      (bondedto (attr store1 < 134.957810435  and attr store1 > 133.757810435 ) or 
       bondedto (attr store1 < 39.4780631883  and attr store1 > 38.2780631883 ))) 
6 0.1 0.1 peak 1174 volume 10.9079 ppm1 0.986 ppm2 1.570
 
! ############### hot_mothernoesy_072403.1175 folded -
assi (attr store1 < 1.083 and attr store1 > 0.883 )
     ((attr store1 < 1.033 and attr store1 > 0.933 ) and 
      (bondedto (attr store1 < 134.959810435  and attr store1 > 133.759810435 ) or 
       bondedto (attr store1 < 39.4800631883  and attr store1 > 38.2800631883 ))) 
6 0.1 0.1 peak 1175 volume 101.6689 ppm1 0.983 ppm2 0.983
 
! ############### hot_mothernoesy_072403.1176 folded -
assi (attr store1 < 3.22 and attr store1 > 3.02 )
     ((attr store1 < 4.599 and attr store1 > 4.499 ) and 
      (bondedto (attr store1 < 134.787810435  and attr store1 > 133.587810435 ) or 
       bondedto (attr store1 < 39.3080631883  and attr store1 > 38.1080631883 ))) 
6 0.1 0.1 peak 1176 volume 10.1027 ppm1 4.549 ppm2 3.120
 
! ############### hot_mothernoesy_072403.1177 folded -
assi (attr store1 < 3.102 and attr store1 > 2.902 )
     ((attr store1 < 4.598 and attr store1 > 4.498 ) and 
      (bondedto (attr store1 < 134.803810435  and attr store1 > 133.603810435 ) or 
       bondedto (attr store1 < 39.3240631883  and attr store1 > 38.1240631883 ))) 
6 0.1 0.1 peak 1177 volume 11.796 ppm1 4.548 ppm2 3.002
 
! ############### hot_mothernoesy_072403.1178 folded -
assi (attr store1 < 4.646 and attr store1 > 4.446 )
     ((attr store1 < 3.167 and attr store1 > 3.067 ) and 
      (bondedto (attr store1 < 134.794810435  and attr store1 > 133.594810435 ) or 
       bondedto (attr store1 < 39.3150631883  and attr store1 > 38.1150631883 ))) 
6 0.1 0.1 peak 1178 volume 13.8005 ppm1 3.117 ppm2 4.546
 
! ############### hot_mothernoesy_072403.1179 folded -
assi (attr store1 < 3.218 and attr store1 > 3.018 )
     ((attr store1 < 3.167 and attr store1 > 3.067 ) and 
      (bondedto (attr store1 < 134.800810435  and attr store1 > 133.600810435 ) or 
       bondedto (attr store1 < 39.3210631883  and attr store1 > 38.1210631883 ))) 
6 0.1 0.1 peak 1179 volume 151.9483 ppm1 3.117 ppm2 3.118
 
! ############### hot_mothernoesy_072403.1180 folded -
assi (attr store1 < 3.107 and attr store1 > 2.907 )
     ((attr store1 < 3.061 and attr store1 > 2.961 ) and 
      (bondedto (attr store1 < 134.823810435  and attr store1 > 133.623810435 ) or 
       bondedto (attr store1 < 39.3440631883  and attr store1 > 38.1440631883 ))) 
6 0.1 0.1 peak 1180 volume 234.45821 ppm1 3.011 ppm2 3.007
 
! ############### hot_mothernoesy_072403.1182 folded +
assi (attr store1 < 3.812 and attr store1 > 3.612 )
     ((attr store1 < 3.763 and attr store1 > 3.663 ) and 
      (bondedto (attr store1 < 110.899873623  and attr store1 > 109.699873623 ) or 
       bondedto (attr store1 < 63.16  and attr store1 > 61.96 ) or 
       bondedto (attr store1 < 15.4201263766  and attr store1 > 14.2201263766 ))) 
6 0.1 0.1 peak 1182 volume 15.54680 ppm1 3.713 ppm2 3.712
 
! ############### hot_mothernoesy_072403.1185 folded +
assi (attr store1 < 1.651 and attr store1 > 1.451 )
     ((attr store1 < 3.765 and attr store1 > 3.665 ) and 
      (bondedto (attr store1 < 110.883873623  and attr store1 > 109.683873623 ) or 
       bondedto (attr store1 < 63.144  and attr store1 > 61.944 ) or 
       bondedto (attr store1 < 15.4041263766  and attr store1 > 14.2041263766 ))) 
6 0.1 0.1 peak 1185 volume 8.93190 ppm1 3.715 ppm2 1.551
 
! ############### hot_mothernoesy_072403.1186 folded -
assi (attr store1 < 3.099 and attr store1 > 2.899 )
     ((attr store1 < 3.167 and attr store1 > 3.067 ) and 
      (bondedto (attr store1 < 134.760810435  and attr store1 > 133.560810435 ) or 
       bondedto (attr store1 < 39.2810631883  and attr store1 > 38.0810631883 ))) 
6 0.1 0.1 peak 1186 volume 149.8752 ppm1 3.117 ppm2 2.999
 
! ############### hot_mothernoesy_072403.1187 folded -
assi (attr store1 < 3.217 and attr store1 > 3.017 )
     ((attr store1 < 3.049 and attr store1 > 2.949 ) and 
      (bondedto (attr store1 < 134.764810435  and attr store1 > 133.564810435 ) or 
       bondedto (attr store1 < 39.2850631883  and attr store1 > 38.0850631883 ))) 
6 0.1 0.1 peak 1187 volume 139.8457 ppm1 2.999 ppm2 3.117
 
! ############### hot_mothernoesy_072403.1188 folded -
assi (attr store1 < 2.874 and attr store1 > 2.674 )
     ((attr store1 < 3.054 and attr store1 > 2.954 ) and 
      (bondedto (attr store1 < 134.690810435  and attr store1 > 133.490810435 ) or 
       bondedto (attr store1 < 39.2110631883  and attr store1 > 38.0110631883 ))) 
6 0.1 0.1 peak 1188 volume 3.8119 ppm1 3.004 ppm2 2.774
 
! ############### hot_mothernoesy_072403.1189 folded +
assi (attr store1 < 4.167 and attr store1 > 3.967 )
     ((attr store1 < 4.118 and attr store1 > 4.018 ) and 
      (bondedto (attr store1 < 110.792873623  and attr store1 > 109.592873623 ) or 
       bondedto (attr store1 < 63.053  and attr store1 > 61.853 ) or 
       bondedto (attr store1 < 15.3131263766  and attr store1 > 14.1131263766 ))) 
6 0.1 0.1 peak 1189 volume 1145.23706 ppm1 4.068 ppm2 4.067
 
! ############### hot_mothernoesy_072403.1190 folded +
assi (attr store1 < 2.19 and attr store1 > 1.99 )
     ((attr store1 < 4.118 and attr store1 > 4.018 ) and 
      (bondedto (attr store1 < 110.785873623  and attr store1 > 109.585873623 ) or 
       bondedto (attr store1 < 63.046  and attr store1 > 61.846 ) or 
       bondedto (attr store1 < 15.3061263766  and attr store1 > 14.1061263766 ))) 
6 0.1 0.1 peak 1190 volume 9.77000 ppm1 4.068 ppm2 2.090
 
! ############### hot_mothernoesy_072403.1191 folded +
assi (attr store1 < 1.059 and attr store1 > 0.859 )
     ((attr store1 < 4.117 and attr store1 > 4.017 ) and 
      (bondedto (attr store1 < 110.805873623  and attr store1 > 109.605873623 ) or 
       bondedto (attr store1 < 63.066  and attr store1 > 61.866 ) or 
       bondedto (attr store1 < 15.3261263766  and attr store1 > 14.1261263766 ))) 
6 0.1 0.1 peak 1191 volume 6.98910 ppm1 4.067 ppm2 0.959
 
! ############### hot_mothernoesy_072403.1192 folded -
assi (attr store1 < 2.674 and attr store1 > 2.474 )
     ((attr store1 < 4.648 and attr store1 > 4.548 ) and 
      (bondedto (attr store1 < 134.671810435  and attr store1 > 133.471810435 ) or 
       bondedto (attr store1 < 39.1920631883  and attr store1 > 37.9920631883 ))) 
6 0.1 0.1 peak 1192 volume 7.9379 ppm1 4.598 ppm2 2.574
 
! ############### hot_mothernoesy_072403.1193 folded -
assi (attr store1 < 2.806 and attr store1 > 2.606 )
     ((attr store1 < 4.645 and attr store1 > 4.545 ) and 
      (bondedto (attr store1 < 134.646810435  and attr store1 > 133.446810435 ) or 
       bondedto (attr store1 < 39.1670631883  and attr store1 > 37.9670631883 ))) 
6 0.1 0.1 peak 1193 volume 4.9857 ppm1 4.595 ppm2 2.706
 
! ############### hot_mothernoesy_072403.1194 folded -
assi (attr store1 < 4.7 and attr store1 > 4.5 )
     ((attr store1 < 2.752 and attr store1 > 2.652 ) and 
      (bondedto (attr store1 < 134.647810435  and attr store1 > 133.447810435 ) or 
       bondedto (attr store1 < 39.1680631883  and attr store1 > 37.9680631883 ))) 
6 0.1 0.1 peak 1194 volume 13.4302 ppm1 2.702 ppm2 4.600
 
! ############### hot_mothernoesy_072403.1195 folded -
assi (attr store1 < 2.801 and attr store1 > 2.601 )
     ((attr store1 < 2.749 and attr store1 > 2.649 ) and 
      (bondedto (attr store1 < 134.658810435  and attr store1 > 133.458810435 ) or 
       bondedto (attr store1 < 39.1790631883  and attr store1 > 37.9790631883 ))) 
6 0.1 0.1 peak 1195 volume 184.7612 ppm1 2.699 ppm2 2.701
 
! ############### hot_mothernoesy_072403.1196 folded -
assi (attr store1 < 2.669 and attr store1 > 2.469 )
     ((attr store1 < 2.752 and attr store1 > 2.652 ) and 
      (bondedto (attr store1 < 134.647810435  and attr store1 > 133.447810435 ) or 
       bondedto (attr store1 < 39.1680631883  and attr store1 > 37.9680631883 ))) 
6 0.1 0.1 peak 1196 volume 127.7685 ppm1 2.702 ppm2 2.569
 
! ############### hot_mothernoesy_072403.1197 folded -
assi (attr store1 < 4.697 and attr store1 > 4.497 )
     ((attr store1 < 2.619 and attr store1 > 2.519 ) and 
      (bondedto (attr store1 < 134.648810435  and attr store1 > 133.448810435 ) or 
       bondedto (attr store1 < 39.1690631883  and attr store1 > 37.9690631883 ))) 
6 0.1 0.1 peak 1197 volume 13.2616 ppm1 2.569 ppm2 4.597
 
! ############### hot_mothernoesy_072403.1198 folded -
assi (attr store1 < 2.801 and attr store1 > 2.601 )
     ((attr store1 < 2.619 and attr store1 > 2.519 ) and 
      (bondedto (attr store1 < 134.635810435  and attr store1 > 133.435810435 ) or 
       bondedto (attr store1 < 39.1560631883  and attr store1 > 37.9560631883 ))) 
6 0.1 0.1 peak 1198 volume 126.8363 ppm1 2.569 ppm2 2.701
 
! ############### hot_mothernoesy_072403.1199 folded -
assi (attr store1 < 2.668 and attr store1 > 2.468 )
     ((attr store1 < 2.62 and attr store1 > 2.52 ) and 
      (bondedto (attr store1 < 134.650810435  and attr store1 > 133.450810435 ) or 
       bondedto (attr store1 < 39.1710631883  and attr store1 > 37.9710631883 ))) 
6 0.1 0.1 peak 1199 volume 151.2592 ppm1 2.570 ppm2 2.568
 
! ############### hot_mothernoesy_072403.1201 folded +
assi (attr store1 < 2.865 and attr store1 > 2.665 )
     ((attr store1 < 4.522 and attr store1 > 4.422 ) and 
      (bondedto (attr store1 < 110.635873623  and attr store1 > 109.435873623 ) or 
       bondedto (attr store1 < 62.896  and attr store1 > 61.696 ) or 
       bondedto (attr store1 < 15.1561263766  and attr store1 > 13.9561263766 ))) 
6 0.1 0.1 peak 1201 volume 3.36550 ppm1 4.472 ppm2 2.765
 
! ############### hot_mothernoesy_072403.1202 folded -
assi (attr store1 < 2.865 and attr store1 > 2.665 )
     ((attr store1 < 4.485 and attr store1 > 4.385 ) and 
      (bondedto (attr store1 < 134.546810435  and attr store1 > 133.346810435 ) or 
       bondedto (attr store1 < 39.0670631883  and attr store1 > 37.8670631883 ))) 
6 0.1 0.1 peak 1202 volume 17.2336 ppm1 4.435 ppm2 2.765
 
! ############### hot_mothernoesy_072403.1203 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 2.814 and attr store1 > 2.714 ) and 
      (bondedto (attr store1 < 134.566810435  and attr store1 > 133.366810435 ) or 
       bondedto (attr store1 < 39.0870631883  and attr store1 > 37.8870631883 ))) 
6 0.1 0.1 peak 1203 volume 5.6874 ppm1 2.764 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1204 folded -
assi (attr store1 < 4.537 and attr store1 > 4.337 )
     ((attr store1 < 2.815 and attr store1 > 2.715 ) and 
      (bondedto (attr store1 < 134.540810435  and attr store1 > 133.340810435 ) or 
       bondedto (attr store1 < 39.0610631883  and attr store1 > 37.8610631883 ))) 
6 0.1 0.1 peak 1204 volume 19.4446 ppm1 2.765 ppm2 4.437
 
! ############### hot_mothernoesy_072403.1205 folded -
assi (attr store1 < 2.865 and attr store1 > 2.665 )
     ((attr store1 < 2.814 and attr store1 > 2.714 ) and 
      (bondedto (attr store1 < 134.536810435  and attr store1 > 133.336810435 ) or 
       bondedto (attr store1 < 39.0570631883  and attr store1 > 37.8570631883 ))) 
6 0.1 0.1 peak 1205 volume 491.73639 ppm1 2.764 ppm2 2.765
 
! ############### hot_mothernoesy_072403.1210 folded +
assi (attr store1 < 3.637 and attr store1 > 3.437 )
     ((attr store1 < 3.214 and attr store1 > 3.114 ) and 
      (bondedto (attr store1 < 110.553873623  and attr store1 > 109.353873623 ) or 
       bondedto (attr store1 < 62.814  and attr store1 > 61.614 ) or 
       bondedto (attr store1 < 15.0741263766  and attr store1 > 13.8741263766 ))) 
6 0.1 0.1 peak 1210 volume 6.26160 ppm1 3.164 ppm2 3.537
 
! ############### hot_mothernoesy_072403.1211 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 3.213 and attr store1 > 3.113 ) and 
      (bondedto (attr store1 < 110.563873623  and attr store1 > 109.363873623 ) or 
       bondedto (attr store1 < 62.824  and attr store1 > 61.624 ) or 
       bondedto (attr store1 < 15.0841263766  and attr store1 > 13.8841263766 ))) 
6 0.1 0.1 peak 1211 volume 3.25850 ppm1 3.163 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1212 folded +
assi (attr store1 < 1.544 and attr store1 > 1.344 )
     ((attr store1 < 1.039 and attr store1 > 0.939 ) and 
      (bondedto (attr store1 < 110.576873623  and attr store1 > 109.376873623 ) or 
       bondedto (attr store1 < 62.837  and attr store1 > 61.637 ) or 
       bondedto (attr store1 < 15.0971263766  and attr store1 > 13.8971263766 ))) 
6 0.1 0.1 peak 1212 volume 9.84190 ppm1 0.989 ppm2 1.444
 
! ############### hot_mothernoesy_072403.1213 folded +
assi (attr store1 < 1.327 and attr store1 > 1.127 )
     ((attr store1 < 1.038 and attr store1 > 0.938 ) and 
      (bondedto (attr store1 < 110.571873623  and attr store1 > 109.371873623 ) or 
       bondedto (attr store1 < 62.832  and attr store1 > 61.632 ) or 
       bondedto (attr store1 < 15.0921263766  and attr store1 > 13.8921263766 ))) 
6 0.1 0.1 peak 1213 volume 6.51130 ppm1 0.988 ppm2 1.227
 
! ############### hot_mothernoesy_072403.1214 folded +
assi (attr store1 < 1.086 and attr store1 > 0.886 )
     ((attr store1 < 1.039 and attr store1 > 0.939 ) and 
      (bondedto (attr store1 < 110.565873623  and attr store1 > 109.365873623 ) or 
       bondedto (attr store1 < 62.826  and attr store1 > 61.626 ) or 
       bondedto (attr store1 < 15.0861263766  and attr store1 > 13.8861263766 ))) 
6 0.1 0.1 peak 1214 volume 219.26100 ppm1 0.989 ppm2 0.986
 
! ############### hot_mothernoesy_072403.1215 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 1.034 and attr store1 > 0.934 ) and 
      (bondedto (attr store1 < 110.552873623  and attr store1 > 109.352873623 ) or 
       bondedto (attr store1 < 62.813  and attr store1 > 61.613 ) or 
       bondedto (attr store1 < 15.0731263766  and attr store1 > 13.8731263766 ))) 
6 0.1 0.1 peak 1215 volume 5.04690 ppm1 0.984 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1218 folded +
assi (attr store1 < 2.994 and attr store1 > 2.794 )
     ((attr store1 < 1.038 and attr store1 > 0.938 ) and 
      (bondedto (attr store1 < 110.545873623  and attr store1 > 109.345873623 ) or 
       bondedto (attr store1 < 62.806  and attr store1 > 61.606 ) or 
       bondedto (attr store1 < 15.0661263766  and attr store1 > 13.8661263766 ))) 
6 0.1 0.1 peak 1218 volume 3.17770 ppm1 0.988 ppm2 2.894
 
! ############### hot_mothernoesy_072403.1219 folded +
assi (attr store1 < 1.989 and attr store1 > 1.789 )
     ((attr store1 < 1.035 and attr store1 > 0.935 ) and 
      (bondedto (attr store1 < 110.581873623  and attr store1 > 109.381873623 ) or 
       bondedto (attr store1 < 62.842  and attr store1 > 61.642 ) or 
       bondedto (attr store1 < 15.1021263766  and attr store1 > 13.9021263766 ))) 
6 0.1 0.1 peak 1219 volume 6.92810 ppm1 0.985 ppm2 1.889
 
! ############### hot_mothernoesy_072403.1221 folded +
assi (attr store1 < 0.912 and attr store1 > 0.712 )
     ((attr store1 < 1.038 and attr store1 > 0.938 ) and 
      (bondedto (attr store1 < 110.570873623  and attr store1 > 109.370873623 ) or 
       bondedto (attr store1 < 62.831  and attr store1 > 61.631 ) or 
       bondedto (attr store1 < 15.0911263766  and attr store1 > 13.8911263766 ))) 
6 0.1 0.1 peak 1221 volume 18.75280 ppm1 0.988 ppm2 0.812
 
! ############### hot_mothernoesy_072403.1224 folded +
assi (attr store1 < 3.268 and attr store1 > 3.068 )
     ((attr store1 < 3.217 and attr store1 > 3.117 ) and 
      (bondedto (attr store1 < 110.509873623  and attr store1 > 109.309873623 ) or 
       bondedto (attr store1 < 62.77  and attr store1 > 61.57 ) or 
       bondedto (attr store1 < 15.0301263766  and attr store1 > 13.8301263766 ))) 
6 0.1 0.1 peak 1224 volume 51.08110 ppm1 3.167 ppm2 3.168
 
! ############### hot_mothernoesy_072403.1225 folded +
assi (attr store1 < 1.089 and attr store1 > 0.889 )
     ((attr store1 < 3.215 and attr store1 > 3.115 ) and 
      (bondedto (attr store1 < 110.513873623  and attr store1 > 109.313873623 ) or 
       bondedto (attr store1 < 62.774  and attr store1 > 61.574 ) or 
       bondedto (attr store1 < 15.0341263766  and attr store1 > 13.8341263766 ))) 
6 0.1 0.1 peak 1225 volume 5.55650 ppm1 3.165 ppm2 0.989
 
! ############### hot_mothernoesy_072403.1226 folded +
assi (attr store1 < 4.104 and attr store1 > 3.904 )
     ((attr store1 < 3.212 and attr store1 > 3.112 ) and 
      (bondedto (attr store1 < 110.498873623  and attr store1 > 109.298873623 ) or 
       bondedto (attr store1 < 62.759  and attr store1 > 61.559 ) or 
       bondedto (attr store1 < 15.0191263766  and attr store1 > 13.8191263766 ))) 
6 0.1 0.1 peak 1226 volume 3.94570 ppm1 3.162 ppm2 4.004
 
! ############### hot_mothernoesy_072403.1227 folded +
assi (attr store1 < 4.125 and attr store1 > 3.925 )
     ((attr store1 < 4.075 and attr store1 > 3.975 ) and 
      (bondedto (attr store1 < 110.309873623  and attr store1 > 109.109873623 ) or 
       bondedto (attr store1 < 62.57  and attr store1 > 61.37 ) or 
       bondedto (attr store1 < 14.8301263766  and attr store1 > 13.6301263766 ))) 
6 0.1 0.1 peak 1227 volume 353.47751 ppm1 4.025 ppm2 4.025
 
! ############### hot_mothernoesy_072403.1232 folded -
assi (attr store1 < 3.143 and attr store1 > 2.943 )
     ((attr store1 < 3.427 and attr store1 > 3.327 ) and 
      (bondedto (attr store1 < 134.150810435  and attr store1 > 132.950810435 ) or 
       bondedto (attr store1 < 38.6710631883  and attr store1 > 37.4710631883 ))) 
6 0.1 0.1 peak 1232 volume 3.6705 ppm1 3.377 ppm2 3.043
 
! ############### hot_mothernoesy_072403.1233 folded +
assi (attr store1 < 1.742 and attr store1 > 1.542 )
     ((attr store1 < 4.075 and attr store1 > 3.975 ) and 
      (bondedto (attr store1 < 110.254873623  and attr store1 > 109.054873623 ) or 
       bondedto (attr store1 < 62.515  and attr store1 > 61.315 ) or 
       bondedto (attr store1 < 14.7751263766  and attr store1 > 13.5751263766 ))) 
6 0.1 0.1 peak 1233 volume 3.40370 ppm1 4.025 ppm2 1.642
 
! ############### hot_mothernoesy_072403.1234 folded -
assi (attr store1 < 4.782 and attr store1 > 4.582 )
     ((attr store1 < 3.144 and attr store1 > 3.044 ) and 
      (bondedto (attr store1 < 134.037810435  and attr store1 > 132.837810435 ) or 
       bondedto (attr store1 < 38.5580631883  and attr store1 > 37.3580631883 ))) 
6 0.1 0.1 peak 1234 volume 4.2277 ppm1 3.094 ppm2 4.682
 
! ############### hot_mothernoesy_072403.1235 folded -
assi (attr store1 < 4.647 and attr store1 > 4.447 )
     ((attr store1 < 3.042 and attr store1 > 2.942 ) and 
      (bondedto (attr store1 < 134.113810435  and attr store1 > 132.913810435 ) or 
       bondedto (attr store1 < 38.6340631883  and attr store1 > 37.4340631883 ))) 
6 0.1 0.1 peak 1235 volume 3.7981 ppm1 2.992 ppm2 4.547
 
! ############### hot_mothernoesy_072403.1236 folded -
assi (attr store1 < 4.781 and attr store1 > 4.581 )
     ((attr store1 < 3.029 and attr store1 > 2.929 ) and 
      (bondedto (attr store1 < 134.042810435  and attr store1 > 132.842810435 ) or 
       bondedto (attr store1 < 38.5630631883  and attr store1 > 37.3630631883 ))) 
6 0.1 0.1 peak 1236 volume 4.228 ppm1 2.979 ppm2 4.681
 
! ############### hot_mothernoesy_072403.1237 folded +
assi (attr store1 < 3.68 and attr store1 > 3.48 )
     ((attr store1 < 3.627 and attr store1 > 3.527 ) and 
      (bondedto (attr store1 < 109.980873623  and attr store1 > 108.780873623 ) or 
       bondedto (attr store1 < 62.241  and attr store1 > 61.041 ) or 
       bondedto (attr store1 < 14.5011263766  and attr store1 > 13.3011263766 ))) 
6 0.1 0.1 peak 1237 volume 8.29260 ppm1 3.577 ppm2 3.580
 
! ############### hot_mothernoesy_072403.1239 folded +
assi (attr store1 < 1.579 and attr store1 > 1.379 )
     ((attr store1 < 3.625 and attr store1 > 3.525 ) and 
      (bondedto (attr store1 < 109.997873623  and attr store1 > 108.797873623 ) or 
       bondedto (attr store1 < 62.258  and attr store1 > 61.058 ) or 
       bondedto (attr store1 < 14.5181263766  and attr store1 > 13.3181263766 ))) 
6 0.1 0.1 peak 1239 volume 3.29140 ppm1 3.575 ppm2 1.479
 
! ############### hot_mothernoesy_072403.1241 folded +
assi (attr store1 < 2.919 and attr store1 > 2.719 )
     ((attr store1 < 3.235 and attr store1 > 3.135 ) and 
      (bondedto (attr store1 < 110.018873623  and attr store1 > 108.818873623 ) or 
       bondedto (attr store1 < 62.279  and attr store1 > 61.079 ) or 
       bondedto (attr store1 < 14.5391263766  and attr store1 > 13.3391263766 ))) 
6 0.1 0.1 peak 1241 volume 10.72940 ppm1 3.185 ppm2 2.819
 
! ############### hot_mothernoesy_072403.1242 folded +
assi (attr store1 < 3.271 and attr store1 > 3.071 )
     ((attr store1 < 3.219 and attr store1 > 3.119 ) and 
      (bondedto (attr store1 < 110.043873623  and attr store1 > 108.843873623 ) or 
       bondedto (attr store1 < 62.304  and attr store1 > 61.104 ) or 
       bondedto (attr store1 < 14.5641263766  and attr store1 > 13.3641263766 ))) 
6 0.1 0.1 peak 1242 volume 31.73240 ppm1 3.169 ppm2 3.171
 
! ############### hot_mothernoesy_072403.1243 folded +
assi (attr store1 < 3.283 and attr store1 > 3.083 )
     ((attr store1 < 2.875 and attr store1 > 2.775 ) and 
      (bondedto (attr store1 < 109.994873623  and attr store1 > 108.794873623 ) or 
       bondedto (attr store1 < 62.255  and attr store1 > 61.055 ) or 
       bondedto (attr store1 < 14.5151263766  and attr store1 > 13.3151263766 ))) 
6 0.1 0.1 peak 1243 volume 10.70880 ppm1 2.825 ppm2 3.183
 
! ############### hot_mothernoesy_072403.1244 folded +
assi (attr store1 < 2.93 and attr store1 > 2.73 )
     ((attr store1 < 2.879 and attr store1 > 2.779 ) and 
      (bondedto (attr store1 < 110.046873623  and attr store1 > 108.846873623 ) or 
       bondedto (attr store1 < 62.307  and attr store1 > 61.107 ) or 
       bondedto (attr store1 < 14.5671263766  and attr store1 > 13.3671263766 ))) 
6 0.1 0.1 peak 1244 volume 9.17990 ppm1 2.829 ppm2 2.830
 
! ############### hot_mothernoesy_072403.1247 folded +
assi (attr store1 < 2.127 and attr store1 > 1.927 )
     ((attr store1 < 4.412 and attr store1 > 4.312 ) and 
      (bondedto (attr store1 < 109.913873623  and attr store1 > 108.713873623 ) or 
       bondedto (attr store1 < 62.174  and attr store1 > 60.974 ) or 
       bondedto (attr store1 < 14.4341263766  and attr store1 > 13.2341263766 ))) 
6 0.1 0.1 peak 1247 volume 3.69950 ppm1 4.362 ppm2 2.027
 
! ############### hot_mothernoesy_072403.1250 folded +
assi (attr store1 < 2.276 and attr store1 > 2.076 )
     ((attr store1 < 4.408 and attr store1 > 4.308 ) and 
      (bondedto (attr store1 < 109.931873623  and attr store1 > 108.731873623 ) or 
       bondedto (attr store1 < 62.192  and attr store1 > 60.992 ) or 
       bondedto (attr store1 < 14.4521263766  and attr store1 > 13.2521263766 ))) 
6 0.1 0.1 peak 1250 volume 6.25440 ppm1 4.358 ppm2 2.176
 
! ############### hot_mothernoesy_072403.1251 folded +
assi (attr store1 < 1.666 and attr store1 > 1.466 )
     ((attr store1 < 4.302 and attr store1 > 4.202 ) and 
      (bondedto (attr store1 < 109.940873623  and attr store1 > 108.740873623 ) or 
       bondedto (attr store1 < 62.201  and attr store1 > 61.001 ) or 
       bondedto (attr store1 < 14.4611263766  and attr store1 > 13.2611263766 ))) 
6 0.1 0.1 peak 1251 volume 3.82630 ppm1 4.252 ppm2 1.566
 
! ############### hot_mothernoesy_072403.1252 folded +
assi (attr store1 < 0.908 and attr store1 > 0.708 )
     ((attr store1 < 4.306 and attr store1 > 4.206 ) and 
      (bondedto (attr store1 < 109.953873623  and attr store1 > 108.753873623 ) or 
       bondedto (attr store1 < 62.214  and attr store1 > 61.014 ) or 
       bondedto (attr store1 < 14.4741263766  and attr store1 > 13.2741263766 ))) 
6 0.1 0.1 peak 1252 volume 5.37190 ppm1 4.256 ppm2 0.808
 
! ############### hot_mothernoesy_072403.1253 folded +
assi (attr store1 < 2.048 and attr store1 > 1.848 )
     ((attr store1 < 4.041 and attr store1 > 3.941 ) and 
      (bondedto (attr store1 < 109.907873623  and attr store1 > 108.707873623 ) or 
       bondedto (attr store1 < 62.168  and attr store1 > 60.968 ) or 
       bondedto (attr store1 < 14.4281263766  and attr store1 > 13.2281263766 ))) 
6 0.1 0.1 peak 1253 volume 9.35340 ppm1 3.991 ppm2 1.948
 
! ############### hot_mothernoesy_072403.1254 folded +
assi (attr store1 < 1.89 and attr store1 > 1.69 )
     ((attr store1 < 4.044 and attr store1 > 3.944 ) and 
      (bondedto (attr store1 < 109.945873623  and attr store1 > 108.745873623 ) or 
       bondedto (attr store1 < 62.206  and attr store1 > 61.006 ) or 
       bondedto (attr store1 < 14.4661263766  and attr store1 > 13.2661263766 ))) 
6 0.1 0.1 peak 1254 volume 4.44740 ppm1 3.994 ppm2 1.790
 
! ############### hot_mothernoesy_072403.1255 folded +
assi (attr store1 < 1.65 and attr store1 > 1.45 )
     ((attr store1 < 4.039 and attr store1 > 3.939 ) and 
      (bondedto (attr store1 < 109.901873623  and attr store1 > 108.701873623 ) or 
       bondedto (attr store1 < 62.162  and attr store1 > 60.962 ) or 
       bondedto (attr store1 < 14.4221263766  and attr store1 > 13.2221263766 ))) 
6 0.1 0.1 peak 1255 volume 3.23700 ppm1 3.989 ppm2 1.550
 
! ############### hot_mothernoesy_072403.1256 folded +
assi (attr store1 < 1.66 and attr store1 > 1.46 )
     ((attr store1 < 3.63 and attr store1 > 3.53 ) and 
      (bondedto (attr store1 < 109.956873623  and attr store1 > 108.756873623 ) or 
       bondedto (attr store1 < 62.217  and attr store1 > 61.017 ) or 
       bondedto (attr store1 < 14.4771263766  and attr store1 > 13.2771263766 ))) 
6 0.1 0.1 peak 1256 volume 4.82120 ppm1 3.580 ppm2 1.560
 
! ############### hot_mothernoesy_072403.1259 folded -
assi (attr store1 < 2.04 and attr store1 > 1.84 )
     ((attr store1 < 1.986 and attr store1 > 1.886 ) and 
      (bondedto (attr store1 < 133.833810435  and attr store1 > 132.633810435 ) or 
       bondedto (attr store1 < 38.3540631883  and attr store1 > 37.1540631883 ))) 
6 0.1 0.1 peak 1259 volume 13.7611 ppm1 1.936 ppm2 1.940
 
! ############### hot_mothernoesy_072403.1260 folded +
assi (attr store1 < 4.461 and attr store1 > 4.261 )
     ((attr store1 < 4.406 and attr store1 > 4.306 ) and 
      (bondedto (attr store1 < 109.880873623  and attr store1 > 108.680873623 ) or 
       bondedto (attr store1 < 62.141  and attr store1 > 60.941 ) or 
       bondedto (attr store1 < 14.4011263766  and attr store1 > 13.2011263766 ))) 
6 0.1 0.1 peak 1260 volume 22.90300 ppm1 4.356 ppm2 4.361
 
! ############### hot_mothernoesy_072403.1261 folded +
assi (attr store1 < 3.321 and attr store1 > 3.121 )
     ((attr store1 < 4.042 and attr store1 > 3.942 ) and 
      (bondedto (attr store1 < 109.883873623  and attr store1 > 108.683873623 ) or 
       bondedto (attr store1 < 62.144  and attr store1 > 60.944 ) or 
       bondedto (attr store1 < 14.4041263766  and attr store1 > 13.2041263766 ))) 
6 0.1 0.1 peak 1261 volume 3.31460 ppm1 3.992 ppm2 3.221
 
! ############### hot_mothernoesy_072403.1262 folded -
assi (attr store1 < 4.123 and attr store1 > 3.923 )
     ((attr store1 < 0.916 and attr store1 > 0.816 ) and 
      (bondedto (attr store1 < 133.579810435  and attr store1 > 132.379810435 ) or 
       bondedto (attr store1 < 38.1000631883  and attr store1 > 36.9000631883 ))) 
6 0.1 0.1 peak 1262 volume 3.2006 ppm1 0.866 ppm2 4.023
 
! ############### hot_mothernoesy_072403.1263 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 4.303 and attr store1 > 4.203 ) and 
      (bondedto (attr store1 < 109.669873623  and attr store1 > 108.469873623 ) or 
       bondedto (attr store1 < 61.93  and attr store1 > 60.73 ) or 
       bondedto (attr store1 < 14.1901263766  and attr store1 > 12.9901263766 ))) 
6 0.1 0.1 peak 1263 volume 3.24200 ppm1 4.253 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1264 folded -
assi (attr store1 < 1.981 and attr store1 > 1.781 )
     ((attr store1 < 0.949 and attr store1 > 0.849 ) and 
      (bondedto (attr store1 < 133.560810435  and attr store1 > 132.360810435 ) or 
       bondedto (attr store1 < 38.0810631883  and attr store1 > 36.8810631883 ))) 
6 0.1 0.1 peak 1264 volume 3.866 ppm1 0.899 ppm2 1.881
 
! ############### hot_mothernoesy_072403.1265 folded -
assi (attr store1 < 1.986 and attr store1 > 1.786 )
     ((attr store1 < 0.916 and attr store1 > 0.816 ) and 
      (bondedto (attr store1 < 133.555810435  and attr store1 > 132.355810435 ) or 
       bondedto (attr store1 < 38.0760631883  and attr store1 > 36.8760631883 ))) 
6 0.1 0.1 peak 1265 volume 6.6265 ppm1 0.866 ppm2 1.886
 
! ############### hot_mothernoesy_072403.1266 folded -
assi (attr store1 < 1.554 and attr store1 > 1.354 )
     ((attr store1 < 0.917 and attr store1 > 0.817 ) and 
      (bondedto (attr store1 < 133.484810435  and attr store1 > 132.284810435 ) or 
       bondedto (attr store1 < 38.0050631883  and attr store1 > 36.8050631883 ))) 
6 0.1 0.1 peak 1266 volume 17.3203 ppm1 0.867 ppm2 1.454
 
! ############### hot_mothernoesy_072403.1267 folded -
assi (attr store1 < 1.267 and attr store1 > 1.067 )
     ((attr store1 < 0.917 and attr store1 > 0.817 ) and 
      (bondedto (attr store1 < 133.527810435  and attr store1 > 132.327810435 ) or 
       bondedto (attr store1 < 38.0480631883  and attr store1 > 36.8480631883 ))) 
6 0.1 0.1 peak 1267 volume 19.401 ppm1 0.867 ppm2 1.167
 
! ############### hot_mothernoesy_072403.1268 folded -
assi (attr store1 < 0.967 and attr store1 > 0.767 )
     ((attr store1 < 0.917 and attr store1 > 0.817 ) and 
      (bondedto (attr store1 < 133.523810435  and attr store1 > 132.323810435 ) or 
       bondedto (attr store1 < 38.0440631883  and attr store1 > 36.8440631883 ))) 
6 0.1 0.1 peak 1268 volume 894.13678 ppm1 0.867 ppm2 0.867
 
! ############### hot_mothernoesy_072403.1269 folded +
assi (attr store1 < 4.348 and attr store1 > 4.148 )
     ((attr store1 < 4.302 and attr store1 > 4.202 ) and 
      (bondedto (attr store1 < 109.593873623  and attr store1 > 108.393873623 ) or 
       bondedto (attr store1 < 61.854  and attr store1 > 60.654 ) or 
       bondedto (attr store1 < 14.1141263766  and attr store1 > 12.9141263766 ))) 
6 0.1 0.1 peak 1269 volume 36.11040 ppm1 4.252 ppm2 4.248
 
! ############### hot_mothernoesy_072403.1271 folded +
assi (attr store1 < 1.117 and attr store1 > 0.917 )
     ((attr store1 < 4.302 and attr store1 > 4.202 ) and 
      (bondedto (attr store1 < 109.577873623  and attr store1 > 108.377873623 ) or 
       bondedto (attr store1 < 61.838  and attr store1 > 60.638 ) or 
       bondedto (attr store1 < 14.0981263766  and attr store1 > 12.8981263766 ))) 
6 0.1 0.1 peak 1271 volume 21.92700 ppm1 4.252 ppm2 1.017
 
! ############### hot_mothernoesy_072403.1272 folded +
assi (attr store1 < 3.951 and attr store1 > 3.751 )
     ((attr store1 < 3.902 and attr store1 > 3.802 ) and 
      (bondedto (attr store1 < 109.512873623  and attr store1 > 108.312873623 ) or 
       bondedto (attr store1 < 61.773  and attr store1 > 60.573 ) or 
       bondedto (attr store1 < 14.0331263766  and attr store1 > 12.8331263766 ))) 
6 0.1 0.1 peak 1272 volume 21.98440 ppm1 3.852 ppm2 3.851
 
! ############### hot_mothernoesy_072403.1274 folded +
assi (attr store1 < 1.632 and attr store1 > 1.432 )
     ((attr store1 < 3.902 and attr store1 > 3.802 ) and 
      (bondedto (attr store1 < 109.525873623  and attr store1 > 108.325873623 ) or 
       bondedto (attr store1 < 61.786  and attr store1 > 60.586 ) or 
       bondedto (attr store1 < 14.0461263766  and attr store1 > 12.8461263766 ))) 
6 0.1 0.1 peak 1274 volume 6.27360 ppm1 3.852 ppm2 1.532
 
! ############### hot_mothernoesy_072403.1275 folded +
assi (attr store1 < 1.544 and attr store1 > 1.344 )
     ((attr store1 < 3.898 and attr store1 > 3.798 ) and 
      (bondedto (attr store1 < 109.517873623  and attr store1 > 108.317873623 ) or 
       bondedto (attr store1 < 61.778  and attr store1 > 60.578 ) or 
       bondedto (attr store1 < 14.0381263766  and attr store1 > 12.8381263766 ))) 
6 0.1 0.1 peak 1275 volume 4.28320 ppm1 3.848 ppm2 1.444
 
! ############### hot_mothernoesy_072403.1276 folded +
assi (attr store1 < 1.027 and attr store1 > 0.827 )
     ((attr store1 < 3.898 and attr store1 > 3.798 ) and 
      (bondedto (attr store1 < 109.526873623  and attr store1 > 108.326873623 ) or 
       bondedto (attr store1 < 61.787  and attr store1 > 60.587 ) or 
       bondedto (attr store1 < 14.0471263766  and attr store1 > 12.8471263766 ))) 
6 0.1 0.1 peak 1276 volume 6.01000 ppm1 3.848 ppm2 0.927
 
! ############### hot_mothernoesy_072403.1278 folded +
assi (attr store1 < 2.435 and attr store1 > 2.235 )
     ((attr store1 < 2.386 and attr store1 > 2.286 ) and 
      (bondedto (attr store1 < 109.563873623  and attr store1 > 108.363873623 ) or 
       bondedto (attr store1 < 61.824  and attr store1 > 60.624 ) or 
       bondedto (attr store1 < 14.0841263766  and attr store1 > 12.8841263766 ))) 
6 0.1 0.1 peak 1278 volume 62.17810 ppm1 2.336 ppm2 2.335
 
! ############### hot_mothernoesy_072403.1280 folded -
assi (attr store1 < 4.418 and attr store1 > 4.218 )
     ((attr store1 < 3.234 and attr store1 > 3.134 ) and 
      (bondedto (attr store1 < 133.233810435  and attr store1 > 132.033810435 ) or 
       bondedto (attr store1 < 37.7540631883  and attr store1 > 36.5540631883 ))) 
6 0.1 0.1 peak 1280 volume 15.172 ppm1 3.184 ppm2 4.318
 
! ############### hot_mothernoesy_072403.1281 folded -
assi (attr store1 < 3.286 and attr store1 > 3.086 )
     ((attr store1 < 3.235 and attr store1 > 3.135 ) and 
      (bondedto (attr store1 < 133.235810435  and attr store1 > 132.035810435 ) or 
       bondedto (attr store1 < 37.7560631883  and attr store1 > 36.5560631883 ))) 
6 0.1 0.1 peak 1281 volume 84.482 ppm1 3.185 ppm2 3.186
 
! ############### hot_mothernoesy_072403.1282 folded -
assi (attr store1 < 2.923 and attr store1 > 2.723 )
     ((attr store1 < 3.234 and attr store1 > 3.134 ) and 
      (bondedto (attr store1 < 133.225810435  and attr store1 > 132.025810435 ) or 
       bondedto (attr store1 < 37.7460631883  and attr store1 > 36.5460631883 ))) 
6 0.1 0.1 peak 1282 volume 58.7938 ppm1 3.184 ppm2 2.823
 
! ############### hot_mothernoesy_072403.1283 folded -
assi (attr store1 < 3.217 and attr store1 > 3.017 )
     ((attr store1 < 3.043 and attr store1 > 2.943 ) and 
      (bondedto (attr store1 < 133.254810435  and attr store1 > 132.054810435 ) or 
       bondedto (attr store1 < 37.7750631883  and attr store1 > 36.5750631883 ))) 
6 0.1 0.1 peak 1283 volume 9.4147 ppm1 2.993 ppm2 3.117
 
! ############### hot_mothernoesy_072403.1284 folded -
assi (attr store1 < 4.417 and attr store1 > 4.217 )
     ((attr store1 < 2.871 and attr store1 > 2.771 ) and 
      (bondedto (attr store1 < 133.239810435  and attr store1 > 132.039810435 ) or 
       bondedto (attr store1 < 37.7600631883  and attr store1 > 36.5600631883 ))) 
6 0.1 0.1 peak 1284 volume 14.0042 ppm1 2.821 ppm2 4.317
 
! ############### hot_mothernoesy_072403.1285 folded -
assi (attr store1 < 3.284 and attr store1 > 3.084 )
     ((attr store1 < 2.873 and attr store1 > 2.773 ) and 
      (bondedto (attr store1 < 133.237810435  and attr store1 > 132.037810435 ) or 
       bondedto (attr store1 < 37.7580631883  and attr store1 > 36.5580631883 ))) 
6 0.1 0.1 peak 1285 volume 59.4737 ppm1 2.823 ppm2 3.184
 
! ############### hot_mothernoesy_072403.1286 folded -
assi (attr store1 < 2.922 and attr store1 > 2.722 )
     ((attr store1 < 2.872 and attr store1 > 2.772 ) and 
      (bondedto (attr store1 < 133.235810435  and attr store1 > 132.035810435 ) or 
       bondedto (attr store1 < 37.7560631883  and attr store1 > 36.5560631883 ))) 
6 0.1 0.1 peak 1286 volume 90.8906 ppm1 2.822 ppm2 2.822
 
! ############### hot_mothernoesy_072403.1287 folded -
assi (attr store1 < 3.107 and attr store1 > 2.907 )
     ((attr store1 < 3.066 and attr store1 > 2.966 ) and 
      (bondedto (attr store1 < 133.185810435  and attr store1 > 131.985810435 ) or 
       bondedto (attr store1 < 37.7060631883  and attr store1 > 36.5060631883 ))) 
6 0.1 0.1 peak 1287 volume 38.7894 ppm1 3.016 ppm2 3.007
 
! ############### hot_mothernoesy_072403.1288 folded -
assi (attr store1 < 3.078 and attr store1 > 2.878 )
     ((attr store1 < 3.036 and attr store1 > 2.936 ) and 
      (bondedto (attr store1 < 133.144810435  and attr store1 > 131.944810435 ) or 
       bondedto (attr store1 < 37.6650631883  and attr store1 > 36.4650631883 ))) 
6 0.1 0.1 peak 1288 volume 36.2723 ppm1 2.986 ppm2 2.978
 
! ############### hot_mothernoesy_072403.1289 folded -
assi (attr store1 < 2.991 and attr store1 > 2.791 )
     ((attr store1 < 3.034 and attr store1 > 2.934 ) and 
      (bondedto (attr store1 < 133.126810435  and attr store1 > 131.926810435 ) or 
       bondedto (attr store1 < 37.6470631883  and attr store1 > 36.4470631883 ))) 
6 0.1 0.1 peak 1289 volume 28.1346 ppm1 2.984 ppm2 2.891
 
! ############### hot_mothernoesy_072403.1290 folded -
assi (attr store1 < 4.793 and attr store1 > 4.593 )
     ((attr store1 < 3.028 and attr store1 > 2.928 ) and 
      (bondedto (attr store1 < 133.122810435  and attr store1 > 131.922810435 ) or 
       bondedto (attr store1 < 37.6430631883  and attr store1 > 36.4430631883 ))) 
6 0.1 0.1 peak 1290 volume 12.3358 ppm1 2.978 ppm2 4.693
 
! ############### hot_mothernoesy_072403.1291 folded -
assi (attr store1 < 3.08 and attr store1 > 2.88 )
     ((attr store1 < 2.941 and attr store1 > 2.841 ) and 
      (bondedto (attr store1 < 133.121810435  and attr store1 > 131.921810435 ) or 
       bondedto (attr store1 < 37.6420631883  and attr store1 > 36.4420631883 ))) 
6 0.1 0.1 peak 1291 volume 26.304 ppm1 2.891 ppm2 2.980
 
! ############### hot_mothernoesy_072403.1292 folded -
assi (attr store1 < 4.793 and attr store1 > 4.593 )
     ((attr store1 < 2.937 and attr store1 > 2.837 ) and 
      (bondedto (attr store1 < 133.114810435  and attr store1 > 131.914810435 ) or 
       bondedto (attr store1 < 37.6350631883  and attr store1 > 36.4350631883 ))) 
6 0.1 0.1 peak 1292 volume 10.9948 ppm1 2.887 ppm2 4.693
 
! ############### hot_mothernoesy_072403.1293 folded -
assi (attr store1 < 2.985 and attr store1 > 2.785 )
     ((attr store1 < 2.931 and attr store1 > 2.831 ) and 
      (bondedto (attr store1 < 133.125810435  and attr store1 > 131.925810435 ) or 
       bondedto (attr store1 < 37.6460631883  and attr store1 > 36.4460631883 ))) 
6 0.1 0.1 peak 1293 volume 27.3147 ppm1 2.881 ppm2 2.885
 
! ############### hot_mothernoesy_072403.1294 folded -
assi (attr store1 < 4.59 and attr store1 > 4.39 )
     ((attr store1 < 0.927 and attr store1 > 0.827 ) and 
      (bondedto (attr store1 < 133.135810435  and attr store1 > 131.935810435 ) or 
       bondedto (attr store1 < 37.6560631883  and attr store1 > 36.4560631883 ))) 
6 0.1 0.1 peak 1294 volume 3.6599 ppm1 0.877 ppm2 4.490
 
! ############### hot_mothernoesy_072403.1295 folded -
assi (attr store1 < 2.053 and attr store1 > 1.853 )
     ((attr store1 < 0.928 and attr store1 > 0.828 ) and 
      (bondedto (attr store1 < 133.185810435  and attr store1 > 131.985810435 ) or 
       bondedto (attr store1 < 37.7060631883  and attr store1 > 36.5060631883 ))) 
6 0.1 0.1 peak 1295 volume 6.5795 ppm1 0.878 ppm2 1.953
 
! ############### hot_mothernoesy_072403.1296 folded -
assi (attr store1 < 1.183 and attr store1 > 0.983 )
     ((attr store1 < 0.926 and attr store1 > 0.826 ) and 
      (bondedto (attr store1 < 133.146810435  and attr store1 > 131.946810435 ) or 
       bondedto (attr store1 < 37.6670631883  and attr store1 > 36.4670631883 ))) 
6 0.1 0.1 peak 1296 volume 28.4239 ppm1 0.876 ppm2 1.083
 
! ############### hot_mothernoesy_072403.1297 folded +
assi (attr store1 < 3.775 and attr store1 > 3.575 )
     ((attr store1 < 3.726 and attr store1 > 3.626 ) and 
      (bondedto (attr store1 < 109.047873623  and attr store1 > 107.847873623 ) or 
       bondedto (attr store1 < 61.308  and attr store1 > 60.108 ) or 
       bondedto (attr store1 < 13.5681263766  and attr store1 > 12.3681263766 ))) 
6 0.1 0.1 peak 1297 volume 31.95540 ppm1 3.676 ppm2 3.675
 
! ############### hot_mothernoesy_072403.1298 folded +
assi (attr store1 < 2.432 and attr store1 > 2.232 )
     ((attr store1 < 3.726 and attr store1 > 3.626 ) and 
      (bondedto (attr store1 < 109.046873623  and attr store1 > 107.846873623 ) or 
       bondedto (attr store1 < 61.307  and attr store1 > 60.107 ) or 
       bondedto (attr store1 < 13.5671263766  and attr store1 > 12.3671263766 ))) 
6 0.1 0.1 peak 1298 volume 9.87820 ppm1 3.676 ppm2 2.332
 
! ############### hot_mothernoesy_072403.1299 folded +
assi (attr store1 < 2.237 and attr store1 > 2.037 )
     ((attr store1 < 3.726 and attr store1 > 3.626 ) and 
      (bondedto (attr store1 < 109.052873623  and attr store1 > 107.852873623 ) or 
       bondedto (attr store1 < 61.313  and attr store1 > 60.113 ) or 
       bondedto (attr store1 < 13.5731263766  and attr store1 > 12.3731263766 ))) 
6 0.1 0.1 peak 1299 volume 10.24920 ppm1 3.676 ppm2 2.137
 
! ############### hot_mothernoesy_072403.1300 folded +
assi (attr store1 < 2.164 and attr store1 > 1.964 )
     ((attr store1 < 3.725 and attr store1 > 3.625 ) and 
      (bondedto (attr store1 < 109.054873623  and attr store1 > 107.854873623 ) or 
       bondedto (attr store1 < 61.315  and attr store1 > 60.115 ) or 
       bondedto (attr store1 < 13.5751263766  and attr store1 > 12.3751263766 ))) 
6 0.1 0.1 peak 1300 volume 9.60810 ppm1 3.675 ppm2 2.064
 
! ############### hot_mothernoesy_072403.1304 folded +
assi (attr store1 < 0.965 and attr store1 > 0.765 )
     ((attr store1 < 0.915 and attr store1 > 0.815 ) and 
      (bondedto (attr store1 < 109.111873623  and attr store1 > 107.911873623 ) or 
       bondedto (attr store1 < 61.372  and attr store1 > 60.172 ) or 
       bondedto (attr store1 < 13.6321263766  and attr store1 > 12.4321263766 ))) 
6 0.1 0.1 peak 1304 volume 1976.19604 ppm1 0.865 ppm2 0.865
 
! ############### hot_mothernoesy_072403.1305 folded -
assi (attr store1 < 2.303 and attr store1 > 2.103 )
     ((attr store1 < 2.683 and attr store1 > 2.583 ) and 
      (bondedto (attr store1 < 132.960810435  and attr store1 > 131.760810435 ) or 
       bondedto (attr store1 < 37.4810631883  and attr store1 > 36.2810631883 ))) 
6 0.1 0.1 peak 1305 volume 3.4894 ppm1 2.633 ppm2 2.203
 
! ############### hot_mothernoesy_072403.1306 folded -
assi (attr store1 < 2.223 and attr store1 > 2.023 )
     ((attr store1 < 2.673 and attr store1 > 2.573 ) and 
      (bondedto (attr store1 < 132.955810435  and attr store1 > 131.755810435 ) or 
       bondedto (attr store1 < 37.4760631883  and attr store1 > 36.2760631883 ))) 
6 0.1 0.1 peak 1306 volume 5.4524 ppm1 2.623 ppm2 2.123
 
! ############### hot_mothernoesy_072403.1307 folded -
assi (attr store1 < 1.121 and attr store1 > 0.921 )
     ((attr store1 < 2.676 and attr store1 > 2.576 ) and 
      (bondedto (attr store1 < 132.945810435  and attr store1 > 131.745810435 ) or 
       bondedto (attr store1 < 37.4660631883  and attr store1 > 36.2660631883 ))) 
6 0.1 0.1 peak 1307 volume 4.5285 ppm1 2.626 ppm2 1.021
 
! ############### hot_mothernoesy_072403.1308 folded -
assi (attr store1 < 2.72 and attr store1 > 2.52 )
     ((attr store1 < 2.662 and attr store1 > 2.562 ) and 
      (bondedto (attr store1 < 132.995810435  and attr store1 > 131.795810435 ) or 
       bondedto (attr store1 < 37.5160631883  and attr store1 > 36.3160631883 ))) 
6 0.1 0.1 peak 1308 volume 6.7 ppm1 2.612 ppm2 2.620
 
! ############### hot_mothernoesy_072403.1309 folded -
assi (attr store1 < 4.142 and attr store1 > 3.942 )
     ((attr store1 < 2.501 and attr store1 > 2.401 ) and 
      (bondedto (attr store1 < 132.926810435  and attr store1 > 131.726810435 ) or 
       bondedto (attr store1 < 37.4470631883  and attr store1 > 36.2470631883 ))) 
6 0.1 0.1 peak 1309 volume 9.0562 ppm1 2.451 ppm2 4.042
 
! ############### hot_mothernoesy_072403.1310 folded -
assi (attr store1 < 2.42 and attr store1 > 2.22 )
     ((attr store1 < 2.502 and attr store1 > 2.402 ) and 
      (bondedto (attr store1 < 132.934810435  and attr store1 > 131.734810435 ) or 
       bondedto (attr store1 < 37.4550631883  and attr store1 > 36.2550631883 ))) 
6 0.1 0.1 peak 1310 volume 123.6376 ppm1 2.452 ppm2 2.320
 
! ############### hot_mothernoesy_072403.1311 folded -
assi (attr store1 < 2.182 and attr store1 > 1.982 )
     ((attr store1 < 2.501 and attr store1 > 2.401 ) and 
      (bondedto (attr store1 < 132.927810435  and attr store1 > 131.727810435 ) or 
       bondedto (attr store1 < 37.4480631883  and attr store1 > 36.2480631883 ))) 
6 0.1 0.1 peak 1311 volume 23.0132 ppm1 2.451 ppm2 2.082
 
! ############### hot_mothernoesy_072403.1312 folded -
assi (attr store1 < 2.103 and attr store1 > 1.903 )
     ((attr store1 < 2.498 and attr store1 > 2.398 ) and 
      (bondedto (attr store1 < 132.943810435  and attr store1 > 131.743810435 ) or 
       bondedto (attr store1 < 37.4640631883  and attr store1 > 36.2640631883 ))) 
6 0.1 0.1 peak 1312 volume 20.2137 ppm1 2.448 ppm2 2.003
 
! ############### hot_mothernoesy_072403.1313 folded -
assi (attr store1 < 2.551 and attr store1 > 2.351 )
     ((attr store1 < 2.494 and attr store1 > 2.394 ) and 
      (bondedto (attr store1 < 132.942810435  and attr store1 > 131.742810435 ) or 
       bondedto (attr store1 < 37.4630631883  and attr store1 > 36.2630631883 ))) 
6 0.1 0.1 peak 1313 volume 168.2784 ppm1 2.444 ppm2 2.451
 
! ############### hot_mothernoesy_072403.1314 folded -
assi (attr store1 < 1.144 and attr store1 > 0.944 )
     ((attr store1 < 2.495 and attr store1 > 2.395 ) and 
      (bondedto (attr store1 < 132.940810435  and attr store1 > 131.740810435 ) or 
       bondedto (attr store1 < 37.4610631883  and attr store1 > 36.2610631883 ))) 
6 0.1 0.1 peak 1314 volume 4.7482 ppm1 2.445 ppm2 1.044
 
! ############### hot_mothernoesy_072403.1315 folded -
assi (attr store1 < 2.549 and attr store1 > 2.349 )
     ((attr store1 < 2.371 and attr store1 > 2.271 ) and 
      (bondedto (attr store1 < 132.929810435  and attr store1 > 131.729810435 ) or 
       bondedto (attr store1 < 37.4500631883  and attr store1 > 36.2500631883 ))) 
6 0.1 0.1 peak 1315 volume 135.1882 ppm1 2.321 ppm2 2.449
 
! ############### hot_mothernoesy_072403.1316 folded -
assi (attr store1 < 2.11 and attr store1 > 1.91 )
     ((attr store1 < 2.371 and attr store1 > 2.271 ) and 
      (bondedto (attr store1 < 132.926810435  and attr store1 > 131.726810435 ) or 
       bondedto (attr store1 < 37.4470631883  and attr store1 > 36.2470631883 ))) 
6 0.1 0.1 peak 1316 volume 38.9642 ppm1 2.321 ppm2 2.010
 
! ############### hot_mothernoesy_072403.1317 folded -
assi (attr store1 < 1.129 and attr store1 > 0.929 )
     ((attr store1 < 2.37 and attr store1 > 2.27 ) and 
      (bondedto (attr store1 < 132.919810435  and attr store1 > 131.719810435 ) or 
       bondedto (attr store1 < 37.4400631883  and attr store1 > 36.2400631883 ))) 
6 0.1 0.1 peak 1317 volume 4.3879 ppm1 2.320 ppm2 1.029
 
! ############### hot_mothernoesy_072403.1318 folded -
assi (attr store1 < 4.255 and attr store1 > 4.055 )
     ((attr store1 < 2.364 and attr store1 > 2.264 ) and 
      (bondedto (attr store1 < 132.929810435  and attr store1 > 131.729810435 ) or 
       bondedto (attr store1 < 37.4500631883  and attr store1 > 36.2500631883 ))) 
6 0.1 0.1 peak 1318 volume 8.2862 ppm1 2.314 ppm2 4.155
 
! ############### hot_mothernoesy_072403.1319 folded -
assi (attr store1 < 2.415 and attr store1 > 2.215 )
     ((attr store1 < 2.363 and attr store1 > 2.263 ) and 
      (bondedto (attr store1 < 132.929810435  and attr store1 > 131.729810435 ) or 
       bondedto (attr store1 < 37.4500631883  and attr store1 > 36.2500631883 ))) 
6 0.1 0.1 peak 1319 volume 205.3029 ppm1 2.313 ppm2 2.315
 
! ############### hot_mothernoesy_072403.1320 folded -
assi (attr store1 < 2.327 and attr store1 > 2.127 )
     ((attr store1 < 2.364 and attr store1 > 2.264 ) and 
      (bondedto (attr store1 < 132.921810435  and attr store1 > 131.721810435 ) or 
       bondedto (attr store1 < 37.4420631883  and attr store1 > 36.2420631883 ))) 
6 0.1 0.1 peak 1320 volume 121.9126 ppm1 2.314 ppm2 2.227
 
! ############### hot_mothernoesy_072403.1321 folded -
assi (attr store1 < 2.328 and attr store1 > 2.128 )
     ((attr store1 < 2.279 and attr store1 > 2.179 ) and 
      (bondedto (attr store1 < 132.916810435  and attr store1 > 131.716810435 ) or 
       bondedto (attr store1 < 37.4370631883  and attr store1 > 36.2370631883 ))) 
6 0.1 0.1 peak 1321 volume 99.1143 ppm1 2.229 ppm2 2.228
 
! ############### hot_mothernoesy_072403.1322 folded -
assi (attr store1 < 1.97 and attr store1 > 1.77 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 132.954810435  and attr store1 > 131.754810435 ) or 
       bondedto (attr store1 < 37.4750631883  and attr store1 > 36.2750631883 ))) 
6 0.1 0.1 peak 1322 volume 3.7882 ppm1 2.126 ppm2 1.870
 
! ############### hot_mothernoesy_072403.1323 folded -
assi (attr store1 < 4.178 and attr store1 > 3.978 )
     ((attr store1 < 2.165 and attr store1 > 2.065 ) and 
      (bondedto (attr store1 < 132.957810435  and attr store1 > 131.757810435 ) or 
       bondedto (attr store1 < 37.4780631883  and attr store1 > 36.2780631883 ))) 
6 0.1 0.1 peak 1323 volume 3.3105 ppm1 2.115 ppm2 4.078
 
! ############### hot_mothernoesy_072403.1324 folded -
assi (attr store1 < 2.728 and attr store1 > 2.528 )
     ((attr store1 < 2.17 and attr store1 > 2.07 ) and 
      (bondedto (attr store1 < 132.943810435  and attr store1 > 131.743810435 ) or 
       bondedto (attr store1 < 37.4640631883  and attr store1 > 36.2640631883 ))) 
6 0.1 0.1 peak 1324 volume 4.694 ppm1 2.120 ppm2 2.628
 
! ############### hot_mothernoesy_072403.1325 folded -
assi (attr store1 < 2.323 and attr store1 > 2.123 )
     ((attr store1 < 2.169 and attr store1 > 2.069 ) and 
      (bondedto (attr store1 < 132.933810435  and attr store1 > 131.733810435 ) or 
       bondedto (attr store1 < 37.4540631883  and attr store1 > 36.2540631883 ))) 
6 0.1 0.1 peak 1325 volume 11.0675 ppm1 2.119 ppm2 2.223
 
! ############### hot_mothernoesy_072403.1326 folded -
assi (attr store1 < 1.12 and attr store1 > 0.92 )
     ((attr store1 < 2.165 and attr store1 > 2.065 ) and 
      (bondedto (attr store1 < 132.961810435  and attr store1 > 131.761810435 ) or 
       bondedto (attr store1 < 37.4820631883  and attr store1 > 36.2820631883 ))) 
6 0.1 0.1 peak 1326 volume 5.0339 ppm1 2.115 ppm2 1.020
 
! ############### hot_mothernoesy_072403.1327 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 3.725 and attr store1 > 3.625 ) and 
      (bondedto (attr store1 < 109.042873623  and attr store1 > 107.842873623 ) or 
       bondedto (attr store1 < 61.303  and attr store1 > 60.103 ) or 
       bondedto (attr store1 < 13.5631263766  and attr store1 > 12.3631263766 ))) 
6 0.1 0.1 peak 1327 volume 5.76100 ppm1 3.675 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1328 folded +
assi (attr store1 < 3.318 and attr store1 > 3.118 )
     ((attr store1 < 3.727 and attr store1 > 3.627 ) and 
      (bondedto (attr store1 < 109.044873623  and attr store1 > 107.844873623 ) or 
       bondedto (attr store1 < 61.305  and attr store1 > 60.105 ) or 
       bondedto (attr store1 < 13.5651263766  and attr store1 > 12.3651263766 ))) 
6 0.1 0.1 peak 1328 volume 3.58720 ppm1 3.677 ppm2 3.218
 
! ############### hot_mothernoesy_072403.1329 folded +
assi (attr store1 < 2.042 and attr store1 > 1.842 )
     ((attr store1 < 3.727 and attr store1 > 3.627 ) and 
      (bondedto (attr store1 < 109.023873623  and attr store1 > 107.823873623 ) or 
       bondedto (attr store1 < 61.284  and attr store1 > 60.084 ) or 
       bondedto (attr store1 < 13.5441263766  and attr store1 > 12.3441263766 ))) 
6 0.1 0.1 peak 1329 volume 6.75640 ppm1 3.677 ppm2 1.942
 
! ############### hot_mothernoesy_072403.1330 folded -
assi (attr store1 < 4.136 and attr store1 > 3.936 )
     ((attr store1 < 2.37 and attr store1 > 2.27 ) and 
      (bondedto (attr store1 < 132.891810435  and attr store1 > 131.691810435 ) or 
       bondedto (attr store1 < 37.4120631883  and attr store1 > 36.2120631883 ))) 
6 0.1 0.1 peak 1330 volume 9.1737 ppm1 2.320 ppm2 4.036
 
! ############### hot_mothernoesy_072403.1331 folded -
assi (attr store1 < 2.2 and attr store1 > 2.0 )
     ((attr store1 < 2.369 and attr store1 > 2.269 ) and 
      (bondedto (attr store1 < 132.909810435  and attr store1 > 131.709810435 ) or 
       bondedto (attr store1 < 37.4300631883  and attr store1 > 36.2300631883 ))) 
6 0.1 0.1 peak 1331 volume 42.6444 ppm1 2.319 ppm2 2.100
 
! ############### hot_mothernoesy_072403.1332 folded -
assi (attr store1 < 1.561 and attr store1 > 1.361 )
     ((attr store1 < 2.371 and attr store1 > 2.271 ) and 
      (bondedto (attr store1 < 132.908810435  and attr store1 > 131.708810435 ) or 
       bondedto (attr store1 < 37.4290631883  and attr store1 > 36.2290631883 ))) 
6 0.1 0.1 peak 1332 volume 3.6674 ppm1 2.321 ppm2 1.461
 
! ############### hot_mothernoesy_072403.1333 folded -
assi (attr store1 < 2.413 and attr store1 > 2.213 )
     ((attr store1 < 2.277 and attr store1 > 2.177 ) and 
      (bondedto (attr store1 < 132.913810435  and attr store1 > 131.713810435 ) or 
       bondedto (attr store1 < 37.4340631883  and attr store1 > 36.2340631883 ))) 
6 0.1 0.1 peak 1333 volume 126.384 ppm1 2.227 ppm2 2.313
 
! ############### hot_mothernoesy_072403.1334 folded -
assi (attr store1 < 2.206 and attr store1 > 2.006 )
     ((attr store1 < 2.281 and attr store1 > 2.181 ) and 
      (bondedto (attr store1 < 132.888810435  and attr store1 > 131.688810435 ) or 
       bondedto (attr store1 < 37.4090631883  and attr store1 > 36.2090631883 ))) 
6 0.1 0.1 peak 1334 volume 26.2471 ppm1 2.231 ppm2 2.106
 
! ############### hot_mothernoesy_072403.1335 folded -
assi (attr store1 < 2.123 and attr store1 > 1.923 )
     ((attr store1 < 2.282 and attr store1 > 2.182 ) and 
      (bondedto (attr store1 < 132.911810435  and attr store1 > 131.711810435 ) or 
       bondedto (attr store1 < 37.4320631883  and attr store1 > 36.2320631883 ))) 
6 0.1 0.1 peak 1335 volume 22.0144 ppm1 2.232 ppm2 2.023
 
! ############### hot_mothernoesy_072403.1336 folded -
assi (attr store1 < 4.255 and attr store1 > 4.055 )
     ((attr store1 < 2.274 and attr store1 > 2.174 ) and 
      (bondedto (attr store1 < 132.912810435  and attr store1 > 131.712810435 ) or 
       bondedto (attr store1 < 37.4330631883  and attr store1 > 36.2330631883 ))) 
6 0.1 0.1 peak 1336 volume 7.7387 ppm1 2.224 ppm2 4.155
 
! ############### hot_mothernoesy_072403.1337 folded -
assi (attr store1 < 2.415 and attr store1 > 2.215 )
     ((attr store1 < 2.155 and attr store1 > 2.055 ) and 
      (bondedto (attr store1 < 132.887810435  and attr store1 > 131.687810435 ) or 
       bondedto (attr store1 < 37.4080631883  and attr store1 > 36.2080631883 ))) 
6 0.1 0.1 peak 1337 volume 6.3315 ppm1 2.105 ppm2 2.315
 
! ############### hot_mothernoesy_072403.1340 folded -
assi (attr store1 < 2.374 and attr store1 > 2.174 )
     ((attr store1 < 2.425 and attr store1 > 2.325 ) and 
      (bondedto (attr store1 < 132.637810435  and attr store1 > 131.437810435 ) or 
       bondedto (attr store1 < 37.1580631883  and attr store1 > 35.9580631883 ))) 
6 0.1 0.1 peak 1340 volume 110.5969 ppm1 2.375 ppm2 2.274
 
! ############### hot_mothernoesy_072403.1341 folded -
assi (attr store1 < 4.11 and attr store1 > 3.91 )
     ((attr store1 < 2.328 and attr store1 > 2.228 ) and 
      (bondedto (attr store1 < 132.660810435  and attr store1 > 131.460810435 ) or 
       bondedto (attr store1 < 37.1810631883  and attr store1 > 35.9810631883 ))) 
6 0.1 0.1 peak 1341 volume 8.699 ppm1 2.278 ppm2 4.010
 
! ############### hot_mothernoesy_072403.1342 folded -
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 2.32 and attr store1 > 2.22 ) and 
      (bondedto (attr store1 < 132.644810435  and attr store1 > 131.444810435 ) or 
       bondedto (attr store1 < 37.1650631883  and attr store1 > 35.9650631883 ))) 
6 0.1 0.1 peak 1342 volume 3.1866 ppm1 2.270 ppm2 4.772
 
! ############### hot_mothernoesy_072403.1343 folded -
assi (attr store1 < 2.472 and attr store1 > 2.272 )
     ((attr store1 < 2.324 and attr store1 > 2.224 ) and 
      (bondedto (attr store1 < 132.640810435  and attr store1 > 131.440810435 ) or 
       bondedto (attr store1 < 37.1610631883  and attr store1 > 35.9610631883 ))) 
6 0.1 0.1 peak 1343 volume 105.1667 ppm1 2.274 ppm2 2.372
 
! ############### hot_mothernoesy_072403.1344 folded +
assi (attr store1 < 3.989 and attr store1 > 3.789 )
     ((attr store1 < 3.939 and attr store1 > 3.839 ) and 
      (bondedto (attr store1 < 108.726873623  and attr store1 > 107.526873623 ) or 
       bondedto (attr store1 < 60.987  and attr store1 > 59.787 ) or 
       bondedto (attr store1 < 13.2471263766  and attr store1 > 12.0471263766 ))) 
6 0.1 0.1 peak 1344 volume 26.38210 ppm1 3.889 ppm2 3.889
 
! ############### hot_mothernoesy_072403.1345 folded +
assi (attr store1 < 2.017 and attr store1 > 1.817 )
     ((attr store1 < 3.936 and attr store1 > 3.836 ) and 
      (bondedto (attr store1 < 108.732873623  and attr store1 > 107.532873623 ) or 
       bondedto (attr store1 < 60.993  and attr store1 > 59.793 ) or 
       bondedto (attr store1 < 13.2531263766  and attr store1 > 12.0531263766 ))) 
6 0.1 0.1 peak 1345 volume 15.10090 ppm1 3.886 ppm2 1.917
 
! ############### hot_mothernoesy_072403.1346 folded +
assi (attr store1 < 1.687 and attr store1 > 1.487 )
     ((attr store1 < 3.937 and attr store1 > 3.837 ) and 
      (bondedto (attr store1 < 108.751873623  and attr store1 > 107.551873623 ) or 
       bondedto (attr store1 < 61.012  and attr store1 > 59.812 ) or 
       bondedto (attr store1 < 13.2721263766  and attr store1 > 12.0721263766 ))) 
6 0.1 0.1 peak 1346 volume 4.98180 ppm1 3.887 ppm2 1.587
 
! ############### hot_mothernoesy_072403.1347 folded +
assi (attr store1 < 2.432 and attr store1 > 2.232 )
     ((attr store1 < 0.926 and attr store1 > 0.826 ) and 
      (bondedto (attr store1 < 108.748873623  and attr store1 > 107.548873623 ) or 
       bondedto (attr store1 < 61.009  and attr store1 > 59.809 ) or 
       bondedto (attr store1 < 13.2691263766  and attr store1 > 12.0691263766 ))) 
6 0.1 0.1 peak 1347 volume 7.87810 ppm1 0.876 ppm2 2.332
 
! ############### hot_mothernoesy_072403.1348 folded +
assi (attr store1 < 2.157 and attr store1 > 1.957 )
     ((attr store1 < 0.925 and attr store1 > 0.825 ) and 
      (bondedto (attr store1 < 108.750873623  and attr store1 > 107.550873623 ) or 
       bondedto (attr store1 < 61.011  and attr store1 > 59.811 ) or 
       bondedto (attr store1 < 13.2711263766  and attr store1 > 12.0711263766 ))) 
6 0.1 0.1 peak 1348 volume 8.63980 ppm1 0.875 ppm2 2.057
 
! ############### hot_mothernoesy_072403.1351 folded +
assi (attr store1 < 1.161 and attr store1 > 0.961 )
     ((attr store1 < 0.926 and attr store1 > 0.826 ) and 
      (bondedto (attr store1 < 108.757873623  and attr store1 > 107.557873623 ) or 
       bondedto (attr store1 < 61.018  and attr store1 > 59.818 ) or 
       bondedto (attr store1 < 13.2781263766  and attr store1 > 12.0781263766 ))) 
6 0.1 0.1 peak 1351 volume 83.38020 ppm1 0.876 ppm2 1.061
 
! ############### hot_mothernoesy_072403.1352 folded -
assi (attr store1 < 4.102 and attr store1 > 3.902 )
     ((attr store1 < 2.427 and attr store1 > 2.327 ) and 
      (bondedto (attr store1 < 132.566810435  and attr store1 > 131.366810435 ) or 
       bondedto (attr store1 < 37.0870631883  and attr store1 > 35.8870631883 ))) 
6 0.1 0.1 peak 1352 volume 10.5165 ppm1 2.377 ppm2 4.002
 
! ############### hot_mothernoesy_072403.1353 folded +
assi (attr store1 < 4.875 and attr store1 > 4.675 )
     ((attr store1 < 4.349 and attr store1 > 4.249 ) and 
      (bondedto (attr store1 < 108.617873623  and attr store1 > 107.417873623 ) or 
       bondedto (attr store1 < 60.878  and attr store1 > 59.678 ) or 
       bondedto (attr store1 < 13.1381263766  and attr store1 > 11.9381263766 ))) 
6 0.1 0.1 peak 1353 volume 4.61630 ppm1 4.299 ppm2 4.775
 
! ############### hot_mothernoesy_072403.1354 folded +
assi (attr store1 < 4.402 and attr store1 > 4.202 )
     ((attr store1 < 4.355 and attr store1 > 4.255 ) and 
      (bondedto (attr store1 < 108.659873623  and attr store1 > 107.459873623 ) or 
       bondedto (attr store1 < 60.92  and attr store1 > 59.72 ) or 
       bondedto (attr store1 < 13.1801263766  and attr store1 > 11.9801263766 ))) 
6 0.1 0.1 peak 1354 volume 34.52190 ppm1 4.305 ppm2 4.302
 
! ############### hot_mothernoesy_072403.1356 folded +
assi (attr store1 < 1.903 and attr store1 > 1.703 )
     ((attr store1 < 4.353 and attr store1 > 4.253 ) and 
      (bondedto (attr store1 < 108.630873623  and attr store1 > 107.430873623 ) or 
       bondedto (attr store1 < 60.891  and attr store1 > 59.691 ) or 
       bondedto (attr store1 < 13.1511263766  and attr store1 > 11.9511263766 ))) 
6 0.1 0.1 peak 1356 volume 3.75060 ppm1 4.303 ppm2 1.803
 
! ############### hot_mothernoesy_072403.1357 folded +
assi (attr store1 < 1.833 and attr store1 > 1.633 )
     ((attr store1 < 4.353 and attr store1 > 4.253 ) and 
      (bondedto (attr store1 < 108.661873623  and attr store1 > 107.461873623 ) or 
       bondedto (attr store1 < 60.922  and attr store1 > 59.722 ) or 
       bondedto (attr store1 < 13.1821263766  and attr store1 > 11.9821263766 ))) 
6 0.1 0.1 peak 1357 volume 3.85900 ppm1 4.303 ppm2 1.733
 
! ############### hot_mothernoesy_072403.1358 folded +
assi (attr store1 < 1.091 and attr store1 > 0.891 )
     ((attr store1 < 4.353 and attr store1 > 4.253 ) and 
      (bondedto (attr store1 < 108.654873623  and attr store1 > 107.454873623 ) or 
       bondedto (attr store1 < 60.915  and attr store1 > 59.715 ) or 
       bondedto (attr store1 < 13.1751263766  and attr store1 > 11.9751263766 ))) 
6 0.1 0.1 peak 1358 volume 4.48660 ppm1 4.303 ppm2 0.991
 
! ############### hot_mothernoesy_072403.1359 folded +
assi (attr store1 < 4.126 and attr store1 > 3.926 )
     ((attr store1 < 0.916 and attr store1 > 0.816 ) and 
      (bondedto (attr store1 < 108.565873623  and attr store1 > 107.365873623 ) or 
       bondedto (attr store1 < 60.826  and attr store1 > 59.626 ) or 
       bondedto (attr store1 < 13.0861263766  and attr store1 > 11.8861263766 ))) 
6 0.1 0.1 peak 1359 volume 3.39440 ppm1 0.866 ppm2 4.026
 
! ############### hot_mothernoesy_072403.1360 folded +
assi (attr store1 < 2.42 and attr store1 > 2.22 )
     ((attr store1 < 4.092 and attr store1 > 3.992 ) and 
      (bondedto (attr store1 < 108.393873623  and attr store1 > 107.193873623 ) or 
       bondedto (attr store1 < 60.654  and attr store1 > 59.454 ) or 
       bondedto (attr store1 < 12.9141263766  and attr store1 > 11.7141263766 ))) 
6 0.1 0.1 peak 1360 volume 8.77940 ppm1 4.042 ppm2 2.320
 
! ############### hot_mothernoesy_072403.1361 folded +
assi (attr store1 < 2.103 and attr store1 > 1.903 )
     ((attr store1 < 4.093 and attr store1 > 3.993 ) and 
      (bondedto (attr store1 < 108.393873623  and attr store1 > 107.193873623 ) or 
       bondedto (attr store1 < 60.654  and attr store1 > 59.454 ) or 
       bondedto (attr store1 < 12.9141263766  and attr store1 > 11.7141263766 ))) 
6 0.1 0.1 peak 1361 volume 13.89840 ppm1 4.043 ppm2 2.003
 
! ############### hot_mothernoesy_072403.1362 folded +
assi (attr store1 < 1.569 and attr store1 > 1.369 )
     ((attr store1 < 4.094 and attr store1 > 3.994 ) and 
      (bondedto (attr store1 < 108.399873623  and attr store1 > 107.199873623 ) or 
       bondedto (attr store1 < 60.66  and attr store1 > 59.46 ) or 
       bondedto (attr store1 < 12.9201263766  and attr store1 > 11.7201263766 ))) 
6 0.1 0.1 peak 1362 volume 14.69430 ppm1 4.044 ppm2 1.469
 
! ############### hot_mothernoesy_072403.1363 folded +
assi (attr store1 < 1.144 and attr store1 > 0.944 )
     ((attr store1 < 4.096 and attr store1 > 3.996 ) and 
      (bondedto (attr store1 < 108.433873623  and attr store1 > 107.233873623 ) or 
       bondedto (attr store1 < 60.694  and attr store1 > 59.494 ) or 
       bondedto (attr store1 < 12.9541263766  and attr store1 > 11.7541263766 ))) 
6 0.1 0.1 peak 1363 volume 3.17480 ppm1 4.046 ppm2 1.044
 
! ############### hot_mothernoesy_072403.1364 folded -
assi (attr store1 < 4.368 and attr store1 > 4.168 )
     ((attr store1 < 4.308 and attr store1 > 4.208 ) and 
      (bondedto (attr store1 < 132.339810435  and attr store1 > 131.139810435 ) or 
       bondedto (attr store1 < 36.8600631883  and attr store1 > 35.6600631883 ))) 
6 0.1 0.1 peak 1364 volume 4.7058 ppm1 4.258 ppm2 4.268
 
! ############### hot_mothernoesy_072403.1366 folded -
assi (attr store1 < 2.489 and attr store1 > 2.289 )
     ((attr store1 < 2.442 and attr store1 > 2.342 ) and 
      (bondedto (attr store1 < 132.334810435  and attr store1 > 131.134810435 ) or 
       bondedto (attr store1 < 36.8550631883  and attr store1 > 35.6550631883 ))) 
6 0.1 0.1 peak 1366 volume 164.4015 ppm1 2.392 ppm2 2.389
 
! ############### hot_mothernoesy_072403.1367 folded -
assi (attr store1 < 2.271 and attr store1 > 2.071 )
     ((attr store1 < 2.443 and attr store1 > 2.343 ) and 
      (bondedto (attr store1 < 132.303810435  and attr store1 > 131.103810435 ) or 
       bondedto (attr store1 < 36.8240631883  and attr store1 > 35.6240631883 ))) 
6 0.1 0.1 peak 1367 volume 76.4019 ppm1 2.393 ppm2 2.171
 
! ############### hot_mothernoesy_072403.1369 folded -
assi (attr store1 < 4.461 and attr store1 > 4.261 )
     ((attr store1 < 2.221 and attr store1 > 2.121 ) and 
      (bondedto (attr store1 < 132.279810435  and attr store1 > 131.079810435 ) or 
       bondedto (attr store1 < 36.8000631883  and attr store1 > 35.6000631883 ))) 
6 0.1 0.1 peak 1369 volume 3.5004 ppm1 2.171 ppm2 4.361
 
! ############### hot_mothernoesy_072403.1371 folded -
assi (attr store1 < 2.493 and attr store1 > 2.293 )
     ((attr store1 < 2.219 and attr store1 > 2.119 ) and 
      (bondedto (attr store1 < 132.303810435  and attr store1 > 131.103810435 ) or 
       bondedto (attr store1 < 36.8240631883  and attr store1 > 35.6240631883 ))) 
6 0.1 0.1 peak 1371 volume 61.3858 ppm1 2.169 ppm2 2.393
 
! ############### hot_mothernoesy_072403.1372 folded -
assi (attr store1 < 2.27 and attr store1 > 2.07 )
     ((attr store1 < 2.219 and attr store1 > 2.119 ) and 
      (bondedto (attr store1 < 132.298810435  and attr store1 > 131.098810435 ) or 
       bondedto (attr store1 < 36.8190631883  and attr store1 > 35.6190631883 ))) 
6 0.1 0.1 peak 1372 volume 128.13789 ppm1 2.169 ppm2 2.170
 
! ############### hot_mothernoesy_072403.1373 folded -
assi (attr store1 < 2.128 and attr store1 > 1.928 )
     ((attr store1 < 2.22 and attr store1 > 2.12 ) and 
      (bondedto (attr store1 < 132.297810435  and attr store1 > 131.097810435 ) or 
       bondedto (attr store1 < 36.8180631883  and attr store1 > 35.6180631883 ))) 
6 0.1 0.1 peak 1373 volume 21.8104 ppm1 2.170 ppm2 2.028
 
! ############### hot_mothernoesy_072403.1375 folded +
assi (attr store1 < 1.998 and attr store1 > 1.798 )
     ((attr store1 < 4.249 and attr store1 > 4.149 ) and 
      (bondedto (attr store1 < 108.328873623  and attr store1 > 107.128873623 ) or 
       bondedto (attr store1 < 60.589  and attr store1 > 59.389 ) or 
       bondedto (attr store1 < 12.8491263766  and attr store1 > 11.6491263766 ))) 
6 0.1 0.1 peak 1375 volume 10.26040 ppm1 4.199 ppm2 1.898
 
! ############### hot_mothernoesy_072403.1376 folded +
assi (attr store1 < 1.454 and attr store1 > 1.254 )
     ((attr store1 < 4.246 and attr store1 > 4.146 ) and 
      (bondedto (attr store1 < 108.315873623  and attr store1 > 107.115873623 ) or 
       bondedto (attr store1 < 60.576  and attr store1 > 59.376 ) or 
       bondedto (attr store1 < 12.8361263766  and attr store1 > 11.6361263766 ))) 
6 0.1 0.1 peak 1376 volume 3.65220 ppm1 4.196 ppm2 1.354
 
! ############### hot_mothernoesy_072403.1377 folded +
assi (attr store1 < 4.143 and attr store1 > 3.943 )
     ((attr store1 < 4.092 and attr store1 > 3.992 ) and 
      (bondedto (attr store1 < 108.385873623  and attr store1 > 107.185873623 ) or 
       bondedto (attr store1 < 60.646  and attr store1 > 59.446 ) or 
       bondedto (attr store1 < 12.9061263766  and attr store1 > 11.7061263766 ))) 
6 0.1 0.1 peak 1377 volume 64.11790 ppm1 4.042 ppm2 4.043
 
! ############### hot_mothernoesy_072403.1378 folded +
assi (attr store1 < 2.55 and attr store1 > 2.35 )
     ((attr store1 < 4.097 and attr store1 > 3.997 ) and 
      (bondedto (attr store1 < 108.376873623  and attr store1 > 107.176873623 ) or 
       bondedto (attr store1 < 60.637  and attr store1 > 59.437 ) or 
       bondedto (attr store1 < 12.8971263766  and attr store1 > 11.6971263766 ))) 
6 0.1 0.1 peak 1378 volume 4.57480 ppm1 4.047 ppm2 2.450
 
! ############### hot_mothernoesy_072403.1379 folded +
assi (attr store1 < 2.166 and attr store1 > 1.966 )
     ((attr store1 < 4.095 and attr store1 > 3.995 ) and 
      (bondedto (attr store1 < 108.371873623  and attr store1 > 107.171873623 ) or 
       bondedto (attr store1 < 60.632  and attr store1 > 59.432 ) or 
       bondedto (attr store1 < 12.8921263766  and attr store1 > 11.6921263766 ))) 
6 0.1 0.1 peak 1379 volume 14.14310 ppm1 4.045 ppm2 2.066
 
! ############### hot_mothernoesy_072403.1380 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 4.247 and attr store1 > 4.147 ) and 
      (bondedto (attr store1 < 108.285873623  and attr store1 > 107.085873623 ) or 
       bondedto (attr store1 < 60.546  and attr store1 > 59.346 ) or 
       bondedto (attr store1 < 12.8061263766  and attr store1 > 11.6061263766 ))) 
6 0.1 0.1 peak 1380 volume 4.82820 ppm1 4.197 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1381 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 2.382 and attr store1 > 2.282 ) and 
      (bondedto (attr store1 < 132.108810435  and attr store1 > 130.908810435 ) or 
       bondedto (attr store1 < 36.6290631883  and attr store1 > 35.4290631883 ))) 
6 0.1 0.1 peak 1381 volume 8.3581 ppm1 2.332 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1382 folded -
assi (attr store1 < 3.773 and attr store1 > 3.573 )
     ((attr store1 < 2.384 and attr store1 > 2.284 ) and 
      (bondedto (attr store1 < 132.105810435  and attr store1 > 130.905810435 ) or 
       bondedto (attr store1 < 36.6260631883  and attr store1 > 35.4260631883 ))) 
6 0.1 0.1 peak 1382 volume 11.9816 ppm1 2.334 ppm2 3.673
 
! ############### hot_mothernoesy_072403.1383 folded -
assi (attr store1 < 2.432 and attr store1 > 2.232 )
     ((attr store1 < 2.383 and attr store1 > 2.283 ) and 
      (bondedto (attr store1 < 132.109810435  and attr store1 > 130.909810435 ) or 
       bondedto (attr store1 < 36.6300631883  and attr store1 > 35.4300631883 ))) 
6 0.1 0.1 peak 1383 volume 541.36719 ppm1 2.333 ppm2 2.332
 
! ############### hot_mothernoesy_072403.1384 folded -
assi (attr store1 < 2.24 and attr store1 > 2.04 )
     ((attr store1 < 2.385 and attr store1 > 2.285 ) and 
      (bondedto (attr store1 < 132.101810435  and attr store1 > 130.901810435 ) or 
       bondedto (attr store1 < 36.6220631883  and attr store1 > 35.4220631883 ))) 
6 0.1 0.1 peak 1384 volume 52.892 ppm1 2.335 ppm2 2.140
 
! ############### hot_mothernoesy_072403.1385 folded -
assi (attr store1 < 2.165 and attr store1 > 1.965 )
     ((attr store1 < 2.386 and attr store1 > 2.286 ) and 
      (bondedto (attr store1 < 132.109810435  and attr store1 > 130.909810435 ) or 
       bondedto (attr store1 < 36.6300631883  and attr store1 > 35.4300631883 ))) 
6 0.1 0.1 peak 1385 volume 47.0202 ppm1 2.336 ppm2 2.065
 
! ############### hot_mothernoesy_072403.1386 folded +
assi (attr store1 < 4.31 and attr store1 > 4.11 )
     ((attr store1 < 4.274 and attr store1 > 4.174 ) and 
      (bondedto (attr store1 < 108.204873623  and attr store1 > 107.004873623 ) or 
       bondedto (attr store1 < 60.465  and attr store1 > 59.265 ) or 
       bondedto (attr store1 < 12.7251263766  and attr store1 > 11.5251263766 ))) 
6 0.1 0.1 peak 1386 volume 20.87150 ppm1 4.224 ppm2 4.210
 
! ############### hot_mothernoesy_072403.1390 folded +
assi (attr store1 < 4.596 and attr store1 > 4.396 )
     ((attr store1 < 4.538 and attr store1 > 4.438 ) and 
      (bondedto (attr store1 < 108.071873623  and attr store1 > 106.871873623 ) or 
       bondedto (attr store1 < 60.332  and attr store1 > 59.132 ) or 
       bondedto (attr store1 < 12.5921263766  and attr store1 > 11.3921263766 ))) 
6 0.1 0.1 peak 1390 volume 23.23460 ppm1 4.488 ppm2 4.496
 
! ############### hot_mothernoesy_072403.1392 folded +
assi (attr store1 < 4.87 and attr store1 > 4.67 )
     ((attr store1 < 4.313 and attr store1 > 4.213 ) and 
      (bondedto (attr store1 < 108.087873623  and attr store1 > 106.887873623 ) or 
       bondedto (attr store1 < 60.348  and attr store1 > 59.148 ) or 
       bondedto (attr store1 < 12.6081263766  and attr store1 > 11.4081263766 ))) 
6 0.1 0.1 peak 1392 volume 3.18830 ppm1 4.263 ppm2 4.770
 
! ############### hot_mothernoesy_072403.1393 folded +
assi (attr store1 < 3.002 and attr store1 > 2.802 )
     ((attr store1 < 4.322 and attr store1 > 4.222 ) and 
      (bondedto (attr store1 < 107.975873623  and attr store1 > 106.775873623 ) or 
       bondedto (attr store1 < 60.236  and attr store1 > 59.036 ) or 
       bondedto (attr store1 < 12.4961263766  and attr store1 > 11.2961263766 ))) 
6 0.1 0.1 peak 1393 volume 7.48960 ppm1 4.272 ppm2 2.902
 
! ############### hot_mothernoesy_072403.1394 folded +
assi (attr store1 < 3.169 and attr store1 > 2.969 )
     ((attr store1 < 4.319 and attr store1 > 4.219 ) and 
      (bondedto (attr store1 < 107.985873623  and attr store1 > 106.785873623 ) or 
       bondedto (attr store1 < 60.246  and attr store1 > 59.046 ) or 
       bondedto (attr store1 < 12.5061263766  and attr store1 > 11.3061263766 ))) 
6 0.1 0.1 peak 1394 volume 4.71640 ppm1 4.269 ppm2 3.069
 
! ############### hot_mothernoesy_072403.1395 folded +
assi (attr store1 < 2.31 and attr store1 > 2.11 )
     ((attr store1 < 4.32 and attr store1 > 4.22 ) and 
      (bondedto (attr store1 < 107.969873623  and attr store1 > 106.769873623 ) or 
       bondedto (attr store1 < 60.23  and attr store1 > 59.03 ) or 
       bondedto (attr store1 < 12.4901263766  and attr store1 > 11.2901263766 ))) 
6 0.1 0.1 peak 1395 volume 3.90040 ppm1 4.270 ppm2 2.210
 
! ############### hot_mothernoesy_072403.1396 folded +
assi (attr store1 < 4.256 and attr store1 > 4.056 )
     ((attr store1 < 4.206 and attr store1 > 4.106 ) and 
      (bondedto (attr store1 < 107.935873623  and attr store1 > 106.735873623 ) or 
       bondedto (attr store1 < 60.196  and attr store1 > 58.996 ) or 
       bondedto (attr store1 < 12.4561263766  and attr store1 > 11.2561263766 ))) 
6 0.1 0.1 peak 1396 volume 86.73670 ppm1 4.156 ppm2 4.156
 
! ############### hot_mothernoesy_072403.1398 folded +
assi (attr store1 < 2.54 and attr store1 > 2.34 )
     ((attr store1 < 4.206 and attr store1 > 4.106 ) and 
      (bondedto (attr store1 < 107.965873623  and attr store1 > 106.765873623 ) or 
       bondedto (attr store1 < 60.226  and attr store1 > 59.026 ) or 
       bondedto (attr store1 < 12.4861263766  and attr store1 > 11.2861263766 ))) 
6 0.1 0.1 peak 1398 volume 3.98750 ppm1 4.156 ppm2 2.440
 
! ############### hot_mothernoesy_072403.1399 folded +
assi (attr store1 < 2.412 and attr store1 > 2.212 )
     ((attr store1 < 4.206 and attr store1 > 4.106 ) and 
      (bondedto (attr store1 < 107.948873623  and attr store1 > 106.748873623 ) or 
       bondedto (attr store1 < 60.209  and attr store1 > 59.009 ) or 
       bondedto (attr store1 < 12.4691263766  and attr store1 > 11.2691263766 ))) 
6 0.1 0.1 peak 1399 volume 9.58370 ppm1 4.156 ppm2 2.312
 
! ############### hot_mothernoesy_072403.1400 folded +
assi (attr store1 < 2.321 and attr store1 > 2.121 )
     ((attr store1 < 4.205 and attr store1 > 4.105 ) and 
      (bondedto (attr store1 < 107.930873623  and attr store1 > 106.730873623 ) or 
       bondedto (attr store1 < 60.191  and attr store1 > 58.991 ) or 
       bondedto (attr store1 < 12.4511263766  and attr store1 > 11.2511263766 ))) 
6 0.1 0.1 peak 1400 volume 8.51660 ppm1 4.155 ppm2 2.221
 
! ############### hot_mothernoesy_072403.1401 folded +
assi (attr store1 < 2.207 and attr store1 > 2.007 )
     ((attr store1 < 4.205 and attr store1 > 4.105 ) and 
      (bondedto (attr store1 < 107.940873623  and attr store1 > 106.740873623 ) or 
       bondedto (attr store1 < 60.201  and attr store1 > 59.001 ) or 
       bondedto (attr store1 < 12.4611263766  and attr store1 > 11.2611263766 ))) 
6 0.1 0.1 peak 1401 volume 16.26020 ppm1 4.155 ppm2 2.107
 
! ############### hot_mothernoesy_072403.1402 folded +
assi (attr store1 < 2.12 and attr store1 > 1.92 )
     ((attr store1 < 4.207 and attr store1 > 4.107 ) and 
      (bondedto (attr store1 < 107.936873623  and attr store1 > 106.736873623 ) or 
       bondedto (attr store1 < 60.197  and attr store1 > 58.997 ) or 
       bondedto (attr store1 < 12.4571263766  and attr store1 > 11.2571263766 ))) 
6 0.1 0.1 peak 1402 volume 13.68530 ppm1 4.157 ppm2 2.020
 
! ############### hot_mothernoesy_072403.1403 folded -
assi (attr store1 < 2.558 and attr store1 > 2.358 )
     ((attr store1 < 2.371 and attr store1 > 2.271 ) and 
      (bondedto (attr store1 < 131.852810435  and attr store1 > 130.652810435 ) or 
       bondedto (attr store1 < 36.3730631883  and attr store1 > 35.1730631883 ))) 
6 0.1 0.1 peak 1403 volume 59.8667 ppm1 2.321 ppm2 2.458
 
! ############### hot_mothernoesy_072403.1405 folded +
assi (attr store1 < 4.074 and attr store1 > 3.874 )
     ((attr store1 < 4.022 and attr store1 > 3.922 ) and 
      (bondedto (attr store1 < 107.839873623  and attr store1 > 106.639873623 ) or 
       bondedto (attr store1 < 60.1  and attr store1 > 58.9 ) or 
       bondedto (attr store1 < 12.3601263766  and attr store1 > 11.1601263766 ))) 
6 0.1 0.1 peak 1405 volume 98.93490 ppm1 3.972 ppm2 3.974
 
! ############### hot_mothernoesy_072403.1406 folded +
assi (attr store1 < 3.312 and attr store1 > 3.112 )
     ((attr store1 < 4.023 and attr store1 > 3.923 ) and 
      (bondedto (attr store1 < 107.883873623  and attr store1 > 106.683873623 ) or 
       bondedto (attr store1 < 60.144  and attr store1 > 58.944 ) or 
       bondedto (attr store1 < 12.4041263766  and attr store1 > 11.2041263766 ))) 
6 0.1 0.1 peak 1406 volume 5.48290 ppm1 3.973 ppm2 3.212
 
! ############### hot_mothernoesy_072403.1407 folded +
assi (attr store1 < 2.487 and attr store1 > 2.287 )
     ((attr store1 < 4.024 and attr store1 > 3.924 ) and 
      (bondedto (attr store1 < 107.848873623  and attr store1 > 106.648873623 ) or 
       bondedto (attr store1 < 60.109  and attr store1 > 58.909 ) or 
       bondedto (attr store1 < 12.3691263766  and attr store1 > 11.1691263766 ))) 
6 0.1 0.1 peak 1407 volume 7.49770 ppm1 3.974 ppm2 2.387
 
! ############### hot_mothernoesy_072403.1408 folded +
assi (attr store1 < 2.274 and attr store1 > 2.074 )
     ((attr store1 < 4.027 and attr store1 > 3.927 ) and 
      (bondedto (attr store1 < 107.850873623  and attr store1 > 106.650873623 ) or 
       bondedto (attr store1 < 60.111  and attr store1 > 58.911 ) or 
       bondedto (attr store1 < 12.3711263766  and attr store1 > 11.1711263766 ))) 
6 0.1 0.1 peak 1408 volume 17.92830 ppm1 3.977 ppm2 2.174
 
! ############### hot_mothernoesy_072403.1409 folded +
assi (attr store1 < 2.397 and attr store1 > 2.197 )
     ((attr store1 < 4.017 and attr store1 > 3.917 ) and 
      (bondedto (attr store1 < 107.855873623  and attr store1 > 106.655873623 ) or 
       bondedto (attr store1 < 60.116  and attr store1 > 58.916 ) or 
       bondedto (attr store1 < 12.3761263766  and attr store1 > 11.1761263766 ))) 
6 0.1 0.1 peak 1409 volume 6.36870 ppm1 3.967 ppm2 2.297
 
! ############### hot_mothernoesy_072403.1410 folded +
assi (attr store1 < 2.037 and attr store1 > 1.837 )
     ((attr store1 < 4.019 and attr store1 > 3.919 ) and 
      (bondedto (attr store1 < 107.865873623  and attr store1 > 106.665873623 ) or 
       bondedto (attr store1 < 60.126  and attr store1 > 58.926 ) or 
       bondedto (attr store1 < 12.3861263766  and attr store1 > 11.1861263766 ))) 
6 0.1 0.1 peak 1410 volume 22.30750 ppm1 3.969 ppm2 1.937
 
! ############### hot_mothernoesy_072403.1411 folded +
assi (attr store1 < 1.877 and attr store1 > 1.677 )
     ((attr store1 < 4.019 and attr store1 > 3.919 ) and 
      (bondedto (attr store1 < 107.870873623  and attr store1 > 106.670873623 ) or 
       bondedto (attr store1 < 60.131  and attr store1 > 58.931 ) or 
       bondedto (attr store1 < 12.3911263766  and attr store1 > 11.1911263766 ))) 
6 0.1 0.1 peak 1411 volume 7.58020 ppm1 3.969 ppm2 1.777
 
! ############### hot_mothernoesy_072403.1412 folded +
assi (attr store1 < 1.708 and attr store1 > 1.508 )
     ((attr store1 < 4.02 and attr store1 > 3.92 ) and 
      (bondedto (attr store1 < 107.866873623  and attr store1 > 106.666873623 ) or 
       bondedto (attr store1 < 60.127  and attr store1 > 58.927 ) or 
       bondedto (attr store1 < 12.3871263766  and attr store1 > 11.1871263766 ))) 
6 0.1 0.1 peak 1412 volume 8.50560 ppm1 3.970 ppm2 1.608
 
! ############### hot_mothernoesy_072403.1413 folded +
assi (attr store1 < 1.24 and attr store1 > 1.04 )
     ((attr store1 < 4.017 and attr store1 > 3.917 ) and 
      (bondedto (attr store1 < 107.860873623  and attr store1 > 106.660873623 ) or 
       bondedto (attr store1 < 60.121  and attr store1 > 58.921 ) or 
       bondedto (attr store1 < 12.3811263766  and attr store1 > 11.1811263766 ))) 
6 0.1 0.1 peak 1413 volume 8.22200 ppm1 3.967 ppm2 1.140
 
! ############### hot_mothernoesy_072403.1414 folded +
assi (attr store1 < 1.103 and attr store1 > 0.903 )
     ((attr store1 < 4.015 and attr store1 > 3.915 ) and 
      (bondedto (attr store1 < 107.891873623  and attr store1 > 106.691873623 ) or 
       bondedto (attr store1 < 60.152  and attr store1 > 58.952 ) or 
       bondedto (attr store1 < 12.4121263766  and attr store1 > 11.2121263766 ))) 
6 0.1 0.1 peak 1414 volume 3.99370 ppm1 3.965 ppm2 1.003
 
! ############### hot_mothernoesy_072403.1415 folded -
assi (attr store1 < 4.413 and attr store1 > 4.213 )
     ((attr store1 < 2.52 and attr store1 > 2.42 ) and 
      (bondedto (attr store1 < 131.775810435  and attr store1 > 130.575810435 ) or 
       bondedto (attr store1 < 36.2960631883  and attr store1 > 35.0960631883 ))) 
6 0.1 0.1 peak 1415 volume 6.2896 ppm1 2.470 ppm2 4.313
 
! ############### hot_mothernoesy_072403.1416 folded -
assi (attr store1 < 2.413 and attr store1 > 2.213 )
     ((attr store1 < 2.518 and attr store1 > 2.418 ) and 
      (bondedto (attr store1 < 131.794810435  and attr store1 > 130.594810435 ) or 
       bondedto (attr store1 < 36.3150631883  and attr store1 > 35.1150631883 ))) 
6 0.1 0.1 peak 1416 volume 62.7853 ppm1 2.468 ppm2 2.313
 
! ############### hot_mothernoesy_072403.1417 folded -
assi (attr store1 < 2.051 and attr store1 > 1.851 )
     ((attr store1 < 2.516 and attr store1 > 2.416 ) and 
      (bondedto (attr store1 < 131.782810435  and attr store1 > 130.582810435 ) or 
       bondedto (attr store1 < 36.3030631883  and attr store1 > 35.1030631883 ))) 
6 0.1 0.1 peak 1417 volume 13.7814 ppm1 2.466 ppm2 1.951
 
! ############### hot_mothernoesy_072403.1418 folded -
assi (attr store1 < 2.556 and attr store1 > 2.356 )
     ((attr store1 < 2.496 and attr store1 > 2.396 ) and 
      (bondedto (attr store1 < 131.737810435  and attr store1 > 130.537810435 ) or 
       bondedto (attr store1 < 36.2580631883  and attr store1 > 35.0580631883 ))) 
6 0.1 0.1 peak 1418 volume 81.6022 ppm1 2.446 ppm2 2.456
 
! ############### hot_mothernoesy_072403.1419 folded -
assi (attr store1 < 4.414 and attr store1 > 4.214 )
     ((attr store1 < 2.366 and attr store1 > 2.266 ) and 
      (bondedto (attr store1 < 131.769810435  and attr store1 > 130.569810435 ) or 
       bondedto (attr store1 < 36.2900631883  and attr store1 > 35.0900631883 ))) 
6 0.1 0.1 peak 1419 volume 7.0112 ppm1 2.316 ppm2 4.314
 
! ############### hot_mothernoesy_072403.1420 folded +
assi (attr store1 < 4.163 and attr store1 > 3.963 )
     ((attr store1 < 4.117 and attr store1 > 4.017 ) and 
      (bondedto (attr store1 < 107.487873623  and attr store1 > 106.287873623 ) or 
       bondedto (attr store1 < 59.748  and attr store1 > 58.548 ) or 
       bondedto (attr store1 < 12.0081263766  and attr store1 > 10.8081263766 ))) 
6 0.1 0.1 peak 1420 volume 43.21280 ppm1 4.067 ppm2 4.063
 
! ############### hot_mothernoesy_072403.1421 folded +
assi (attr store1 < 2.725 and attr store1 > 2.525 )
     ((attr store1 < 4.12 and attr store1 > 4.02 ) and 
      (bondedto (attr store1 < 107.502873623  and attr store1 > 106.302873623 ) or 
       bondedto (attr store1 < 59.763  and attr store1 > 58.563 ) or 
       bondedto (attr store1 < 12.0231263766  and attr store1 > 10.8231263766 ))) 
6 0.1 0.1 peak 1421 volume 5.93260 ppm1 4.070 ppm2 2.625
 
! ############### hot_mothernoesy_072403.1422 folded +
assi (attr store1 < 2.306 and attr store1 > 2.106 )
     ((attr store1 < 4.119 and attr store1 > 4.019 ) and 
      (bondedto (attr store1 < 107.512873623  and attr store1 > 106.312873623 ) or 
       bondedto (attr store1 < 59.773  and attr store1 > 58.573 ) or 
       bondedto (attr store1 < 12.0331263766  and attr store1 > 10.8331263766 ))) 
6 0.1 0.1 peak 1422 volume 7.55310 ppm1 4.069 ppm2 2.206
 
! ############### hot_mothernoesy_072403.1423 folded +
assi (attr store1 < 2.216 and attr store1 > 2.016 )
     ((attr store1 < 4.117 and attr store1 > 4.017 ) and 
      (bondedto (attr store1 < 107.497873623  and attr store1 > 106.297873623 ) or 
       bondedto (attr store1 < 59.758  and attr store1 > 58.558 ) or 
       bondedto (attr store1 < 12.0181263766  and attr store1 > 10.8181263766 ))) 
6 0.1 0.1 peak 1423 volume 10.97390 ppm1 4.067 ppm2 2.116
 
! ############### hot_mothernoesy_072403.1424 folded +
assi (attr store1 < 1.968 and attr store1 > 1.768 )
     ((attr store1 < 4.119 and attr store1 > 4.019 ) and 
      (bondedto (attr store1 < 107.509873623  and attr store1 > 106.309873623 ) or 
       bondedto (attr store1 < 59.77  and attr store1 > 58.57 ) or 
       bondedto (attr store1 < 12.0301263766  and attr store1 > 10.8301263766 ))) 
6 0.1 0.1 peak 1424 volume 8.81810 ppm1 4.069 ppm2 1.868
 
! ############### hot_mothernoesy_072403.1425 folded +
assi (attr store1 < 1.127 and attr store1 > 0.927 )
     ((attr store1 < 4.122 and attr store1 > 4.022 ) and 
      (bondedto (attr store1 < 107.504873623  and attr store1 > 106.304873623 ) or 
       bondedto (attr store1 < 59.765  and attr store1 > 58.565 ) or 
       bondedto (attr store1 < 12.0251263766  and attr store1 > 10.8251263766 ))) 
6 0.1 0.1 peak 1425 volume 6.76840 ppm1 4.072 ppm2 1.027
 
! ############### hot_mothernoesy_072403.1426 folded +
assi (attr store1 < 3.813 and attr store1 > 3.613 )
     ((attr store1 < 3.767 and attr store1 > 3.667 ) and 
      (bondedto (attr store1 < 107.461873623  and attr store1 > 106.261873623 ) or 
       bondedto (attr store1 < 59.722  and attr store1 > 58.522 ) or 
       bondedto (attr store1 < 11.9821263766  and attr store1 > 10.7821263766 ))) 
6 0.1 0.1 peak 1426 volume 10.43560 ppm1 3.717 ppm2 3.713
 
! ############### hot_mothernoesy_072403.1427 folded +
assi (attr store1 < 4.109 and attr store1 > 3.909 )
     ((attr store1 < 4.064 and attr store1 > 3.964 ) and 
      (bondedto (attr store1 < 107.332873623  and attr store1 > 106.132873623 ) or 
       bondedto (attr store1 < 59.593  and attr store1 > 58.393 ) or 
       bondedto (attr store1 < 11.8531263766  and attr store1 > 10.6531263766 ))) 
6 0.1 0.1 peak 1427 volume 79.57210 ppm1 4.014 ppm2 4.009
 
! ############### hot_mothernoesy_072403.1428 folded +
assi (attr store1 < 2.471 and attr store1 > 2.271 )
     ((attr store1 < 4.057 and attr store1 > 3.957 ) and 
      (bondedto (attr store1 < 107.322873623  and attr store1 > 106.122873623 ) or 
       bondedto (attr store1 < 59.583  and attr store1 > 58.383 ) or 
       bondedto (attr store1 < 11.8431263766  and attr store1 > 10.6431263766 ))) 
6 0.1 0.1 peak 1428 volume 7.88070 ppm1 4.007 ppm2 2.371
 
! ############### hot_mothernoesy_072403.1429 folded +
assi (attr store1 < 2.372 and attr store1 > 2.172 )
     ((attr store1 < 4.056 and attr store1 > 3.956 ) and 
      (bondedto (attr store1 < 107.325873623  and attr store1 > 106.125873623 ) or 
       bondedto (attr store1 < 59.586  and attr store1 > 58.386 ) or 
       bondedto (attr store1 < 11.8461263766  and attr store1 > 10.6461263766 ))) 
6 0.1 0.1 peak 1429 volume 10.39180 ppm1 4.006 ppm2 2.272
 
! ############### hot_mothernoesy_072403.1430 folded +
assi (attr store1 < 2.191 and attr store1 > 1.991 )
     ((attr store1 < 4.056 and attr store1 > 3.956 ) and 
      (bondedto (attr store1 < 107.336873623  and attr store1 > 106.136873623 ) or 
       bondedto (attr store1 < 59.597  and attr store1 > 58.397 ) or 
       bondedto (attr store1 < 11.8571263766  and attr store1 > 10.6571263766 ))) 
6 0.1 0.1 peak 1430 volume 14.52010 ppm1 4.006 ppm2 2.091
 
! ############### hot_mothernoesy_072403.1431 folded +
assi (attr store1 < 1.945 and attr store1 > 1.745 )
     ((attr store1 < 4.059 and attr store1 > 3.959 ) and 
      (bondedto (attr store1 < 107.350873623  and attr store1 > 106.150873623 ) or 
       bondedto (attr store1 < 59.611  and attr store1 > 58.411 ) or 
       bondedto (attr store1 < 11.8711263766  and attr store1 > 10.6711263766 ))) 
6 0.1 0.1 peak 1431 volume 8.16200 ppm1 4.009 ppm2 1.845
 
! ############### hot_mothernoesy_072403.1432 folded +
assi (attr store1 < 1.466 and attr store1 > 1.266 )
     ((attr store1 < 4.054 and attr store1 > 3.954 ) and 
      (bondedto (attr store1 < 107.318873623  and attr store1 > 106.118873623 ) or 
       bondedto (attr store1 < 59.579  and attr store1 > 58.379 ) or 
       bondedto (attr store1 < 11.8391263766  and attr store1 > 10.6391263766 ))) 
6 0.1 0.1 peak 1432 volume 3.73830 ppm1 4.004 ppm2 1.366
 
! ############### hot_mothernoesy_072403.1433 folded +
assi (attr store1 < 1.992 and attr store1 > 1.792 )
     ((attr store1 < 4.043 and attr store1 > 3.943 ) and 
      (bondedto (attr store1 < 107.296873623  and attr store1 > 106.096873623 ) or 
       bondedto (attr store1 < 59.557  and attr store1 > 58.357 ) or 
       bondedto (attr store1 < 11.8171263766  and attr store1 > 10.6171263766 ))) 
6 0.1 0.1 peak 1433 volume 7.08680 ppm1 3.993 ppm2 1.892
 
! ############### hot_mothernoesy_072403.1434 folded +
assi (attr store1 < 2.024 and attr store1 > 1.824 )
     ((attr store1 < 4.478 and attr store1 > 4.378 ) and 
      (bondedto (attr store1 < 107.095873623  and attr store1 > 105.895873623 ) or 
       bondedto (attr store1 < 59.356  and attr store1 > 58.156 ) or 
       bondedto (attr store1 < 11.6161263766  and attr store1 > 10.4161263766 ))) 
6 0.1 0.1 peak 1434 volume 3.24740 ppm1 4.428 ppm2 1.924
 
! ############### hot_mothernoesy_072403.1438 folded +
assi (attr store1 < 1.348 and attr store1 > 1.148 )
     ((attr store1 < 4.374 and attr store1 > 4.274 ) and 
      (bondedto (attr store1 < 107.032873623  and attr store1 > 105.832873623 ) or 
       bondedto (attr store1 < 59.293  and attr store1 > 58.093 ) or 
       bondedto (attr store1 < 11.5531263766  and attr store1 > 10.3531263766 ))) 
6 0.1 0.1 peak 1438 volume 5.77260 ppm1 4.324 ppm2 1.248
 
! ############### hot_mothernoesy_072403.1439 folded +
assi (attr store1 < 1.144 and attr store1 > 0.944 )
     ((attr store1 < 4.376 and attr store1 > 4.276 ) and 
      (bondedto (attr store1 < 107.059873623  and attr store1 > 105.859873623 ) or 
       bondedto (attr store1 < 59.32  and attr store1 > 58.12 ) or 
       bondedto (attr store1 < 11.5801263766  and attr store1 > 10.3801263766 ))) 
6 0.1 0.1 peak 1439 volume 3.17260 ppm1 4.326 ppm2 1.044
 
! ############### hot_mothernoesy_072403.1440 folded +
assi (attr store1 < 3.165 and attr store1 > 2.965 )
     ((attr store1 < 4.368 and attr store1 > 4.268 ) and 
      (bondedto (attr store1 < 107.004873623  and attr store1 > 105.804873623 ) or 
       bondedto (attr store1 < 59.265  and attr store1 > 58.065 ) or 
       bondedto (attr store1 < 11.5251263766  and attr store1 > 10.3251263766 ))) 
6 0.1 0.1 peak 1440 volume 4.09550 ppm1 4.318 ppm2 3.065
 
! ############### hot_mothernoesy_072403.1441 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 4.5 and attr store1 > 4.4 ) and 
      (bondedto (attr store1 < 106.902873623  and attr store1 > 105.702873623 ) or 
       bondedto (attr store1 < 59.163  and attr store1 > 57.963 ) or 
       bondedto (attr store1 < 11.4231263766  and attr store1 > 10.2231263766 ))) 
6 0.1 0.1 peak 1441 volume 12.23100 ppm1 4.450 ppm2 4.772
 
! ############### hot_mothernoesy_072403.1442 folded +
assi (attr store1 < 4.091 and attr store1 > 3.891 )
     ((attr store1 < 4.501 and attr store1 > 4.401 ) and 
      (bondedto (attr store1 < 106.901873623  and attr store1 > 105.701873623 ) or 
       bondedto (attr store1 < 59.162  and attr store1 > 57.962 ) or 
       bondedto (attr store1 < 11.4221263766  and attr store1 > 10.2221263766 ))) 
6 0.1 0.1 peak 1442 volume 17.75230 ppm1 4.451 ppm2 3.991
 
! ############### hot_mothernoesy_072403.1443 folded +
assi (attr store1 < 2.195 and attr store1 > 1.995 )
     ((attr store1 < 4.5 and attr store1 > 4.4 ) and 
      (bondedto (attr store1 < 106.927873623  and attr store1 > 105.727873623 ) or 
       bondedto (attr store1 < 59.188  and attr store1 > 57.988 ) or 
       bondedto (attr store1 < 11.4481263766  and attr store1 > 10.2481263766 ))) 
6 0.1 0.1 peak 1443 volume 5.58170 ppm1 4.450 ppm2 2.095
 
! ############### hot_mothernoesy_072403.1444 folded +
assi (attr store1 < 3.365 and attr store1 > 3.165 )
     ((attr store1 < 4.369 and attr store1 > 4.269 ) and 
      (bondedto (attr store1 < 106.994873623  and attr store1 > 105.794873623 ) or 
       bondedto (attr store1 < 59.255  and attr store1 > 58.055 ) or 
       bondedto (attr store1 < 11.5151263766  and attr store1 > 10.3151263766 ))) 
6 0.1 0.1 peak 1444 volume 5.14070 ppm1 4.319 ppm2 3.265
 
! ############### hot_mothernoesy_072403.1445 folded +
assi (attr store1 < 1.345 and attr store1 > 1.145 )
     ((attr store1 < 3.958 and attr store1 > 3.858 ) and 
      (bondedto (attr store1 < 106.911873623  and attr store1 > 105.711873623 ) or 
       bondedto (attr store1 < 59.172  and attr store1 > 57.972 ) or 
       bondedto (attr store1 < 11.4321263766  and attr store1 > 10.2321263766 ))) 
6 0.1 0.1 peak 1445 volume 6.61600 ppm1 3.908 ppm2 1.245
 
! ############### hot_mothernoesy_072403.1446 folded +
assi (attr store1 < 1.041 and attr store1 > 0.841 )
     ((attr store1 < 3.955 and attr store1 > 3.855 ) and 
      (bondedto (attr store1 < 106.909873623  and attr store1 > 105.709873623 ) or 
       bondedto (attr store1 < 59.17  and attr store1 > 57.97 ) or 
       bondedto (attr store1 < 11.4301263766  and attr store1 > 10.2301263766 ))) 
6 0.1 0.1 peak 1446 volume 9.62820 ppm1 3.905 ppm2 0.941
 
! ############### hot_mothernoesy_072403.1447 folded -
assi (attr store1 < 2.498 and attr store1 > 2.298 )
     ((attr store1 < 2.219 and attr store1 > 2.119 ) and 
      (bondedto (attr store1 < 130.847810435  and attr store1 > 129.647810435 ) or 
       bondedto (attr store1 < 35.3680631883  and attr store1 > 34.1680631883 ))) 
6 0.1 0.1 peak 1447 volume 8.8067 ppm1 2.169 ppm2 2.398
 
! ############### hot_mothernoesy_072403.1448 folded -
assi (attr store1 < 2.268 and attr store1 > 2.068 )
     ((attr store1 < 2.213 and attr store1 > 2.113 ) and 
      (bondedto (attr store1 < 130.855810435  and attr store1 > 129.655810435 ) or 
       bondedto (attr store1 < 35.3760631883  and attr store1 > 34.1760631883 ))) 
6 0.1 0.1 peak 1448 volume 14.473 ppm1 2.163 ppm2 2.168
 
! ############### hot_mothernoesy_072403.1449 folded +
assi (attr store1 < 4.273 and attr store1 > 4.073 )
     ((attr store1 < 4.503 and attr store1 > 4.403 ) and 
      (bondedto (attr store1 < 106.876873623  and attr store1 > 105.676873623 ) or 
       bondedto (attr store1 < 59.137  and attr store1 > 57.937 ) or 
       bondedto (attr store1 < 11.3971263766  and attr store1 > 10.1971263766 ))) 
6 0.1 0.1 peak 1449 volume 17.53330 ppm1 4.453 ppm2 4.173
 
! ############### hot_mothernoesy_072403.1450 folded +
assi (attr store1 < 0.886 and attr store1 > 0.686 )
     ((attr store1 < 3.956 and attr store1 > 3.856 ) and 
      (bondedto (attr store1 < 106.881873623  and attr store1 > 105.681873623 ) or 
       bondedto (attr store1 < 59.142  and attr store1 > 57.942 ) or 
       bondedto (attr store1 < 11.4021263766  and attr store1 > 10.2021263766 ))) 
6 0.1 0.1 peak 1450 volume 3.21850 ppm1 3.906 ppm2 0.786
 
! ############### hot_mothernoesy_072403.1451 folded +
assi (attr store1 < 1.824 and attr store1 > 1.624 )
     ((attr store1 < 1.895 and attr store1 > 1.795 ) and 
      (bondedto (attr store1 < 106.723873623  and attr store1 > 105.523873623 ) or 
       bondedto (attr store1 < 58.984  and attr store1 > 57.784 ) or 
       bondedto (attr store1 < 11.2441263766  and attr store1 > 10.0441263766 ))) 
6 0.1 0.1 peak 1451 volume 46.29510 ppm1 1.845 ppm2 1.724
 
! ############### hot_mothernoesy_072403.1452 folded +
assi (attr store1 < 4.234 and attr store1 > 4.034 )
     ((attr store1 < 4.184 and attr store1 > 4.084 ) and 
      (bondedto (attr store1 < 106.658873623  and attr store1 > 105.458873623 ) or 
       bondedto (attr store1 < 58.919  and attr store1 > 57.719 ) or 
       bondedto (attr store1 < 11.1791263766  and attr store1 > 9.9791263766 ))) 
6 0.1 0.1 peak 1452 volume 59.45140 ppm1 4.134 ppm2 4.134
 
! ############### hot_mothernoesy_072403.1453 folded +
assi (attr store1 < 2.647 and attr store1 > 2.447 )
     ((attr store1 < 4.188 and attr store1 > 4.088 ) and 
      (bondedto (attr store1 < 106.675873623  and attr store1 > 105.475873623 ) or 
       bondedto (attr store1 < 58.936  and attr store1 > 57.736 ) or 
       bondedto (attr store1 < 11.1961263766  and attr store1 > 9.9961263766 ))) 
6 0.1 0.1 peak 1453 volume 5.08050 ppm1 4.138 ppm2 2.547
 
! ############### hot_mothernoesy_072403.1454 folded +
assi (attr store1 < 2.52 and attr store1 > 2.32 )
     ((attr store1 < 4.184 and attr store1 > 4.084 ) and 
      (bondedto (attr store1 < 106.644873623  and attr store1 > 105.444873623 ) or 
       bondedto (attr store1 < 58.905  and attr store1 > 57.705 ) or 
       bondedto (attr store1 < 11.1651263766  and attr store1 > 9.9651263766 ))) 
6 0.1 0.1 peak 1454 volume 7.59770 ppm1 4.134 ppm2 2.420
 
! ############### hot_mothernoesy_072403.1455 folded +
assi (attr store1 < 2.313 and attr store1 > 2.113 )
     ((attr store1 < 4.184 and attr store1 > 4.084 ) and 
      (bondedto (attr store1 < 106.655873623  and attr store1 > 105.455873623 ) or 
       bondedto (attr store1 < 58.916  and attr store1 > 57.716 ) or 
       bondedto (attr store1 < 11.1761263766  and attr store1 > 9.9761263766 ))) 
6 0.1 0.1 peak 1455 volume 14.25260 ppm1 4.134 ppm2 2.213
 
! ############### hot_mothernoesy_072403.1456 folded +
assi (attr store1 < 2.002 and attr store1 > 1.802 )
     ((attr store1 < 4.185 and attr store1 > 4.085 ) and 
      (bondedto (attr store1 < 106.655873623  and attr store1 > 105.455873623 ) or 
       bondedto (attr store1 < 58.916  and attr store1 > 57.716 ) or 
       bondedto (attr store1 < 11.1761263766  and attr store1 > 9.9761263766 ))) 
6 0.1 0.1 peak 1456 volume 4.53850 ppm1 4.135 ppm2 1.902
 
! ############### hot_mothernoesy_072403.1457 folded +
assi (attr store1 < 1.091 and attr store1 > 0.891 )
     ((attr store1 < 4.183 and attr store1 > 4.083 ) and 
      (bondedto (attr store1 < 106.645873623  and attr store1 > 105.445873623 ) or 
       bondedto (attr store1 < 58.906  and attr store1 > 57.706 ) or 
       bondedto (attr store1 < 11.1661263766  and attr store1 > 9.9661263766 ))) 
6 0.1 0.1 peak 1457 volume 7.39290 ppm1 4.133 ppm2 0.991
 
! ############### hot_mothernoesy_072403.1458 folded +
assi (attr store1 < 2.19 and attr store1 > 1.99 )
     ((attr store1 < 4.025 and attr store1 > 3.925 ) and 
      (bondedto (attr store1 < 106.644873623  and attr store1 > 105.444873623 ) or 
       bondedto (attr store1 < 58.905  and attr store1 > 57.705 ) or 
       bondedto (attr store1 < 11.1651263766  and attr store1 > 9.9651263766 ))) 
6 0.1 0.1 peak 1458 volume 12.24950 ppm1 3.975 ppm2 2.090
 
! ############### hot_mothernoesy_072403.1459 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 4.011 and attr store1 > 3.911 ) and 
      (bondedto (attr store1 < 106.675873623  and attr store1 > 105.475873623 ) or 
       bondedto (attr store1 < 58.936  and attr store1 > 57.736 ) or 
       bondedto (attr store1 < 11.1961263766  and attr store1 > 9.9961263766 ))) 
6 0.1 0.1 peak 1459 volume 5.13650 ppm1 3.961 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1460 folded +
assi (attr store1 < 4.064 and attr store1 > 3.864 )
     ((attr store1 < 4.014 and attr store1 > 3.914 ) and 
      (bondedto (attr store1 < 106.662873623  and attr store1 > 105.462873623 ) or 
       bondedto (attr store1 < 58.923  and attr store1 > 57.723 ) or 
       bondedto (attr store1 < 11.1831263766  and attr store1 > 9.9831263766 ))) 
6 0.1 0.1 peak 1460 volume 81.07880 ppm1 3.964 ppm2 3.964
 
! ############### hot_mothernoesy_072403.1461 folded +
assi (attr store1 < 3.306 and attr store1 > 3.106 )
     ((attr store1 < 4.013 and attr store1 > 3.913 ) and 
      (bondedto (attr store1 < 106.655873623  and attr store1 > 105.455873623 ) or 
       bondedto (attr store1 < 58.916  and attr store1 > 57.716 ) or 
       bondedto (attr store1 < 11.1761263766  and attr store1 > 9.9761263766 ))) 
6 0.1 0.1 peak 1461 volume 5.46650 ppm1 3.963 ppm2 3.206
 
! ############### hot_mothernoesy_072403.1462 folded +
assi (attr store1 < 2.536 and attr store1 > 2.336 )
     ((attr store1 < 4.015 and attr store1 > 3.915 ) and 
      (bondedto (attr store1 < 106.688873623  and attr store1 > 105.488873623 ) or 
       bondedto (attr store1 < 58.949  and attr store1 > 57.749 ) or 
       bondedto (attr store1 < 11.2091263766  and attr store1 > 10.0091263766 ))) 
6 0.1 0.1 peak 1462 volume 13.98080 ppm1 3.965 ppm2 2.436
 
! ############### hot_mothernoesy_072403.1463 folded +
assi (attr store1 < 2.302 and attr store1 > 2.102 )
     ((attr store1 < 4.015 and attr store1 > 3.915 ) and 
      (bondedto (attr store1 < 106.689873623  and attr store1 > 105.489873623 ) or 
       bondedto (attr store1 < 58.95  and attr store1 > 57.75 ) or 
       bondedto (attr store1 < 11.2101263766  and attr store1 > 10.0101263766 ))) 
6 0.1 0.1 peak 1463 volume 13.93360 ppm1 3.965 ppm2 2.202
 
! ############### hot_mothernoesy_072403.1464 folded +
assi (attr store1 < 2.038 and attr store1 > 1.838 )
     ((attr store1 < 4.013 and attr store1 > 3.913 ) and 
      (bondedto (attr store1 < 106.666873623  and attr store1 > 105.466873623 ) or 
       bondedto (attr store1 < 58.927  and attr store1 > 57.727 ) or 
       bondedto (attr store1 < 11.1871263766  and attr store1 > 9.9871263766 ))) 
6 0.1 0.1 peak 1464 volume 14.17460 ppm1 3.963 ppm2 1.938
 
! ############### hot_mothernoesy_072403.1465 folded +
assi (attr store1 < 1.882 and attr store1 > 1.682 )
     ((attr store1 < 4.013 and attr store1 > 3.913 ) and 
      (bondedto (attr store1 < 106.657873623  and attr store1 > 105.457873623 ) or 
       bondedto (attr store1 < 58.918  and attr store1 > 57.718 ) or 
       bondedto (attr store1 < 11.1781263766  and attr store1 > 9.9781263766 ))) 
6 0.1 0.1 peak 1465 volume 4.25180 ppm1 3.963 ppm2 1.782
 
! ############### hot_mothernoesy_072403.1466 folded +
assi (attr store1 < 2.417 and attr store1 > 2.217 )
     ((attr store1 < 4.08 and attr store1 > 3.98 ) and 
      (bondedto (attr store1 < 106.572873623  and attr store1 > 105.372873623 ) or 
       bondedto (attr store1 < 58.833  and attr store1 > 57.633 ) or 
       bondedto (attr store1 < 11.0931263766  and attr store1 > 9.8931263766 ))) 
6 0.1 0.1 peak 1466 volume 12.06540 ppm1 4.030 ppm2 2.317
 
! ############### hot_mothernoesy_072403.1467 folded +
assi (attr store1 < 2.162 and attr store1 > 1.962 )
     ((attr store1 < 4.084 and attr store1 > 3.984 ) and 
      (bondedto (attr store1 < 106.543873623  and attr store1 > 105.343873623 ) or 
       bondedto (attr store1 < 58.804  and attr store1 > 57.604 ) or 
       bondedto (attr store1 < 11.0641263766  and attr store1 > 9.8641263766 ))) 
6 0.1 0.1 peak 1467 volume 13.89270 ppm1 4.034 ppm2 2.062
 
! ############### hot_mothernoesy_072403.1468 folded +
assi (attr store1 < 2.051 and attr store1 > 1.851 )
     ((attr store1 < 4.076 and attr store1 > 3.976 ) and 
      (bondedto (attr store1 < 106.563873623  and attr store1 > 105.363873623 ) or 
       bondedto (attr store1 < 58.824  and attr store1 > 57.624 ) or 
       bondedto (attr store1 < 11.0841263766  and attr store1 > 9.8841263766 ))) 
6 0.1 0.1 peak 1468 volume 9.57180 ppm1 4.026 ppm2 1.951
 
! ############### hot_mothernoesy_072403.1469 folded +
assi (attr store1 < 4.119 and attr store1 > 3.919 )
     ((attr store1 < 4.07 and attr store1 > 3.97 ) and 
      (bondedto (attr store1 < 106.548873623  and attr store1 > 105.348873623 ) or 
       bondedto (attr store1 < 58.809  and attr store1 > 57.609 ) or 
       bondedto (attr store1 < 11.0691263766  and attr store1 > 9.8691263766 ))) 
6 0.1 0.1 peak 1469 volume 67.39650 ppm1 4.020 ppm2 4.019
 
! ############### hot_mothernoesy_072403.1470 folded +
assi (attr store1 < 3.987 and attr store1 > 3.787 )
     ((attr store1 < 3.936 and attr store1 > 3.836 ) and 
      (bondedto (attr store1 < 106.572873623  and attr store1 > 105.372873623 ) or 
       bondedto (attr store1 < 58.833  and attr store1 > 57.633 ) or 
       bondedto (attr store1 < 11.0931263766  and attr store1 > 9.8931263766 ))) 
6 0.1 0.1 peak 1470 volume 55.39150 ppm1 3.886 ppm2 3.887
 
! ############### hot_mothernoesy_072403.1471 folded +
assi (attr store1 < 3.308 and attr store1 > 3.108 )
     ((attr store1 < 3.938 and attr store1 > 3.838 ) and 
      (bondedto (attr store1 < 106.539873623  and attr store1 > 105.339873623 ) or 
       bondedto (attr store1 < 58.8  and attr store1 > 57.6 ) or 
       bondedto (attr store1 < 11.0601263766  and attr store1 > 9.8601263766 ))) 
6 0.1 0.1 peak 1471 volume 6.04570 ppm1 3.888 ppm2 3.208
 
! ############### hot_mothernoesy_072403.1472 folded +
assi (attr store1 < 2.06 and attr store1 > 1.86 )
     ((attr store1 < 3.939 and attr store1 > 3.839 ) and 
      (bondedto (attr store1 < 106.539873623  and attr store1 > 105.339873623 ) or 
       bondedto (attr store1 < 58.8  and attr store1 > 57.6 ) or 
       bondedto (attr store1 < 11.0601263766  and attr store1 > 9.8601263766 ))) 
6 0.1 0.1 peak 1472 volume 18.93860 ppm1 3.889 ppm2 1.960
 
! ############### hot_mothernoesy_072403.1473 folded +
assi (attr store1 < 1.821 and attr store1 > 1.621 )
     ((attr store1 < 3.936 and attr store1 > 3.836 ) and 
      (bondedto (attr store1 < 106.529873623  and attr store1 > 105.329873623 ) or 
       bondedto (attr store1 < 58.79  and attr store1 > 57.59 ) or 
       bondedto (attr store1 < 11.0501263766  and attr store1 > 9.8501263766 ))) 
6 0.1 0.1 peak 1473 volume 8.30420 ppm1 3.886 ppm2 1.721
 
! ############### hot_mothernoesy_072403.1474 folded +
assi (attr store1 < 3.305 and attr store1 > 3.105 )
     ((attr store1 < 4.063 and attr store1 > 3.963 ) and 
      (bondedto (attr store1 < 106.520873623  and attr store1 > 105.320873623 ) or 
       bondedto (attr store1 < 58.781  and attr store1 > 57.581 ) or 
       bondedto (attr store1 < 11.0411263766  and attr store1 > 9.8411263766 ))) 
6 0.1 0.1 peak 1474 volume 5.12560 ppm1 4.013 ppm2 3.205
 
! ############### hot_mothernoesy_072403.1475 folded +
assi (attr store1 < 3.975 and attr store1 > 3.775 )
     ((attr store1 < 4.559 and attr store1 > 4.459 ) and 
      (bondedto (attr store1 < 106.420873623  and attr store1 > 105.220873623 ) or 
       bondedto (attr store1 < 58.681  and attr store1 > 57.481 ) or 
       bondedto (attr store1 < 10.9411263766  and attr store1 > 9.7411263766 ))) 
6 0.1 0.1 peak 1475 volume 39.83400 ppm1 4.509 ppm2 3.875
 
! ############### hot_mothernoesy_072403.1476 folded +
assi (attr store1 < 1.894 and attr store1 > 1.694 )
     ((attr store1 < 4.042 and attr store1 > 3.942 ) and 
      (bondedto (attr store1 < 106.359873623  and attr store1 > 105.159873623 ) or 
       bondedto (attr store1 < 58.62  and attr store1 > 57.42 ) or 
       bondedto (attr store1 < 10.8801263766  and attr store1 > 9.6801263766 ))) 
6 0.1 0.1 peak 1476 volume 4.29690 ppm1 3.992 ppm2 1.794
 
! ############### hot_mothernoesy_072403.1477 folded +
assi (attr store1 < 3.219 and attr store1 > 3.019 )
     ((attr store1 < 4.598 and attr store1 > 4.498 ) and 
      (bondedto (attr store1 < 106.269873623  and attr store1 > 105.069873623 ) or 
       bondedto (attr store1 < 58.53  and attr store1 > 57.33 ) or 
       bondedto (attr store1 < 10.7901263766  and attr store1 > 9.5901263766 ))) 
6 0.1 0.1 peak 1477 volume 22.74490 ppm1 4.548 ppm2 3.119
 
! ############### hot_mothernoesy_072403.1478 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 4.565 and attr store1 > 4.465 ) and 
      (bondedto (attr store1 < 106.339873623  and attr store1 > 105.139873623 ) or 
       bondedto (attr store1 < 58.6  and attr store1 > 57.4 ) or 
       bondedto (attr store1 < 10.8601263766  and attr store1 > 9.6601263766 ))) 
6 0.1 0.1 peak 1478 volume 9.78860 ppm1 4.515 ppm2 4.772
 
! ############### hot_mothernoesy_072403.1479 folded +
assi (attr store1 < 3.64 and attr store1 > 3.44 )
     ((attr store1 < 4.052 and attr store1 > 3.952 ) and 
      (bondedto (attr store1 < 106.295873623  and attr store1 > 105.095873623 ) or 
       bondedto (attr store1 < 58.556  and attr store1 > 57.356 ) or 
       bondedto (attr store1 < 10.8161263766  and attr store1 > 9.6161263766 ))) 
6 0.1 0.1 peak 1479 volume 3.23190 ppm1 4.002 ppm2 3.540
 
! ############### hot_mothernoesy_072403.1480 folded +
assi (attr store1 < 1.088 and attr store1 > 0.888 )
     ((attr store1 < 4.049 and attr store1 > 3.949 ) and 
      (bondedto (attr store1 < 106.275873623  and attr store1 > 105.075873623 ) or 
       bondedto (attr store1 < 58.536  and attr store1 > 57.336 ) or 
       bondedto (attr store1 < 10.7961263766  and attr store1 > 9.5961263766 ))) 
6 0.1 0.1 peak 1480 volume 14.02270 ppm1 3.999 ppm2 0.988
 
! ############### hot_mothernoesy_072403.1481 folded -
assi (attr store1 < 4.434 and attr store1 > 4.234 )
     ((attr store1 < 2.47 and attr store1 > 2.37 ) and 
      (bondedto (attr store1 < 130.120810435  and attr store1 > 128.920810435 ) or 
       bondedto (attr store1 < 34.6410631883  and attr store1 > 33.4410631883 ))) 
6 0.1 0.1 peak 1481 volume 18.4752 ppm1 2.420 ppm2 4.334
 
! ############### hot_mothernoesy_072403.1482 folded +
assi (attr store1 < 3.101 and attr store1 > 2.901 )
     ((attr store1 < 4.598 and attr store1 > 4.498 ) and 
      (bondedto (attr store1 < 106.218873623  and attr store1 > 105.018873623 ) or 
       bondedto (attr store1 < 58.479  and attr store1 > 57.279 ) or 
       bondedto (attr store1 < 10.7391263766  and attr store1 > 9.5391263766 ))) 
6 0.1 0.1 peak 1482 volume 21.54770 ppm1 4.548 ppm2 3.001
 
! ############### hot_mothernoesy_072403.1483 folded +
assi (attr store1 < 4.641 and attr store1 > 4.441 )
     ((attr store1 < 4.592 and attr store1 > 4.492 ) and 
      (bondedto (attr store1 < 106.178873623  and attr store1 > 104.978873623 ) or 
       bondedto (attr store1 < 58.439  and attr store1 > 57.239 ) or 
       bondedto (attr store1 < 10.6991263766  and attr store1 > 9.4991263766 ))) 
6 0.1 0.1 peak 1483 volume 764.35461 ppm1 4.542 ppm2 4.541
 
! ############### hot_mothernoesy_072403.1484 folded +
assi (attr store1 < 4.537 and attr store1 > 4.337 )
     ((attr store1 < 4.487 and attr store1 > 4.387 ) and 
      (bondedto (attr store1 < 106.219873623  and attr store1 > 105.019873623 ) or 
       bondedto (attr store1 < 58.48  and attr store1 > 57.28 ) or 
       bondedto (attr store1 < 10.7401263766  and attr store1 > 9.5401263766 ))) 
6 0.1 0.1 peak 1484 volume 480.67569 ppm1 4.437 ppm2 4.437
 
! ############### hot_mothernoesy_072403.1485 folded +
assi (attr store1 < 2.866 and attr store1 > 2.666 )
     ((attr store1 < 4.486 and attr store1 > 4.386 ) and 
      (bondedto (attr store1 < 106.219873623  and attr store1 > 105.019873623 ) or 
       bondedto (attr store1 < 58.48  and attr store1 > 57.28 ) or 
       bondedto (attr store1 < 10.7401263766  and attr store1 > 9.5401263766 ))) 
6 0.1 0.1 peak 1485 volume 35.73410 ppm1 4.436 ppm2 2.766
 
! ############### hot_mothernoesy_072403.1486 folded -
assi (attr store1 < 2.514 and attr store1 > 2.314 )
     ((attr store1 < 2.465 and attr store1 > 2.365 ) and 
      (bondedto (attr store1 < 130.073810435  and attr store1 > 128.873810435 ) or 
       bondedto (attr store1 < 34.5940631883  and attr store1 > 33.3940631883 ))) 
6 0.1 0.1 peak 1486 volume 611.23669 ppm1 2.415 ppm2 2.414
 
! ############### hot_mothernoesy_072403.1487 folded -
assi (attr store1 < 2.289 and attr store1 > 2.089 )
     ((attr store1 < 2.461 and attr store1 > 2.361 ) and 
      (bondedto (attr store1 < 130.059810435  and attr store1 > 128.859810435 ) or 
       bondedto (attr store1 < 34.5800631883  and attr store1 > 33.3800631883 ))) 
6 0.1 0.1 peak 1487 volume 77.4297 ppm1 2.411 ppm2 2.189
 
! ############### hot_mothernoesy_072403.1488 folded -
assi (attr store1 < 2.127 and attr store1 > 1.927 )
     ((attr store1 < 2.463 and attr store1 > 2.363 ) and 
      (bondedto (attr store1 < 130.092810435  and attr store1 > 128.892810435 ) or 
       bondedto (attr store1 < 34.6130631883  and attr store1 > 33.4130631883 ))) 
6 0.1 0.1 peak 1488 volume 44.3372 ppm1 2.413 ppm2 2.027
 
! ############### hot_mothernoesy_072403.1489 folded -
assi (attr store1 < 0.906 and attr store1 > 0.706 )
     ((attr store1 < 2.464 and attr store1 > 2.364 ) and 
      (bondedto (attr store1 < 130.055810435  and attr store1 > 128.855810435 ) or 
       bondedto (attr store1 < 34.5760631883  and attr store1 > 33.3760631883 ))) 
6 0.1 0.1 peak 1489 volume 5.0856 ppm1 2.414 ppm2 0.806
 
! ############### hot_mothernoesy_072403.1490 folded +
assi (attr store1 < 3.431 and attr store1 > 3.231 )
     ((attr store1 < 4.584 and attr store1 > 4.484 ) and 
      (bondedto (attr store1 < 106.078873623  and attr store1 > 104.878873623 ) or 
       bondedto (attr store1 < 58.339  and attr store1 > 57.139 ) or 
       bondedto (attr store1 < 10.5991263766  and attr store1 > 9.3991263766 ))) 
6 0.1 0.1 peak 1490 volume 25.36570 ppm1 4.534 ppm2 3.331
 
! ############### hot_mothernoesy_072403.1491 folded +
assi (attr store1 < 1.507 and attr store1 > 1.307 )
     ((attr store1 < 4.583 and attr store1 > 4.483 ) and 
      (bondedto (attr store1 < 106.078873623  and attr store1 > 104.878873623 ) or 
       bondedto (attr store1 < 58.339  and attr store1 > 57.139 ) or 
       bondedto (attr store1 < 10.5991263766  and attr store1 > 9.3991263766 ))) 
6 0.1 0.1 peak 1491 volume 5.73640 ppm1 4.533 ppm2 1.407
 
! ############### hot_mothernoesy_072403.1492 folded -
assi (attr store1 < 4.227 and attr store1 > 4.027 )
     ((attr store1 < 2.599 and attr store1 > 2.499 ) and 
      (bondedto (attr store1 < 129.957810435  and attr store1 > 128.757810435 ) or 
       bondedto (attr store1 < 34.4780631883  and attr store1 > 33.2780631883 ))) 
6 0.1 0.1 peak 1492 volume 9.4021 ppm1 2.549 ppm2 4.127
 
! ############### hot_mothernoesy_072403.1493 folded -
assi (attr store1 < 2.651 and attr store1 > 2.451 )
     ((attr store1 < 2.598 and attr store1 > 2.498 ) and 
      (bondedto (attr store1 < 129.966810435  and attr store1 > 128.766810435 ) or 
       bondedto (attr store1 < 34.4870631883  and attr store1 > 33.2870631883 ))) 
6 0.1 0.1 peak 1493 volume 144.3345 ppm1 2.548 ppm2 2.551
 
! ############### hot_mothernoesy_072403.1494 folded -
assi (attr store1 < 2.517 and attr store1 > 2.317 )
     ((attr store1 < 2.601 and attr store1 > 2.501 ) and 
      (bondedto (attr store1 < 129.947810435  and attr store1 > 128.747810435 ) or 
       bondedto (attr store1 < 34.4680631883  and attr store1 > 33.2680631883 ))) 
6 0.1 0.1 peak 1494 volume 135.9937 ppm1 2.551 ppm2 2.417
 
! ############### hot_mothernoesy_072403.1495 folded -
assi (attr store1 < 2.311 and attr store1 > 2.111 )
     ((attr store1 < 2.6 and attr store1 > 2.5 ) and 
      (bondedto (attr store1 < 129.954810435  and attr store1 > 128.754810435 ) or 
       bondedto (attr store1 < 34.4750631883  and attr store1 > 33.2750631883 ))) 
6 0.1 0.1 peak 1495 volume 24.8155 ppm1 2.550 ppm2 2.211
 
! ############### hot_mothernoesy_072403.1496 folded -
assi (attr store1 < 1.088 and attr store1 > 0.888 )
     ((attr store1 < 2.596 and attr store1 > 2.496 ) and 
      (bondedto (attr store1 < 129.970810435  and attr store1 > 128.770810435 ) or 
       bondedto (attr store1 < 34.4910631883  and attr store1 > 33.2910631883 ))) 
6 0.1 0.1 peak 1496 volume 3.4561 ppm1 2.546 ppm2 0.988
 
! ############### hot_mothernoesy_072403.1497 folded -
assi (attr store1 < 4.228 and attr store1 > 4.028 )
     ((attr store1 < 2.471 and attr store1 > 2.371 ) and 
      (bondedto (attr store1 < 129.976810435  and attr store1 > 128.776810435 ) or 
       bondedto (attr store1 < 34.4970631883  and attr store1 > 33.2970631883 ))) 
6 0.1 0.1 peak 1497 volume 10.4322 ppm1 2.421 ppm2 4.128
 
! ############### hot_mothernoesy_072403.1498 folded -
assi (attr store1 < 2.647 and attr store1 > 2.447 )
     ((attr store1 < 2.468 and attr store1 > 2.368 ) and 
      (bondedto (attr store1 < 129.946810435  and attr store1 > 128.746810435 ) or 
       bondedto (attr store1 < 34.4670631883  and attr store1 > 33.2670631883 ))) 
6 0.1 0.1 peak 1498 volume 138.0146 ppm1 2.418 ppm2 2.547
 
! ############### hot_mothernoesy_072403.1499 folded -
assi (attr store1 < 2.166 and attr store1 > 1.966 )
     ((attr store1 < 2.455 and attr store1 > 2.355 ) and 
      (bondedto (attr store1 < 129.973810435  and attr store1 > 128.773810435 ) or 
       bondedto (attr store1 < 34.4940631883  and attr store1 > 33.2940631883 ))) 
6 0.1 0.1 peak 1499 volume 40.679 ppm1 2.405 ppm2 2.066
 
! ############### hot_mothernoesy_072403.1500 folded -
assi (attr store1 < 0.993 and attr store1 > 0.793 )
     ((attr store1 < 2.456 and attr store1 > 2.356 ) and 
      (bondedto (attr store1 < 129.949810435  and attr store1 > 128.749810435 ) or 
       bondedto (attr store1 < 34.4700631883  and attr store1 > 33.2700631883 ))) 
6 0.1 0.1 peak 1500 volume 5.5769 ppm1 2.406 ppm2 0.893
 
! ############### hot_mothernoesy_072403.1501 folded +
assi (attr store1 < 4.288 and attr store1 > 4.088 )
     ((attr store1 < 4.238 and attr store1 > 4.138 ) and 
      (bondedto (attr store1 < 106.004873623  and attr store1 > 104.804873623 ) or 
       bondedto (attr store1 < 58.265  and attr store1 > 57.065 ) or 
       bondedto (attr store1 < 10.5251263766  and attr store1 > 9.3251263766 ))) 
6 0.1 0.1 peak 1501 volume 1362.66187 ppm1 4.188 ppm2 4.188
 
! ############### hot_mothernoesy_072403.1502 folded -
assi (attr store1 < 1.955 and attr store1 > 1.755 )
     ((attr store1 < 2.606 and attr store1 > 2.506 ) and 
      (bondedto (attr store1 < 129.911810435  and attr store1 > 128.711810435 ) or 
       bondedto (attr store1 < 34.4320631883  and attr store1 > 33.2320631883 ))) 
6 0.1 0.1 peak 1502 volume 3.2433 ppm1 2.556 ppm2 1.855
 
! ############### hot_mothernoesy_072403.1503 folded -
assi (attr store1 < 4.129 and attr store1 > 3.929 )
     ((attr store1 < 2.446 and attr store1 > 2.346 ) and 
      (bondedto (attr store1 < 129.841810435  and attr store1 > 128.641810435 ) or 
       bondedto (attr store1 < 34.3620631883  and attr store1 > 33.1620631883 ))) 
6 0.1 0.1 peak 1503 volume 10.3277 ppm1 2.396 ppm2 4.029
 
! ############### hot_mothernoesy_072403.1504 folded -
assi (attr store1 < 1.14 and attr store1 > 0.94 )
     ((attr store1 < 2.452 and attr store1 > 2.352 ) and 
      (bondedto (attr store1 < 129.873810435  and attr store1 > 128.673810435 ) or 
       bondedto (attr store1 < 34.3940631883  and attr store1 > 33.1940631883 ))) 
6 0.1 0.1 peak 1504 volume 11.2539 ppm1 2.402 ppm2 1.040
 
! ############### hot_mothernoesy_072403.1505 folded -
assi (attr store1 < 4.128 and attr store1 > 3.928 )
     ((attr store1 < 2.392 and attr store1 > 2.292 ) and 
      (bondedto (attr store1 < 129.848810435  and attr store1 > 128.648810435 ) or 
       bondedto (attr store1 < 34.3690631883  and attr store1 > 33.1690631883 ))) 
6 0.1 0.1 peak 1505 volume 8.4334 ppm1 2.342 ppm2 4.028
 
! ############### hot_mothernoesy_072403.1506 folded -
assi (attr store1 < 2.512 and attr store1 > 2.312 )
     ((attr store1 < 2.383 and attr store1 > 2.283 ) and 
      (bondedto (attr store1 < 129.850810435  and attr store1 > 128.650810435 ) or 
       bondedto (attr store1 < 34.3710631883  and attr store1 > 33.1710631883 ))) 
6 0.1 0.1 peak 1506 volume 147.23511 ppm1 2.333 ppm2 2.412
 
! ############### hot_mothernoesy_072403.1507 folded -
assi (attr store1 < 0.978 and attr store1 > 0.778 )
     ((attr store1 < 2.39 and attr store1 > 2.29 ) and 
      (bondedto (attr store1 < 129.856810435  and attr store1 > 128.656810435 ) or 
       bondedto (attr store1 < 34.3770631883  and attr store1 > 33.1770631883 ))) 
6 0.1 0.1 peak 1507 volume 4.4946 ppm1 2.340 ppm2 0.878
 
! ############### hot_mothernoesy_072403.1508 folded -
assi (attr store1 < 2.556 and attr store1 > 2.356 )
     ((attr store1 < 2.053 and attr store1 > 1.953 ) and 
      (bondedto (attr store1 < 129.849810435  and attr store1 > 128.649810435 ) or 
       bondedto (attr store1 < 34.3700631883  and attr store1 > 33.1700631883 ))) 
6 0.1 0.1 peak 1508 volume 13.2281 ppm1 2.003 ppm2 2.456
 
! ############### hot_mothernoesy_072403.1509 folded -
assi (attr store1 < 1.823 and attr store1 > 1.623 )
     ((attr store1 < 1.889 and attr store1 > 1.789 ) and 
      (bondedto (attr store1 < 129.863810435  and attr store1 > 128.663810435 ) or 
       bondedto (attr store1 < 34.3840631883  and attr store1 > 33.1840631883 ))) 
6 0.1 0.1 peak 1509 volume 291.90219 ppm1 1.839 ppm2 1.723
 
! ############### hot_mothernoesy_072403.1510 folded -
assi (attr store1 < 1.52 and attr store1 > 1.32 )
     ((attr store1 < 1.89 and attr store1 > 1.79 ) and 
      (bondedto (attr store1 < 129.848810435  and attr store1 > 128.648810435 ) or 
       bondedto (attr store1 < 34.3690631883  and attr store1 > 33.1690631883 ))) 
6 0.1 0.1 peak 1510 volume 25.0286 ppm1 1.840 ppm2 1.420
 
! ############### hot_mothernoesy_072403.1511 folded -
assi (attr store1 < 1.937 and attr store1 > 1.737 )
     ((attr store1 < 1.882 and attr store1 > 1.782 ) and 
      (bondedto (attr store1 < 129.889810435  and attr store1 > 128.689810435 ) or 
       bondedto (attr store1 < 34.4100631883  and attr store1 > 33.2100631883 ))) 
6 0.1 0.1 peak 1511 volume 368.7507 ppm1 1.832 ppm2 1.837
 
! ############### hot_mothernoesy_072403.1512 folded -
assi (attr store1 < 1.937 and attr store1 > 1.737 )
     ((attr store1 < 1.773 and attr store1 > 1.673 ) and 
      (bondedto (attr store1 < 129.842810435  and attr store1 > 128.642810435 ) or 
       bondedto (attr store1 < 34.3630631883  and attr store1 > 33.1630631883 ))) 
6 0.1 0.1 peak 1512 volume 304.50409 ppm1 1.723 ppm2 1.837
 
! ############### hot_mothernoesy_072403.1513 folded -
assi (attr store1 < 1.827 and attr store1 > 1.627 )
     ((attr store1 < 1.78 and attr store1 > 1.68 ) and 
      (bondedto (attr store1 < 129.884810435  and attr store1 > 128.684810435 ) or 
       bondedto (attr store1 < 34.4050631883  and attr store1 > 33.2050631883 ))) 
6 0.1 0.1 peak 1513 volume 325.3674 ppm1 1.730 ppm2 1.727
 
! ############### hot_mothernoesy_072403.1514 folded -
assi (attr store1 < 1.534 and attr store1 > 1.334 )
     ((attr store1 < 1.772 and attr store1 > 1.672 ) and 
      (bondedto (attr store1 < 129.888810435  and attr store1 > 128.688810435 ) or 
       bondedto (attr store1 < 34.4090631883  and attr store1 > 33.2090631883 ))) 
6 0.1 0.1 peak 1514 volume 11.5889 ppm1 1.722 ppm2 1.434
 
! ############### hot_mothernoesy_072403.1515 folded -
assi (attr store1 < 2.098 and attr store1 > 1.898 )
     ((attr store1 < 2.506 and attr store1 > 2.406 ) and 
      (bondedto (attr store1 < 129.782810435  and attr store1 > 128.582810435 ) or 
       bondedto (attr store1 < 34.3030631883  and attr store1 > 33.1030631883 ))) 
6 0.1 0.1 peak 1515 volume 47.408 ppm1 2.456 ppm2 1.998
 
! ############### hot_mothernoesy_072403.1516 folded -
assi (attr store1 < 1.122 and attr store1 > 0.922 )
     ((attr store1 < 2.373 and attr store1 > 2.273 ) and 
      (bondedto (attr store1 < 129.811810435  and attr store1 > 128.611810435 ) or 
       bondedto (attr store1 < 34.3320631883  and attr store1 > 33.1320631883 ))) 
6 0.1 0.1 peak 1516 volume 11.8551 ppm1 2.323 ppm2 1.022
 
! ############### hot_mothernoesy_072403.1517 folded -
assi (attr store1 < 4.411 and attr store1 > 4.211 )
     ((attr store1 < 2.361 and attr store1 > 2.261 ) and 
      (bondedto (attr store1 < 129.789810435  and attr store1 > 128.589810435 ) or 
       bondedto (attr store1 < 34.3100631883  and attr store1 > 33.1100631883 ))) 
6 0.1 0.1 peak 1517 volume 11.7832 ppm1 2.311 ppm2 4.311
 
! ############### hot_mothernoesy_072403.1518 folded -
assi (attr store1 < 2.41 and attr store1 > 2.21 )
     ((attr store1 < 2.36 and attr store1 > 2.26 ) and 
      (bondedto (attr store1 < 129.799810435  and attr store1 > 128.599810435 ) or 
       bondedto (attr store1 < 34.3200631883  and attr store1 > 33.1200631883 ))) 
6 0.1 0.1 peak 1518 volume 1442.1925 ppm1 2.310 ppm2 2.310
 
! ############### hot_mothernoesy_072403.1519 folded -
assi (attr store1 < 2.182 and attr store1 > 1.982 )
     ((attr store1 < 2.364 and attr store1 > 2.264 ) and 
      (bondedto (attr store1 < 129.780810435  and attr store1 > 128.580810435 ) or 
       bondedto (attr store1 < 34.3010631883  and attr store1 > 33.1010631883 ))) 
6 0.1 0.1 peak 1519 volume 102.5691 ppm1 2.314 ppm2 2.082
 
! ############### hot_mothernoesy_072403.1520 folded -
assi (attr store1 < 2.057 and attr store1 > 1.857 )
     ((attr store1 < 2.36 and attr store1 > 2.26 ) and 
      (bondedto (attr store1 < 129.793810435  and attr store1 > 128.593810435 ) or 
       bondedto (attr store1 < 34.3140631883  and attr store1 > 33.1140631883 ))) 
6 0.1 0.1 peak 1520 volume 44.7438 ppm1 2.310 ppm2 1.957
 
! ############### hot_mothernoesy_072403.1522 folded +
assi (attr store1 < 1.024 and attr store1 > 0.824 )
     ((attr store1 < 4.586 and attr store1 > 4.486 ) and 
      (bondedto (attr store1 < 105.870873623  and attr store1 > 104.670873623 ) or 
       bondedto (attr store1 < 58.131  and attr store1 > 56.931 ) or 
       bondedto (attr store1 < 10.3911263766  and attr store1 > 9.1911263766 ))) 
6 0.1 0.1 peak 1522 volume 3.46630 ppm1 4.536 ppm2 0.924
 
! ############### hot_mothernoesy_072403.1523 folded +
assi (attr store1 < 3.547 and attr store1 > 3.347 )
     ((attr store1 < 4.219 and attr store1 > 4.119 ) and 
      (bondedto (attr store1 < 105.858873623  and attr store1 > 104.658873623 ) or 
       bondedto (attr store1 < 58.119  and attr store1 > 56.919 ) or 
       bondedto (attr store1 < 10.3791263766  and attr store1 > 9.1791263766 ))) 
6 0.1 0.1 peak 1523 volume 4.88220 ppm1 4.169 ppm2 3.447
 
! ############### hot_mothernoesy_072403.1524 folded +
assi (attr store1 < 3.221 and attr store1 > 3.021 )
     ((attr store1 < 4.215 and attr store1 > 4.115 ) and 
      (bondedto (attr store1 < 105.867873623  and attr store1 > 104.667873623 ) or 
       bondedto (attr store1 < 58.128  and attr store1 > 56.928 ) or 
       bondedto (attr store1 < 10.3881263766  and attr store1 > 9.1881263766 ))) 
6 0.1 0.1 peak 1524 volume 3.47750 ppm1 4.165 ppm2 3.121
 
! ############### hot_mothernoesy_072403.1525 folded +
assi (attr store1 < 2.111 and attr store1 > 1.911 )
     ((attr store1 < 4.212 and attr store1 > 4.112 ) and 
      (bondedto (attr store1 < 105.871873623  and attr store1 > 104.671873623 ) or 
       bondedto (attr store1 < 58.132  and attr store1 > 56.932 ) or 
       bondedto (attr store1 < 10.3921263766  and attr store1 > 9.1921263766 ))) 
6 0.1 0.1 peak 1525 volume 6.78760 ppm1 4.162 ppm2 2.011
 
! ############### hot_mothernoesy_072403.1526 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 2.044 and attr store1 > 1.944 ) and 
      (bondedto (attr store1 < 129.667810435  and attr store1 > 128.467810435 ) or 
       bondedto (attr store1 < 34.1880631883  and attr store1 > 32.9880631883 ))) 
6 0.1 0.1 peak 1526 volume 4.182 ppm1 1.994 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1527 folded -
assi (attr store1 < 4.015 and attr store1 > 3.815 )
     ((attr store1 < 2.05 and attr store1 > 1.95 ) and 
      (bondedto (attr store1 < 129.672810435  and attr store1 > 128.472810435 ) or 
       bondedto (attr store1 < 34.1930631883  and attr store1 > 32.9930631883 ))) 
6 0.1 0.1 peak 1527 volume 10.9502 ppm1 2.000 ppm2 3.915
 
! ############### hot_mothernoesy_072403.1528 folded -
assi (attr store1 < 2.099 and attr store1 > 1.899 )
     ((attr store1 < 2.049 and attr store1 > 1.949 ) and 
      (bondedto (attr store1 < 129.656810435  and attr store1 > 128.456810435 ) or 
       bondedto (attr store1 < 34.1770631883  and attr store1 > 32.9770631883 ))) 
6 0.1 0.1 peak 1528 volume 1077.8927 ppm1 1.999 ppm2 1.999
 
! ############### hot_mothernoesy_072403.1529 folded +
assi (attr store1 < 2.936 and attr store1 > 2.736 )
     ((attr store1 < 4.6 and attr store1 > 4.5 ) and 
      (bondedto (attr store1 < 105.771873623  and attr store1 > 104.571873623 ) or 
       bondedto (attr store1 < 58.032  and attr store1 > 56.832 ) or 
       bondedto (attr store1 < 10.2921263766  and attr store1 > 9.0921263766 ))) 
6 0.1 0.1 peak 1529 volume 8.10120 ppm1 4.550 ppm2 2.836
 
! ############### hot_mothernoesy_072403.1530 folded -
assi (attr store1 < 4.063 and attr store1 > 3.863 )
     ((attr store1 < 2.487 and attr store1 > 2.387 ) and 
      (bondedto (attr store1 < 129.504810435  and attr store1 > 128.304810435 ) or 
       bondedto (attr store1 < 34.0250631883  and attr store1 > 32.8250631883 ))) 
6 0.1 0.1 peak 1530 volume 13.8407 ppm1 2.437 ppm2 3.963
 
! ############### hot_mothernoesy_072403.1531 folded -
assi (attr store1 < 2.54 and attr store1 > 2.34 )
     ((attr store1 < 2.488 and attr store1 > 2.388 ) and 
      (bondedto (attr store1 < 129.491810435  and attr store1 > 128.291810435 ) or 
       bondedto (attr store1 < 34.0120631883  and attr store1 > 32.8120631883 ))) 
6 0.1 0.1 peak 1531 volume 457.5575 ppm1 2.438 ppm2 2.440
 
! ############### hot_mothernoesy_072403.1532 folded -
assi (attr store1 < 2.184 and attr store1 > 1.984 )
     ((attr store1 < 2.487 and attr store1 > 2.387 ) and 
      (bondedto (attr store1 < 129.492810435  and attr store1 > 128.292810435 ) or 
       bondedto (attr store1 < 34.0130631883  and attr store1 > 32.8130631883 ))) 
6 0.1 0.1 peak 1532 volume 36.5553 ppm1 2.437 ppm2 2.084
 
! ############### hot_mothernoesy_072403.1533 folded -
assi (attr store1 < 2.302 and attr store1 > 2.102 )
     ((attr store1 < 2.476 and attr store1 > 2.376 ) and 
      (bondedto (attr store1 < 129.553810435  and attr store1 > 128.353810435 ) or 
       bondedto (attr store1 < 34.0740631883  and attr store1 > 32.8740631883 ))) 
6 0.1 0.1 peak 1533 volume 51.4349 ppm1 2.426 ppm2 2.202
 
! ############### hot_mothernoesy_072403.1534 folded -
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 1.916 and attr store1 > 1.816 ) and 
      (bondedto (attr store1 < 129.388810435  and attr store1 > 128.188810435 ) or 
       bondedto (attr store1 < 33.9090631883  and attr store1 > 32.7090631883 ))) 
6 0.1 0.1 peak 1534 volume 4.5888 ppm1 1.866 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1535 folded -
assi (attr store1 < 4.411 and attr store1 > 4.211 )
     ((attr store1 < 1.916 and attr store1 > 1.816 ) and 
      (bondedto (attr store1 < 129.326810435  and attr store1 > 128.126810435 ) or 
       bondedto (attr store1 < 33.8470631883  and attr store1 > 32.6470631883 ))) 
6 0.1 0.1 peak 1535 volume 16.4369 ppm1 1.866 ppm2 4.311
 
! ############### hot_mothernoesy_072403.1536 folded -
assi (attr store1 < 1.741 and attr store1 > 1.541 )
     ((attr store1 < 1.848 and attr store1 > 1.748 ) and 
      (bondedto (attr store1 < 129.316810435  and attr store1 > 128.116810435 ) or 
       bondedto (attr store1 < 33.8370631883  and attr store1 > 32.6370631883 ))) 
6 0.1 0.1 peak 1536 volume 15.6059 ppm1 1.798 ppm2 1.641
 
! ############### hot_mothernoesy_072403.1537 folded -
assi (attr store1 < 4.409 and attr store1 > 4.209 )
     ((attr store1 < 1.837 and attr store1 > 1.737 ) and 
      (bondedto (attr store1 < 129.344810435  and attr store1 > 128.144810435 ) or 
       bondedto (attr store1 < 33.8650631883  and attr store1 > 32.6650631883 ))) 
6 0.1 0.1 peak 1537 volume 15.2492 ppm1 1.787 ppm2 4.309
 
! ############### hot_mothernoesy_072403.1538 folded -
assi (attr store1 < 4.875 and attr store1 > 4.675 )
     ((attr store1 < 1.827 and attr store1 > 1.727 ) and 
      (bondedto (attr store1 < 129.367810435  and attr store1 > 128.167810435 ) or 
       bondedto (attr store1 < 33.8880631883  and attr store1 > 32.6880631883 ))) 
6 0.1 0.1 peak 1538 volume 4.3805 ppm1 1.777 ppm2 4.775
 
! ############### hot_mothernoesy_072403.1539 folded +
assi (attr store1 < 2.172 and attr store1 > 1.972 )
     ((attr store1 < 3.95 and attr store1 > 3.85 ) and 
      (bondedto (attr store1 < 105.366873623  and attr store1 > 104.166873623 ) or 
       bondedto (attr store1 < 57.627  and attr store1 > 56.427 ) or 
       bondedto (attr store1 < 9.8871263766  and attr store1 > 8.6871263766 ))) 
6 0.1 0.1 peak 1539 volume 5.16890 ppm1 3.900 ppm2 2.072
 
! ############### hot_mothernoesy_072403.1540 folded +
assi (attr store1 < 1.619 and attr store1 > 1.419 )
     ((attr store1 < 3.949 and attr store1 > 3.849 ) and 
      (bondedto (attr store1 < 105.366873623  and attr store1 > 104.166873623 ) or 
       bondedto (attr store1 < 57.627  and attr store1 > 56.427 ) or 
       bondedto (attr store1 < 9.8871263766  and attr store1 > 8.6871263766 ))) 
6 0.1 0.1 peak 1540 volume 19.20990 ppm1 3.899 ppm2 1.519
 
! ############### hot_mothernoesy_072403.1541 folded +
assi (attr store1 < 1.487 and attr store1 > 1.287 )
     ((attr store1 < 3.947 and attr store1 > 3.847 ) and 
      (bondedto (attr store1 < 105.367873623  and attr store1 > 104.167873623 ) or 
       bondedto (attr store1 < 57.628  and attr store1 > 56.428 ) or 
       bondedto (attr store1 < 9.8881263766  and attr store1 > 8.6881263766 ))) 
6 0.1 0.1 peak 1541 volume 4.58580 ppm1 3.897 ppm2 1.387
 
! ############### hot_mothernoesy_072403.1542 folded +
assi (attr store1 < 1.059 and attr store1 > 0.859 )
     ((attr store1 < 3.949 and attr store1 > 3.849 ) and 
      (bondedto (attr store1 < 105.375873623  and attr store1 > 104.175873623 ) or 
       bondedto (attr store1 < 57.636  and attr store1 > 56.436 ) or 
       bondedto (attr store1 < 9.8961263766  and attr store1 > 8.6961263766 ))) 
6 0.1 0.1 peak 1542 volume 15.50840 ppm1 3.899 ppm2 0.959
 
! ############### hot_mothernoesy_072403.1543 folded -
assi (attr store1 < 1.578 and attr store1 > 1.378 )
     ((attr store1 < 1.914 and attr store1 > 1.814 ) and 
      (bondedto (attr store1 < 129.205810435  and attr store1 > 128.005810435 ) or 
       bondedto (attr store1 < 33.7260631883  and attr store1 > 32.5260631883 ))) 
6 0.1 0.1 peak 1543 volume 44.95 ppm1 1.864 ppm2 1.478
 
! ############### hot_mothernoesy_072403.1544 folded -
assi (attr store1 < 1.596 and attr store1 > 1.396 )
     ((attr store1 < 1.828 and attr store1 > 1.728 ) and 
      (bondedto (attr store1 < 129.227810435  and attr store1 > 128.027810435 ) or 
       bondedto (attr store1 < 33.7480631883  and attr store1 > 32.5480631883 ))) 
6 0.1 0.1 peak 1544 volume 33.5999 ppm1 1.778 ppm2 1.496
 
! ############### hot_mothernoesy_072403.1546 folded +
assi (attr store1 < 1.669 and attr store1 > 1.469 )
     ((attr store1 < 4.156 and attr store1 > 4.056 ) and 
      (bondedto (attr store1 < 105.291873623  and attr store1 > 104.091873623 ) or 
       bondedto (attr store1 < 57.552  and attr store1 > 56.352 ) or 
       bondedto (attr store1 < 9.8121263766  and attr store1 > 8.6121263766 ))) 
6 0.1 0.1 peak 1546 volume 12.41690 ppm1 4.106 ppm2 1.569
 
! ############### hot_mothernoesy_072403.1547 folded -
assi (attr store1 < 2.56 and attr store1 > 2.36 )
     ((attr store1 < 2.048 and attr store1 > 1.948 ) and 
      (bondedto (attr store1 < 129.129810435  and attr store1 > 127.929810435 ) or 
       bondedto (attr store1 < 33.6500631883  and attr store1 > 32.4500631883 ))) 
6 0.1 0.1 peak 1547 volume 8.1492 ppm1 1.998 ppm2 2.460
 
! ############### hot_mothernoesy_072403.1548 folded -
assi (attr store1 < 1.954 and attr store1 > 1.754 )
     ((attr store1 < 1.903 and attr store1 > 1.803 ) and 
      (bondedto (attr store1 < 129.113810435  and attr store1 > 127.913810435 ) or 
       bondedto (attr store1 < 33.6340631883  and attr store1 > 32.4340631883 ))) 
6 0.1 0.1 peak 1548 volume 529.80408 ppm1 1.853 ppm2 1.854
 
! ############### hot_mothernoesy_072403.1549 folded -
assi (attr store1 < 1.96 and attr store1 > 1.76 )
     ((attr store1 < 1.826 and attr store1 > 1.726 ) and 
      (bondedto (attr store1 < 129.097810435  and attr store1 > 127.897810435 ) or 
       bondedto (attr store1 < 33.6180631883  and attr store1 > 32.4180631883 ))) 
6 0.1 0.1 peak 1549 volume 556.45911 ppm1 1.776 ppm2 1.860
 
! ############### hot_mothernoesy_072403.1550 folded +
assi (attr store1 < 3.98 and attr store1 > 3.78 )
     ((attr store1 < 3.93 and attr store1 > 3.83 ) and 
      (bondedto (attr store1 < 105.178873623  and attr store1 > 103.978873623 ) or 
       bondedto (attr store1 < 57.439  and attr store1 > 56.239 ) or 
       bondedto (attr store1 < 9.6991263766  and attr store1 > 8.4991263766 ))) 
6 0.1 0.1 peak 1550 volume 147.43390 ppm1 3.880 ppm2 3.880
 
! ############### hot_mothernoesy_072403.1551 folded -
assi (attr store1 < 1.876 and attr store1 > 1.676 )
     ((attr store1 < 1.914 and attr store1 > 1.814 ) and 
      (bondedto (attr store1 < 129.088810435  and attr store1 > 127.888810435 ) or 
       bondedto (attr store1 < 33.6090631883  and attr store1 > 32.4090631883 ))) 
6 0.1 0.1 peak 1551 volume 560.37769 ppm1 1.864 ppm2 1.776
 
! ############### hot_mothernoesy_072403.1552 folded -
assi (attr store1 < 1.876 and attr store1 > 1.676 )
     ((attr store1 < 1.83 and attr store1 > 1.73 ) and 
      (bondedto (attr store1 < 129.071810435  and attr store1 > 127.871810435 ) or 
       bondedto (attr store1 < 33.5920631883  and attr store1 > 32.3920631883 ))) 
6 0.1 0.1 peak 1552 volume 502.5455 ppm1 1.780 ppm2 1.776
 
! ############### hot_mothernoesy_072403.1553 folded +
assi (attr store1 < 1.578 and attr store1 > 1.378 )
     ((attr store1 < 4.389 and attr store1 > 4.289 ) and 
      (bondedto (attr store1 < 105.036873623  and attr store1 > 103.836873623 ) or 
       bondedto (attr store1 < 57.297  and attr store1 > 56.097 ) or 
       bondedto (attr store1 < 9.5571263766  and attr store1 > 8.3571263766 ))) 
6 0.1 0.1 peak 1553 volume 14.38800 ppm1 4.339 ppm2 1.478
 
! ############### hot_mothernoesy_072403.1554 folded +
assi (attr store1 < 2.217 and attr store1 > 2.017 )
     ((attr store1 < 4.38 and attr store1 > 4.28 ) and 
      (bondedto (attr store1 < 105.053873623  and attr store1 > 103.853873623 ) or 
       bondedto (attr store1 < 57.314  and attr store1 > 56.114 ) or 
       bondedto (attr store1 < 9.5741263766  and attr store1 > 8.3741263766 ))) 
6 0.1 0.1 peak 1554 volume 4.73920 ppm1 4.330 ppm2 2.117
 
! ############### hot_mothernoesy_072403.1555 folded +
assi (attr store1 < 3.064 and attr store1 > 2.864 )
     ((attr store1 < 4.282 and attr store1 > 4.182 ) and 
      (bondedto (attr store1 < 105.068873623  and attr store1 > 103.868873623 ) or 
       bondedto (attr store1 < 57.329  and attr store1 > 56.129 ) or 
       bondedto (attr store1 < 9.5891263766  and attr store1 > 8.3891263766 ))) 
6 0.1 0.1 peak 1555 volume 3.90390 ppm1 4.232 ppm2 2.964
 
! ############### hot_mothernoesy_072403.1556 folded +
assi (attr store1 < 0.887 and attr store1 > 0.687 )
     ((attr store1 < 4.274 and attr store1 > 4.174 ) and 
      (bondedto (attr store1 < 105.038873623  and attr store1 > 103.838873623 ) or 
       bondedto (attr store1 < 57.299  and attr store1 > 56.099 ) or 
       bondedto (attr store1 < 9.5591263766  and attr store1 > 8.3591263766 ))) 
6 0.1 0.1 peak 1556 volume 3.21160 ppm1 4.224 ppm2 0.787
 
! ############### hot_mothernoesy_072403.1557 folded +
assi (attr store1 < 1.742 and attr store1 > 1.542 )
     ((attr store1 < 4.389 and attr store1 > 4.289 ) and 
      (bondedto (attr store1 < 105.032873623  and attr store1 > 103.832873623 ) or 
       bondedto (attr store1 < 57.293  and attr store1 > 56.093 ) or 
       bondedto (attr store1 < 9.5531263766  and attr store1 > 8.3531263766 ))) 
6 0.1 0.1 peak 1557 volume 9.42120 ppm1 4.339 ppm2 1.642
 
! ############### hot_mothernoesy_072403.1558 folded +
assi (attr store1 < 2.164 and attr store1 > 1.964 )
     ((attr store1 < 4.382 and attr store1 > 4.282 ) and 
      (bondedto (attr store1 < 105.018873623  and attr store1 > 103.818873623 ) or 
       bondedto (attr store1 < 57.279  and attr store1 > 56.079 ) or 
       bondedto (attr store1 < 9.5391263766  and attr store1 > 8.3391263766 ))) 
6 0.1 0.1 peak 1558 volume 5.11980 ppm1 4.332 ppm2 2.064
 
! ############### hot_mothernoesy_072403.1559 folded +
assi (attr store1 < 1.893 and attr store1 > 1.693 )
     ((attr store1 < 4.375 and attr store1 > 4.275 ) and 
      (bondedto (attr store1 < 105.018873623  and attr store1 > 103.818873623 ) or 
       bondedto (attr store1 < 57.279  and attr store1 > 56.079 ) or 
       bondedto (attr store1 < 9.5391263766  and attr store1 > 8.3391263766 ))) 
6 0.1 0.1 peak 1559 volume 24.39820 ppm1 4.325 ppm2 1.793
 
! ############### hot_mothernoesy_072403.1560 folded +
assi (attr store1 < 1.617 and attr store1 > 1.417 )
     ((attr store1 < 4.357 and attr store1 > 4.257 ) and 
      (bondedto (attr store1 < 104.963873623  and attr store1 > 103.763873623 ) or 
       bondedto (attr store1 < 57.224  and attr store1 > 56.024 ) or 
       bondedto (attr store1 < 9.4841263766  and attr store1 > 8.2841263766 ))) 
6 0.1 0.1 peak 1560 volume 13.95160 ppm1 4.307 ppm2 1.517
 
! ############### hot_mothernoesy_072403.1561 folded +
assi (attr store1 < 2.489 and attr store1 > 2.289 )
     ((attr store1 < 4.283 and attr store1 > 4.183 ) and 
      (bondedto (attr store1 < 105.029873623  and attr store1 > 103.829873623 ) or 
       bondedto (attr store1 < 57.29  and attr store1 > 56.09 ) or 
       bondedto (attr store1 < 9.5501263766  and attr store1 > 8.3501263766 ))) 
6 0.1 0.1 peak 1561 volume 3.88820 ppm1 4.233 ppm2 2.389
 
! ############### hot_mothernoesy_072403.1562 folded +
assi (attr store1 < 2.237 and attr store1 > 2.037 )
     ((attr store1 < 4.286 and attr store1 > 4.186 ) and 
      (bondedto (attr store1 < 105.025873623  and attr store1 > 103.825873623 ) or 
       bondedto (attr store1 < 57.286  and attr store1 > 56.086 ) or 
       bondedto (attr store1 < 9.5461263766  and attr store1 > 8.3461263766 ))) 
6 0.1 0.1 peak 1562 volume 8.22990 ppm1 4.236 ppm2 2.137
 
! ############### hot_mothernoesy_072403.1563 folded +
assi (attr store1 < 0.996 and attr store1 > 0.796 )
     ((attr store1 < 4.276 and attr store1 > 4.176 ) and 
      (bondedto (attr store1 < 105.010873623  and attr store1 > 103.810873623 ) or 
       bondedto (attr store1 < 57.271  and attr store1 > 56.071 ) or 
       bondedto (attr store1 < 9.5311263766  and attr store1 > 8.3311263766 ))) 
6 0.1 0.1 peak 1563 volume 5.30980 ppm1 4.226 ppm2 0.896
 
! ############### hot_mothernoesy_072403.1564 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 4.353 and attr store1 > 4.253 ) and 
      (bondedto (attr store1 < 104.913873623  and attr store1 > 103.713873623 ) or 
       bondedto (attr store1 < 57.174  and attr store1 > 55.974 ) or 
       bondedto (attr store1 < 9.4341263766  and attr store1 > 8.2341263766 ))) 
6 0.1 0.1 peak 1564 volume 15.98350 ppm1 4.303 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1565 folded +
assi (attr store1 < 4.086 and attr store1 > 3.886 )
     ((attr store1 < 4.342 and attr store1 > 4.242 ) and 
      (bondedto (attr store1 < 104.898873623  and attr store1 > 103.698873623 ) or 
       bondedto (attr store1 < 57.159  and attr store1 > 55.959 ) or 
       bondedto (attr store1 < 9.4191263766  and attr store1 > 8.2191263766 ))) 
6 0.1 0.1 peak 1565 volume 4.70770 ppm1 4.292 ppm2 3.986
 
! ############### hot_mothernoesy_072403.1566 folded +
assi (attr store1 < 2.409 and attr store1 > 2.209 )
     ((attr store1 < 1.958 and attr store1 > 1.858 ) and 
      (bondedto (attr store1 < 104.932873623  and attr store1 > 103.732873623 ) or 
       bondedto (attr store1 < 57.193  and attr store1 > 55.993 ) or 
       bondedto (attr store1 < 9.4531263766  and attr store1 > 8.2531263766 ))) 
6 0.1 0.1 peak 1566 volume 24.15390 ppm1 1.908 ppm2 2.309
 
! ############### hot_mothernoesy_072403.1567 folded +
assi (attr store1 < 4.38 and attr store1 > 4.18 )
     ((attr store1 < 4.333 and attr store1 > 4.233 ) and 
      (bondedto (attr store1 < 104.837873623  and attr store1 > 103.637873623 ) or 
       bondedto (attr store1 < 57.098  and attr store1 > 55.898 ) or 
       bondedto (attr store1 < 9.3581263766  and attr store1 > 8.1581263766 ))) 
6 0.1 0.1 peak 1567 volume 716.23529 ppm1 4.283 ppm2 4.280
 
! ############### hot_mothernoesy_072403.1568 folded -
assi (attr store1 < 4.164 and attr store1 > 3.964 )
     ((attr store1 < 2.142 and attr store1 > 2.042 ) and 
      (bondedto (attr store1 < 128.651810435  and attr store1 > 127.451810435 ) or 
       bondedto (attr store1 < 33.1720631883  and attr store1 > 31.9720631883 ))) 
6 0.1 0.1 peak 1568 volume 5.725 ppm1 2.092 ppm2 4.064
 
! ############### hot_mothernoesy_072403.1569 folded -
assi (attr store1 < 1.117 and attr store1 > 0.917 )
     ((attr store1 < 2.375 and attr store1 > 2.275 ) and 
      (bondedto (attr store1 < 128.561810435  and attr store1 > 127.361810435 ) or 
       bondedto (attr store1 < 33.0820631883  and attr store1 > 31.8820631883 ))) 
6 0.1 0.1 peak 1569 volume 26.4638 ppm1 2.325 ppm2 1.017
 
! ############### hot_mothernoesy_072403.1570 folded -
assi (attr store1 < 4.099 and attr store1 > 3.899 )
     ((attr store1 < 1.889 and attr store1 > 1.789 ) and 
      (bondedto (attr store1 < 128.579810435  and attr store1 > 127.379810435 ) or 
       bondedto (attr store1 < 33.1000631883  and attr store1 > 31.9000631883 ))) 
6 0.1 0.1 peak 1570 volume 5.9936 ppm1 1.839 ppm2 3.999
 
! ############### hot_mothernoesy_072403.1572 folded -
assi (attr store1 < 1.355 and attr store1 > 1.155 )
     ((attr store1 < 1.884 and attr store1 > 1.784 ) and 
      (bondedto (attr store1 < 128.582810435  and attr store1 > 127.382810435 ) or 
       bondedto (attr store1 < 33.1030631883  and attr store1 > 31.9030631883 ))) 
6 0.1 0.1 peak 1572 volume 7.0706 ppm1 1.834 ppm2 1.255
 
! ############### hot_mothernoesy_072403.1573 folded -
assi (attr store1 < 0.856 and attr store1 > 0.656 )
     ((attr store1 < 1.882 and attr store1 > 1.782 ) and 
      (bondedto (attr store1 < 128.561810435  and attr store1 > 127.361810435 ) or 
       bondedto (attr store1 < 33.0820631883  and attr store1 > 31.8820631883 ))) 
6 0.1 0.1 peak 1573 volume 6.7821 ppm1 1.832 ppm2 0.756
 
! ############### hot_mothernoesy_072403.1574 folded -
assi (attr store1 < 4.327 and attr store1 > 4.127 )
     ((attr store1 < 3.036 and attr store1 > 2.936 ) and 
      (bondedto (attr store1 < 128.454810435  and attr store1 > 127.254810435 ) or 
       bondedto (attr store1 < 32.9750631883  and attr store1 > 31.7750631883 ))) 
6 0.1 0.1 peak 1574 volume 3.1661 ppm1 2.986 ppm2 4.227
 
! ############### hot_mothernoesy_072403.1575 folded -
assi (attr store1 < 3.096 and attr store1 > 2.896 )
     ((attr store1 < 3.035 and attr store1 > 2.935 ) and 
      (bondedto (attr store1 < 128.400810435  and attr store1 > 127.200810435 ) or 
       bondedto (attr store1 < 32.9210631883  and attr store1 > 31.7210631883 ))) 
6 0.1 0.1 peak 1575 volume 48.4348 ppm1 2.985 ppm2 2.996
 
! ############### hot_mothernoesy_072403.1576 folded -
assi (attr store1 < 2.498 and attr store1 > 2.298 )
     ((attr store1 < 3.036 and attr store1 > 2.936 ) and 
      (bondedto (attr store1 < 128.425810435  and attr store1 > 127.225810435 ) or 
       bondedto (attr store1 < 32.9460631883  and attr store1 > 31.7460631883 ))) 
6 0.1 0.1 peak 1576 volume 7.0637 ppm1 2.986 ppm2 2.398
 
! ############### hot_mothernoesy_072403.1577 folded -
assi (attr store1 < 2.231 and attr store1 > 2.031 )
     ((attr store1 < 3.036 and attr store1 > 2.936 ) and 
      (bondedto (attr store1 < 128.430810435  and attr store1 > 127.230810435 ) or 
       bondedto (attr store1 < 32.9510631883  and attr store1 > 31.7510631883 ))) 
6 0.1 0.1 peak 1577 volume 10.4382 ppm1 2.986 ppm2 2.131
 
! ############### hot_mothernoesy_072403.1578 folded -
assi (attr store1 < 2.231 and attr store1 > 2.031 )
     ((attr store1 < 3.007 and attr store1 > 2.907 ) and 
      (bondedto (attr store1 < 128.417810435  and attr store1 > 127.217810435 ) or 
       bondedto (attr store1 < 32.9380631883  and attr store1 > 31.7380631883 ))) 
6 0.1 0.1 peak 1578 volume 11.3028 ppm1 2.957 ppm2 2.131
 
! ############### hot_mothernoesy_072403.1579 folded -
assi (attr store1 < 4.313 and attr store1 > 4.113 )
     ((attr store1 < 2.999 and attr store1 > 2.899 ) and 
      (bondedto (attr store1 < 128.423810435  and attr store1 > 127.223810435 ) or 
       bondedto (attr store1 < 32.9440631883  and attr store1 > 31.7440631883 ))) 
6 0.1 0.1 peak 1579 volume 3.1794 ppm1 2.949 ppm2 4.213
 
! ############### hot_mothernoesy_072403.1580 folded -
assi (attr store1 < 3.043 and attr store1 > 2.843 )
     ((attr store1 < 3.003 and attr store1 > 2.903 ) and 
      (bondedto (attr store1 < 128.390810435  and attr store1 > 127.190810435 ) or 
       bondedto (attr store1 < 32.9110631883  and attr store1 > 31.7110631883 ))) 
6 0.1 0.1 peak 1580 volume 53.0626 ppm1 2.953 ppm2 2.943
 
! ############### hot_mothernoesy_072403.1581 folded -
assi (attr store1 < 2.482 and attr store1 > 2.282 )
     ((attr store1 < 2.996 and attr store1 > 2.896 ) and 
      (bondedto (attr store1 < 128.393810435  and attr store1 > 127.193810435 ) or 
       bondedto (attr store1 < 32.9140631883  and attr store1 > 31.7140631883 ))) 
6 0.1 0.1 peak 1581 volume 7.3321 ppm1 2.946 ppm2 2.382
 
! ############### hot_mothernoesy_072403.1582 folded -
assi (attr store1 < 2.506 and attr store1 > 2.306 )
     ((attr store1 < 2.987 and attr store1 > 2.887 ) and 
      (bondedto (attr store1 < 128.399810435  and attr store1 > 127.199810435 ) or 
       bondedto (attr store1 < 32.9200631883  and attr store1 > 31.7200631883 ))) 
6 0.1 0.1 peak 1582 volume 7.3031 ppm1 2.937 ppm2 2.406
 
! ############### hot_mothernoesy_072403.1583 folded +
assi (attr store1 < 1.903 and attr store1 > 1.703 )
     ((attr store1 < 4.352 and attr store1 > 4.252 ) and 
      (bondedto (attr store1 < 104.223873623  and attr store1 > 103.023873623 ) or 
       bondedto (attr store1 < 56.484  and attr store1 > 55.284 ) or 
       bondedto (attr store1 < 8.7441263766  and attr store1 > 7.5441263766 ))) 
6 0.1 0.1 peak 1583 volume 13.12310 ppm1 4.302 ppm2 1.803
 
! ############### hot_mothernoesy_072403.1584 folded +
assi (attr store1 < 1.75 and attr store1 > 1.55 )
     ((attr store1 < 4.331 and attr store1 > 4.231 ) and 
      (bondedto (attr store1 < 104.251873623  and attr store1 > 103.051873623 ) or 
       bondedto (attr store1 < 56.512  and attr store1 > 55.312 ) or 
       bondedto (attr store1 < 8.7721263766  and attr store1 > 7.5721263766 ))) 
6 0.1 0.1 peak 1584 volume 12.07880 ppm1 4.281 ppm2 1.650
 
! ############### hot_mothernoesy_072403.1585 folded +
assi (attr store1 < 1.085 and attr store1 > 0.885 )
     ((attr store1 < 4.329 and attr store1 > 4.229 ) and 
      (bondedto (attr store1 < 104.235873623  and attr store1 > 103.035873623 ) or 
       bondedto (attr store1 < 56.496  and attr store1 > 55.296 ) or 
       bondedto (attr store1 < 8.7561263766  and attr store1 > 7.5561263766 ))) 
6 0.1 0.1 peak 1585 volume 7.07720 ppm1 4.279 ppm2 0.985
 
! ############### hot_mothernoesy_072403.1586 folded +
assi (attr store1 < 1.002 and attr store1 > 0.802 )
     ((attr store1 < 4.329 and attr store1 > 4.229 ) and 
      (bondedto (attr store1 < 104.261873623  and attr store1 > 103.061873623 ) or 
       bondedto (attr store1 < 56.522  and attr store1 > 55.322 ) or 
       bondedto (attr store1 < 8.7821263766  and attr store1 > 7.5821263766 ))) 
6 0.1 0.1 peak 1586 volume 25.96080 ppm1 4.279 ppm2 0.902
 
! ############### hot_mothernoesy_072403.1587 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 3.74 and attr store1 > 3.64 ) and 
      (bondedto (attr store1 < 104.199873623  and attr store1 > 102.999873623 ) or 
       bondedto (attr store1 < 56.46  and attr store1 > 55.26 ) or 
       bondedto (attr store1 < 8.7201263766  and attr store1 > 7.5201263766 ))) 
6 0.1 0.1 peak 1587 volume 4.94030 ppm1 3.690 ppm2 4.774
 
! ############### hot_mothernoesy_072403.1588 folded +
assi (attr store1 < 3.784 and attr store1 > 3.584 )
     ((attr store1 < 3.732 and attr store1 > 3.632 ) and 
      (bondedto (attr store1 < 104.213873623  and attr store1 > 103.013873623 ) or 
       bondedto (attr store1 < 56.474  and attr store1 > 55.274 ) or 
       bondedto (attr store1 < 8.7341263766  and attr store1 > 7.5341263766 ))) 
6 0.1 0.1 peak 1588 volume 6.36280 ppm1 3.682 ppm2 3.684
 
! ############### hot_mothernoesy_072403.1589 folded -
assi (attr store1 < 2.55 and attr store1 > 2.35 )
     ((attr store1 < 2.489 and attr store1 > 2.389 ) and 
      (bondedto (attr store1 < 128.148810435  and attr store1 > 126.948810435 ) or 
       bondedto (attr store1 < 32.6690631883  and attr store1 > 31.4690631883 ))) 
6 0.1 0.1 peak 1589 volume 243.1152 ppm1 2.439 ppm2 2.450
 
! ############### hot_mothernoesy_072403.1590 folded -
assi (attr store1 < 3.711 and attr store1 > 3.511 )
     ((attr store1 < 2.374 and attr store1 > 2.274 ) and 
      (bondedto (attr store1 < 128.105810435  and attr store1 > 126.905810435 ) or 
       bondedto (attr store1 < 32.6260631883  and attr store1 > 31.4260631883 ))) 
6 0.1 0.1 peak 1590 volume 5.6109 ppm1 2.324 ppm2 3.611
 
! ############### hot_mothernoesy_072403.1591 folded -
assi (attr store1 < 4.517 and attr store1 > 4.317 )
     ((attr store1 < 2.36 and attr store1 > 2.26 ) and 
      (bondedto (attr store1 < 128.130810435  and attr store1 > 126.930810435 ) or 
       bondedto (attr store1 < 32.6510631883  and attr store1 > 31.4510631883 ))) 
6 0.1 0.1 peak 1591 volume 27.9485 ppm1 2.310 ppm2 4.417
 
! ############### hot_mothernoesy_072403.1592 folded -
assi (attr store1 < 4.406 and attr store1 > 4.206 )
     ((attr store1 < 2.363 and attr store1 > 2.263 ) and 
      (bondedto (attr store1 < 128.088810435  and attr store1 > 126.888810435 ) or 
       bondedto (attr store1 < 32.6090631883  and attr store1 > 31.4090631883 ))) 
6 0.1 0.1 peak 1592 volume 7.6638 ppm1 2.313 ppm2 4.306
 
! ############### hot_mothernoesy_072403.1593 folded -
assi (attr store1 < 3.938 and attr store1 > 3.738 )
     ((attr store1 < 2.355 and attr store1 > 2.255 ) and 
      (bondedto (attr store1 < 128.103810435  and attr store1 > 126.903810435 ) or 
       bondedto (attr store1 < 32.6240631883  and attr store1 > 31.4240631883 ))) 
6 0.1 0.1 peak 1593 volume 5.5292 ppm1 2.305 ppm2 3.838
 
! ############### hot_mothernoesy_072403.1594 folded -
assi (attr store1 < 2.411 and attr store1 > 2.211 )
     ((attr store1 < 2.361 and attr store1 > 2.261 ) and 
      (bondedto (attr store1 < 128.126810435  and attr store1 > 126.926810435 ) or 
       bondedto (attr store1 < 32.6470631883  and attr store1 > 31.4470631883 ))) 
6 0.1 0.1 peak 1594 volume 735.35968 ppm1 2.311 ppm2 2.311
 
! ############### hot_mothernoesy_072403.1595 folded -
assi (attr store1 < 2.009 and attr store1 > 1.809 )
     ((attr store1 < 2.361 and attr store1 > 2.261 ) and 
      (bondedto (attr store1 < 128.129810435  and attr store1 > 126.929810435 ) or 
       bondedto (attr store1 < 32.6500631883  and attr store1 > 31.4500631883 ))) 
6 0.1 0.1 peak 1595 volume 170.0119 ppm1 2.311 ppm2 1.909
 
! ############### hot_mothernoesy_072403.1597 folded -
assi (attr store1 < 4.02 and attr store1 > 3.82 )
     ((attr store1 < 1.952 and attr store1 > 1.852 ) and 
      (bondedto (attr store1 < 128.105810435  and attr store1 > 126.905810435 ) or 
       bondedto (attr store1 < 32.6260631883  and attr store1 > 31.4260631883 ))) 
6 0.1 0.1 peak 1597 volume 10.4074 ppm1 1.902 ppm2 3.920
 
! ############### hot_mothernoesy_072403.1598 folded -
assi (attr store1 < 3.938 and attr store1 > 3.738 )
     ((attr store1 < 1.957 and attr store1 > 1.857 ) and 
      (bondedto (attr store1 < 128.139810435  and attr store1 > 126.939810435 ) or 
       bondedto (attr store1 < 32.6600631883  and attr store1 > 31.4600631883 ))) 
6 0.1 0.1 peak 1598 volume 7.3696 ppm1 1.907 ppm2 3.838
 
! ############### hot_mothernoesy_072403.1600 folded -
assi (attr store1 < 2.41 and attr store1 > 2.21 )
     ((attr store1 < 1.957 and attr store1 > 1.857 ) and 
      (bondedto (attr store1 < 128.123810435  and attr store1 > 126.923810435 ) or 
       bondedto (attr store1 < 32.6440631883  and attr store1 > 31.4440631883 ))) 
6 0.1 0.1 peak 1600 volume 161.35809 ppm1 1.907 ppm2 2.310
 
! ############### hot_mothernoesy_072403.1601 folded -
assi (attr store1 < 2.142 and attr store1 > 1.942 )
     ((attr store1 < 1.955 and attr store1 > 1.855 ) and 
      (bondedto (attr store1 < 128.127810435  and attr store1 > 126.927810435 ) or 
       bondedto (attr store1 < 32.6480631883  and attr store1 > 31.4480631883 ))) 
6 0.1 0.1 peak 1601 volume 93.5079 ppm1 1.905 ppm2 2.042
 
! ############### hot_mothernoesy_072403.1602 folded -
assi (attr store1 < 2.008 and attr store1 > 1.808 )
     ((attr store1 < 1.959 and attr store1 > 1.859 ) and 
      (bondedto (attr store1 < 128.134810435  and attr store1 > 126.934810435 ) or 
       bondedto (attr store1 < 32.6550631883  and attr store1 > 31.4550631883 ))) 
6 0.1 0.1 peak 1602 volume 441.2731 ppm1 1.909 ppm2 1.908
 
! ############### hot_mothernoesy_072403.1603 folded +
assi (attr store1 < 2.513 and attr store1 > 2.313 )
     ((attr store1 < 4.381 and attr store1 > 4.281 ) and 
      (bondedto (attr store1 < 104.126873623  and attr store1 > 102.926873623 ) or 
       bondedto (attr store1 < 56.387  and attr store1 > 55.187 ) or 
       bondedto (attr store1 < 8.6471263766  and attr store1 > 7.4471263766 ))) 
6 0.1 0.1 peak 1603 volume 23.94040 ppm1 4.331 ppm2 2.413
 
! ############### hot_mothernoesy_072403.1604 folded +
assi (attr store1 < 2.29 and attr store1 > 2.09 )
     ((attr store1 < 4.381 and attr store1 > 4.281 ) and 
      (bondedto (attr store1 < 104.130873623  and attr store1 > 102.930873623 ) or 
       bondedto (attr store1 < 56.391  and attr store1 > 55.191 ) or 
       bondedto (attr store1 < 8.6511263766  and attr store1 > 7.4511263766 ))) 
6 0.1 0.1 peak 1604 volume 20.47120 ppm1 4.331 ppm2 2.190
 
! ############### hot_mothernoesy_072403.1605 folded -
assi (attr store1 < 1.637 and attr store1 > 1.437 )
     ((attr store1 < 2.554 and attr store1 > 2.454 ) and 
      (bondedto (attr store1 < 128.063810435  and attr store1 > 126.863810435 ) or 
       bondedto (attr store1 < 32.5840631883  and attr store1 > 31.3840631883 ))) 
6 0.1 0.1 peak 1605 volume 12.6395 ppm1 2.504 ppm2 1.537
 
! ############### hot_mothernoesy_072403.1606 folded -
assi (attr store1 < 3.956 and attr store1 > 3.756 )
     ((attr store1 < 2.544 and attr store1 > 2.444 ) and 
      (bondedto (attr store1 < 128.037810435  and attr store1 > 126.837810435 ) or 
       bondedto (attr store1 < 32.5580631883  and attr store1 > 31.3580631883 ))) 
6 0.1 0.1 peak 1606 volume 4.4873 ppm1 2.494 ppm2 3.856
 
! ############### hot_mothernoesy_072403.1607 folded -
assi (attr store1 < 4.462 and attr store1 > 4.262 )
     ((attr store1 < 2.525 and attr store1 > 2.425 ) and 
      (bondedto (attr store1 < 128.031810435  and attr store1 > 126.831810435 ) or 
       bondedto (attr store1 < 32.5520631883  and attr store1 > 31.3520631883 ))) 
6 0.1 0.1 peak 1607 volume 7.1504 ppm1 2.475 ppm2 4.362
 
! ############### hot_mothernoesy_072403.1608 folded -
assi (attr store1 < 1.911 and attr store1 > 1.711 )
     ((attr store1 < 2.527 and attr store1 > 2.427 ) and 
      (bondedto (attr store1 < 128.035810435  and attr store1 > 126.835810435 ) or 
       bondedto (attr store1 < 32.5560631883  and attr store1 > 31.3560631883 ))) 
6 0.1 0.1 peak 1608 volume 13.2762 ppm1 2.477 ppm2 1.811
 
! ############### hot_mothernoesy_072403.1609 folded -
assi (attr store1 < 1.788 and attr store1 > 1.588 )
     ((attr store1 < 2.526 and attr store1 > 2.426 ) and 
      (bondedto (attr store1 < 128.036810435  and attr store1 > 126.836810435 ) or 
       bondedto (attr store1 < 32.5570631883  and attr store1 > 31.3570631883 ))) 
6 0.1 0.1 peak 1609 volume 5.1446 ppm1 2.476 ppm2 1.688
 
! ############### hot_mothernoesy_072403.1610 folded -
assi (attr store1 < 1.025 and attr store1 > 0.825 )
     ((attr store1 < 2.536 and attr store1 > 2.436 ) and 
      (bondedto (attr store1 < 128.009810435  and attr store1 > 126.809810435 ) or 
       bondedto (attr store1 < 32.5300631883  and attr store1 > 31.3300631883 ))) 
6 0.1 0.1 peak 1610 volume 4.5276 ppm1 2.486 ppm2 0.925
 
! ############### hot_mothernoesy_072403.1611 folded -
assi (attr store1 < 1.99 and attr store1 > 1.79 )
     ((attr store1 < 2.513 and attr store1 > 2.413 ) and 
      (bondedto (attr store1 < 128.007810435  and attr store1 > 126.807810435 ) or 
       bondedto (attr store1 < 32.5280631883  and attr store1 > 31.3280631883 ))) 
6 0.1 0.1 peak 1611 volume 11.6774 ppm1 2.463 ppm2 1.890
 
! ############### hot_mothernoesy_072403.1612 folded -
assi (attr store1 < 1.966 and attr store1 > 1.766 )
     ((attr store1 < 2.457 and attr store1 > 2.357 ) and 
      (bondedto (attr store1 < 128.017810435  and attr store1 > 126.817810435 ) or 
       bondedto (attr store1 < 32.5380631883  and attr store1 > 31.3380631883 ))) 
6 0.1 0.1 peak 1612 volume 9.8279 ppm1 2.407 ppm2 1.866
 
! ############### hot_mothernoesy_072403.1613 folded -
assi (attr store1 < 1.893 and attr store1 > 1.693 )
     ((attr store1 < 2.45 and attr store1 > 2.35 ) and 
      (bondedto (attr store1 < 128.047810435  and attr store1 > 126.847810435 ) or 
       bondedto (attr store1 < 32.5680631883  and attr store1 > 31.3680631883 ))) 
6 0.1 0.1 peak 1613 volume 5.2064 ppm1 2.400 ppm2 1.793
 
! ############### hot_mothernoesy_072403.1614 folded -
assi (attr store1 < 4.024 and attr store1 > 3.824 )
     ((attr store1 < 2.366 and attr store1 > 2.266 ) and 
      (bondedto (attr store1 < 128.053810435  and attr store1 > 126.853810435 ) or 
       bondedto (attr store1 < 32.5740631883  and attr store1 > 31.3740631883 ))) 
6 0.1 0.1 peak 1614 volume 10.1212 ppm1 2.316 ppm2 3.924
 
! ############### hot_mothernoesy_072403.1615 folded -
assi (attr store1 < 4.301 and attr store1 > 4.101 )
     ((attr store1 < 2.255 and attr store1 > 2.155 ) and 
      (bondedto (attr store1 < 128.023810435  and attr store1 > 126.823810435 ) or 
       bondedto (attr store1 < 32.5440631883  and attr store1 > 31.3440631883 ))) 
6 0.1 0.1 peak 1615 volume 8.5726 ppm1 2.205 ppm2 4.201
 
! ############### hot_mothernoesy_072403.1616 folded -
assi (attr store1 < 1.99 and attr store1 > 1.79 )
     ((attr store1 < 2.255 and attr store1 > 2.155 ) and 
      (bondedto (attr store1 < 128.030810435  and attr store1 > 126.830810435 ) or 
       bondedto (attr store1 < 32.5510631883  and attr store1 > 31.3510631883 ))) 
6 0.1 0.1 peak 1616 volume 19.8255 ppm1 2.205 ppm2 1.890
 
! ############### hot_mothernoesy_072403.1617 folded -
assi (attr store1 < 1.118 and attr store1 > 0.918 )
     ((attr store1 < 1.963 and attr store1 > 1.863 ) and 
      (bondedto (attr store1 < 128.007810435  and attr store1 > 126.807810435 ) or 
       bondedto (attr store1 < 32.5280631883  and attr store1 > 31.3280631883 ))) 
6 0.1 0.1 peak 1617 volume 6.702 ppm1 1.913 ppm2 1.018
 
! ############### hot_mothernoesy_072403.1618 folded -
assi (attr store1 < 1.115 and attr store1 > 0.915 )
     ((attr store1 < 1.94 and attr store1 > 1.84 ) and 
      (bondedto (attr store1 < 128.027810435  and attr store1 > 126.827810435 ) or 
       bondedto (attr store1 < 32.5480631883  and attr store1 > 31.3480631883 ))) 
6 0.1 0.1 peak 1618 volume 8.0746 ppm1 1.890 ppm2 1.015
 
! ############### hot_mothernoesy_072403.1619 folded -
assi (attr store1 < 2.304 and attr store1 > 2.104 )
     ((attr store1 < 1.934 and attr store1 > 1.834 ) and 
      (bondedto (attr store1 < 128.041810435  and attr store1 > 126.841810435 ) or 
       bondedto (attr store1 < 32.5620631883  and attr store1 > 31.3620631883 ))) 
6 0.1 0.1 peak 1619 volume 22.0508 ppm1 1.884 ppm2 2.204
 
! ############### hot_mothernoesy_072403.1620 folded -
assi (attr store1 < 1.116 and attr store1 > 0.916 )
     ((attr store1 < 1.923 and attr store1 > 1.823 ) and 
      (bondedto (attr store1 < 128.015810435  and attr store1 > 126.815810435 ) or 
       bondedto (attr store1 < 32.5360631883  and attr store1 > 31.3360631883 ))) 
6 0.1 0.1 peak 1620 volume 7.7193 ppm1 1.873 ppm2 1.016
 
! ############### hot_mothernoesy_072403.1621 folded -
assi (attr store1 < 2.579 and attr store1 > 2.379 )
     ((attr store1 < 1.862 and attr store1 > 1.762 ) and 
      (bondedto (attr store1 < 128.028810435  and attr store1 > 126.828810435 ) or 
       bondedto (attr store1 < 32.5490631883  and attr store1 > 31.3490631883 ))) 
6 0.1 0.1 peak 1621 volume 10.6977 ppm1 1.812 ppm2 2.479
 
! ############### hot_mothernoesy_072403.1622 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 4.361 and attr store1 > 4.261 ) and 
      (bondedto (attr store1 < 103.956873623  and attr store1 > 102.756873623 ) or 
       bondedto (attr store1 < 56.217  and attr store1 > 55.017 ) or 
       bondedto (attr store1 < 8.4771263766  and attr store1 > 7.2771263766 ))) 
6 0.1 0.1 peak 1622 volume 7.75910 ppm1 4.311 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1623 folded +
assi (attr store1 < 2.409 and attr store1 > 2.209 )
     ((attr store1 < 4.363 and attr store1 > 4.263 ) and 
      (bondedto (attr store1 < 103.996873623  and attr store1 > 102.796873623 ) or 
       bondedto (attr store1 < 56.257  and attr store1 > 55.057 ) or 
       bondedto (attr store1 < 8.5171263766  and attr store1 > 7.3171263766 ))) 
6 0.1 0.1 peak 1623 volume 22.63630 ppm1 4.313 ppm2 2.309
 
! ############### hot_mothernoesy_072403.1624 folded +
assi (attr store1 < 2.17 and attr store1 > 1.97 )
     ((attr store1 < 4.369 and attr store1 > 4.269 ) and 
      (bondedto (attr store1 < 103.977873623  and attr store1 > 102.777873623 ) or 
       bondedto (attr store1 < 56.238  and attr store1 > 55.038 ) or 
       bondedto (attr store1 < 8.4981263766  and attr store1 > 7.2981263766 ))) 
6 0.1 0.1 peak 1624 volume 19.31540 ppm1 4.319 ppm2 2.070
 
! ############### hot_mothernoesy_072403.1625 folded +
assi (attr store1 < 2.041 and attr store1 > 1.841 )
     ((attr store1 < 4.363 and attr store1 > 4.263 ) and 
      (bondedto (attr store1 < 103.993873623  and attr store1 > 102.793873623 ) or 
       bondedto (attr store1 < 56.254  and attr store1 > 55.054 ) or 
       bondedto (attr store1 < 8.5141263766  and attr store1 > 7.3141263766 ))) 
6 0.1 0.1 peak 1625 volume 15.76560 ppm1 4.313 ppm2 1.941
 
! ############### hot_mothernoesy_072403.1626 folded +
assi (attr store1 < 3.878 and attr store1 > 3.678 )
     ((attr store1 < 3.828 and attr store1 > 3.728 ) and 
      (bondedto (attr store1 < 103.937873623  and attr store1 > 102.737873623 ) or 
       bondedto (attr store1 < 56.198  and attr store1 > 54.998 ) or 
       bondedto (attr store1 < 8.4581263766  and attr store1 > 7.2581263766 ))) 
6 0.1 0.1 peak 1626 volume 26.01610 ppm1 3.778 ppm2 3.778
 
! ############### hot_mothernoesy_072403.1627 folded +
assi (attr store1 < 1.486 and attr store1 > 1.286 )
     ((attr store1 < 3.824 and attr store1 > 3.724 ) and 
      (bondedto (attr store1 < 103.990873623  and attr store1 > 102.790873623 ) or 
       bondedto (attr store1 < 56.251  and attr store1 > 55.051 ) or 
       bondedto (attr store1 < 8.5111263766  and attr store1 > 7.3111263766 ))) 
6 0.1 0.1 peak 1627 volume 4.52350 ppm1 3.774 ppm2 1.386
 
! ############### hot_mothernoesy_072403.1629 folded +
assi (attr store1 < 1.037 and attr store1 > 0.837 )
     ((attr store1 < 3.82 and attr store1 > 3.72 ) and 
      (bondedto (attr store1 < 103.981873623  and attr store1 > 102.781873623 ) or 
       bondedto (attr store1 < 56.242  and attr store1 > 55.042 ) or 
       bondedto (attr store1 < 8.5021263766  and attr store1 > 7.3021263766 ))) 
6 0.1 0.1 peak 1629 volume 6.90750 ppm1 3.770 ppm2 0.937
 
! ############### hot_mothernoesy_072403.1630 folded +
assi (attr store1 < 4.635 and attr store1 > 4.435 )
     ((attr store1 < 4.366 and attr store1 > 4.266 ) and 
      (bondedto (attr store1 < 103.911873623  and attr store1 > 102.711873623 ) or 
       bondedto (attr store1 < 56.172  and attr store1 > 54.972 ) or 
       bondedto (attr store1 < 8.4321263766  and attr store1 > 7.2321263766 ))) 
6 0.1 0.1 peak 1630 volume 4.80810 ppm1 4.316 ppm2 4.535
 
! ############### hot_mothernoesy_072403.1631 folded +
assi (attr store1 < 4.415 and attr store1 > 4.215 )
     ((attr store1 < 4.363 and attr store1 > 4.263 ) and 
      (bondedto (attr store1 < 103.889873623  and attr store1 > 102.689873623 ) or 
       bondedto (attr store1 < 56.15  and attr store1 > 54.95 ) or 
       bondedto (attr store1 < 8.4101263766  and attr store1 > 7.2101263766 ))) 
6 0.1 0.1 peak 1631 volume 728.08081 ppm1 4.313 ppm2 4.315
 
! ############### hot_mothernoesy_072403.1634 folded -
assi (attr store1 < 1.239 and attr store1 > 1.039 )
     ((attr store1 < 2.359 and attr store1 > 2.259 ) and 
      (bondedto (attr store1 < 127.713810435  and attr store1 > 126.513810435 ) or 
       bondedto (attr store1 < 32.2340631883  and attr store1 > 31.0340631883 ))) 
6 0.1 0.1 peak 1634 volume 16.7827 ppm1 2.309 ppm2 1.139
 
! ############### hot_mothernoesy_072403.1635 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 3.963 and attr store1 > 3.863 ) and 
      (bondedto (attr store1 < 103.735873623  and attr store1 > 102.535873623 ) or 
       bondedto (attr store1 < 55.996  and attr store1 > 54.796 ) or 
       bondedto (attr store1 < 8.2561263766  and attr store1 > 7.0561263766 ))) 
6 0.1 0.1 peak 1635 volume 21.62460 ppm1 3.913 ppm2 4.773
 
! ############### hot_mothernoesy_072403.1636 folded +
assi (attr store1 < 4.015 and attr store1 > 3.815 )
     ((attr store1 < 3.964 and attr store1 > 3.864 ) and 
      (bondedto (attr store1 < 103.736873623  and attr store1 > 102.536873623 ) or 
       bondedto (attr store1 < 55.997  and attr store1 > 54.797 ) or 
       bondedto (attr store1 < 8.2571263766  and attr store1 > 7.0571263766 ))) 
6 0.1 0.1 peak 1636 volume 676.89880 ppm1 3.914 ppm2 3.915
 
! ############### hot_mothernoesy_072403.1637 folded +
assi (attr store1 < 2.111 and attr store1 > 1.911 )
     ((attr store1 < 3.958 and attr store1 > 3.858 ) and 
      (bondedto (attr store1 < 103.745873623  and attr store1 > 102.545873623 ) or 
       bondedto (attr store1 < 56.006  and attr store1 > 54.806 ) or 
       bondedto (attr store1 < 8.2661263766  and attr store1 > 7.0661263766 ))) 
6 0.1 0.1 peak 1637 volume 13.77050 ppm1 3.908 ppm2 2.011
 
! ############### hot_mothernoesy_072403.1638 folded +
assi (attr store1 < 2.086 and attr store1 > 1.886 )
     ((attr store1 < 3.965 and attr store1 > 3.865 ) and 
      (bondedto (attr store1 < 103.739873623  and attr store1 > 102.539873623 ) or 
       bondedto (attr store1 < 56.0  and attr store1 > 54.8 ) or 
       bondedto (attr store1 < 8.2601263766  and attr store1 > 7.0601263766 ))) 
6 0.1 0.1 peak 1638 volume 15.62110 ppm1 3.915 ppm2 1.986
 
! ############### hot_mothernoesy_072403.1639 folded +
assi (attr store1 < 1.746 and attr store1 > 1.546 )
     ((attr store1 < 2.982 and attr store1 > 2.882 ) and 
      (bondedto (attr store1 < 103.759873623  and attr store1 > 102.559873623 ) or 
       bondedto (attr store1 < 56.02  and attr store1 > 54.82 ) or 
       bondedto (attr store1 < 8.2801263766  and attr store1 > 7.0801263766 ))) 
6 0.1 0.1 peak 1639 volume 4.23920 ppm1 2.932 ppm2 1.646
 
! ############### hot_mothernoesy_072403.1640 folded +
assi (attr store1 < 2.174 and attr store1 > 1.974 )
     ((attr store1 < 2.972 and attr store1 > 2.872 ) and 
      (bondedto (attr store1 < 103.733873623  and attr store1 > 102.533873623 ) or 
       bondedto (attr store1 < 55.994  and attr store1 > 54.794 ) or 
       bondedto (attr store1 < 8.2541263766  and attr store1 > 7.0541263766 ))) 
6 0.1 0.1 peak 1640 volume 3.30560 ppm1 2.922 ppm2 2.074
 
! ############### hot_mothernoesy_072403.1641 folded +
assi (attr store1 < 1.564 and attr store1 > 1.364 )
     ((attr store1 < 2.97 and attr store1 > 2.87 ) and 
      (bondedto (attr store1 < 103.735873623  and attr store1 > 102.535873623 ) or 
       bondedto (attr store1 < 55.996  and attr store1 > 54.796 ) or 
       bondedto (attr store1 < 8.2561263766  and attr store1 > 7.0561263766 ))) 
6 0.1 0.1 peak 1641 volume 15.71740 ppm1 2.920 ppm2 1.464
 
! ############### hot_mothernoesy_072403.1642 folded +
assi (attr store1 < 3.011 and attr store1 > 2.811 )
     ((attr store1 < 2.962 and attr store1 > 2.862 ) and 
      (bondedto (attr store1 < 103.747873623  and attr store1 > 102.547873623 ) or 
       bondedto (attr store1 < 56.008  and attr store1 > 54.808 ) or 
       bondedto (attr store1 < 8.2681263766  and attr store1 > 7.0681263766 ))) 
6 0.1 0.1 peak 1642 volume 15.89180 ppm1 2.912 ppm2 2.911
 
! ############### hot_mothernoesy_072403.1643 folded -
assi (attr store1 < 2.765 and attr store1 > 2.565 )
     ((attr store1 < 2.713 and attr store1 > 2.613 ) and 
      (bondedto (attr store1 < 127.620810435  and attr store1 > 126.420810435 ) or 
       bondedto (attr store1 < 32.1410631883  and attr store1 > 30.9410631883 ))) 
6 0.1 0.1 peak 1643 volume 203.7316 ppm1 2.663 ppm2 2.665
 
! ############### hot_mothernoesy_072403.1644 folded -
assi (attr store1 < 1.113 and attr store1 > 0.913 )
     ((attr store1 < 2.37 and attr store1 > 2.27 ) and 
      (bondedto (attr store1 < 127.686810435  and attr store1 > 126.486810435 ) or 
       bondedto (attr store1 < 32.2070631883  and attr store1 > 31.0070631883 ))) 
6 0.1 0.1 peak 1644 volume 29.6794 ppm1 2.320 ppm2 1.013
 
! ############### hot_mothernoesy_072403.1645 folded +
assi (attr store1 < 2.559 and attr store1 > 2.359 )
     ((attr store1 < 3.963 and attr store1 > 3.863 ) and 
      (bondedto (attr store1 < 103.682873623  and attr store1 > 102.482873623 ) or 
       bondedto (attr store1 < 55.943  and attr store1 > 54.743 ) or 
       bondedto (attr store1 < 8.2031263766  and attr store1 > 7.0031263766 ))) 
6 0.1 0.1 peak 1645 volume 3.23200 ppm1 3.913 ppm2 2.459
 
! ############### hot_mothernoesy_072403.1646 folded +
assi (attr store1 < 1.746 and attr store1 > 1.546 )
     ((attr store1 < 2.961 and attr store1 > 2.861 ) and 
      (bondedto (attr store1 < 103.728873623  and attr store1 > 102.528873623 ) or 
       bondedto (attr store1 < 55.989  and attr store1 > 54.789 ) or 
       bondedto (attr store1 < 8.2491263766  and attr store1 > 7.0491263766 ))) 
6 0.1 0.1 peak 1646 volume 4.80540 ppm1 2.911 ppm2 1.646
 
! ############### hot_mothernoesy_072403.1647 folded -
assi (attr store1 < 1.482 and attr store1 > 1.282 )
     ((attr store1 < 2.112 and attr store1 > 2.012 ) and 
      (bondedto (attr store1 < 127.473810435  and attr store1 > 126.273810435 ) or 
       bondedto (attr store1 < 31.9940631883  and attr store1 > 30.7940631883 ))) 
6 0.1 0.1 peak 1647 volume 3.2574 ppm1 2.062 ppm2 1.382
 
! ############### hot_mothernoesy_072403.1648 folded +
assi (attr store1 < 1.449 and attr store1 > 1.249 )
     ((attr store1 < 4.021 and attr store1 > 3.921 ) and 
      (bondedto (attr store1 < 103.497873623  and attr store1 > 102.297873623 ) or 
       bondedto (attr store1 < 55.758  and attr store1 > 54.558 ) or 
       bondedto (attr store1 < 8.0181263766  and attr store1 > 6.8181263766 ))) 
6 0.1 0.1 peak 1648 volume 7.40880 ppm1 3.971 ppm2 1.349
 
! ############### hot_mothernoesy_072403.1649 folded +
assi (attr store1 < 1.043 and attr store1 > 0.843 )
     ((attr store1 < 4.018 and attr store1 > 3.918 ) and 
      (bondedto (attr store1 < 103.497873623  and attr store1 > 102.297873623 ) or 
       bondedto (attr store1 < 55.758  and attr store1 > 54.558 ) or 
       bondedto (attr store1 < 8.0181263766  and attr store1 > 6.8181263766 ))) 
6 0.1 0.1 peak 1649 volume 4.26780 ppm1 3.968 ppm2 0.943
 
! ############### hot_mothernoesy_072403.1650 folded -
assi (attr store1 < 1.486 and attr store1 > 1.286 )
     ((attr store1 < 2.341 and attr store1 > 2.241 ) and 
      (bondedto (attr store1 < 127.367810435  and attr store1 > 126.167810435 ) or 
       bondedto (attr store1 < 31.8880631883  and attr store1 > 30.6880631883 ))) 
6 0.1 0.1 peak 1650 volume 6.8972 ppm1 2.291 ppm2 1.386
 
! ############### hot_mothernoesy_072403.1651 folded -
assi (attr store1 < 1.481 and attr store1 > 1.281 )
     ((attr store1 < 2.327 and attr store1 > 2.227 ) and 
      (bondedto (attr store1 < 127.367810435  and attr store1 > 126.167810435 ) or 
       bondedto (attr store1 < 31.8880631883  and attr store1 > 30.6880631883 ))) 
6 0.1 0.1 peak 1651 volume 6.9622 ppm1 2.277 ppm2 1.381
 
! ############### hot_mothernoesy_072403.1652 folded -
assi (attr store1 < 1.044 and attr store1 > 0.844 )
     ((attr store1 < 2.327 and attr store1 > 2.227 ) and 
      (bondedto (attr store1 < 127.367810435  and attr store1 > 126.167810435 ) or 
       bondedto (attr store1 < 31.8880631883  and attr store1 > 30.6880631883 ))) 
6 0.1 0.1 peak 1652 volume 11.2327 ppm1 2.277 ppm2 0.944
 
! ############### hot_mothernoesy_072403.1653 folded -
assi (attr store1 < 0.829 and attr store1 > 0.629 )
     ((attr store1 < 2.124 and attr store1 > 2.024 ) and 
      (bondedto (attr store1 < 127.367810435  and attr store1 > 126.167810435 ) or 
       bondedto (attr store1 < 31.8880631883  and attr store1 > 30.6880631883 ))) 
6 0.1 0.1 peak 1653 volume 7.2836 ppm1 2.074 ppm2 0.729
 
! ############### hot_mothernoesy_072403.1654 folded -
assi (attr store1 < 1.091 and attr store1 > 0.891 )
     ((attr store1 < 2.114 and attr store1 > 2.014 ) and 
      (bondedto (attr store1 < 127.367810435  and attr store1 > 126.167810435 ) or 
       bondedto (attr store1 < 31.8880631883  and attr store1 > 30.6880631883 ))) 
6 0.1 0.1 peak 1654 volume 13.1131 ppm1 2.064 ppm2 0.991
 
! ############### hot_mothernoesy_072403.1668 folded -
assi (attr store1 < 7.981 and attr store1 > 7.781 )
     ((attr store1 < 4.026 and attr store1 > 3.926 ) and 
      (bondedto (attr store1 < 151.009810435  and attr store1 > 149.809810435 ) or 
       bondedto (attr store1 < 55.5300631883  and attr store1 > 54.3300631883 ))) 
6 0.1 0.1 peak 1668 volume 5.9904 ppm1 3.976 ppm2 7.881
 
! ############### hot_mothernoesy_072403.1669 folded -
assi (attr store1 < 7.12 and attr store1 > 6.92 )
     ((attr store1 < 2.01 and attr store1 > 1.91 ) and 
      (bondedto (attr store1 < 150.788810435  and attr store1 > 149.588810435 ) or 
       bondedto (attr store1 < 55.3090631883  and attr store1 > 54.1090631883 ))) 
6 0.1 0.1 peak 1669 volume 4.4507 ppm1 1.960 ppm2 7.020
 
! ############### hot_mothernoesy_072403.1670 folded -
assi (attr store1 < 8.727 and attr store1 > 8.527 )
     ((attr store1 < 4.373 and attr store1 > 4.273 ) and 
      (bondedto (attr store1 < 150.646810435  and attr store1 > 149.446810435 ) or 
       bondedto (attr store1 < 55.1670631883  and attr store1 > 53.9670631883 ))) 
6 0.1 0.1 peak 1670 volume 7.0719 ppm1 4.323 ppm2 8.627
 
! ############### hot_mothernoesy_072403.1671 folded -
assi (attr store1 < 7.98 and attr store1 > 7.78 )
     ((attr store1 < 4.367 and attr store1 > 4.267 ) and 
      (bondedto (attr store1 < 150.660810435  and attr store1 > 149.460810435 ) or 
       bondedto (attr store1 < 55.1810631883  and attr store1 > 53.9810631883 ))) 
6 0.1 0.1 peak 1671 volume 19.3335 ppm1 4.317 ppm2 7.880
 
! ############### hot_mothernoesy_072403.1672 folded -
assi (attr store1 < 8.156 and attr store1 > 7.956 )
     ((attr store1 < 1.981 and attr store1 > 1.881 ) and 
      (bondedto (attr store1 < 150.653810435  and attr store1 > 149.453810435 ) or 
       bondedto (attr store1 < 55.1740631883  and attr store1 > 53.9740631883 ))) 
6 0.1 0.1 peak 1672 volume 3.9058 ppm1 1.931 ppm2 8.056
 
! ############### hot_mothernoesy_072403.1673 folded -
assi (attr store1 < 7.976 and attr store1 > 7.776 )
     ((attr store1 < 4.226 and attr store1 > 4.126 ) and 
      (bondedto (attr store1 < 150.616810435  and attr store1 > 149.416810435 ) or 
       bondedto (attr store1 < 55.1370631883  and attr store1 > 53.9370631883 ))) 
6 0.1 0.1 peak 1673 volume 3.8793 ppm1 4.176 ppm2 7.876
 
! ############### hot_mothernoesy_072403.1675 folded -
assi (attr store1 < 8.401 and attr store1 > 8.201 )
     ((attr store1 < 4.666 and attr store1 > 4.566 ) and 
      (bondedto (attr store1 < 150.532810435  and attr store1 > 149.332810435 ) or 
       bondedto (attr store1 < 55.0530631883  and attr store1 > 53.8530631883 ))) 
6 0.1 0.1 peak 1675 volume 5.5731 ppm1 4.616 ppm2 8.301
 
! ############### hot_mothernoesy_072403.1676 folded -
assi (attr store1 < 8.259 and attr store1 > 8.059 )
     ((attr store1 < 4.627 and attr store1 > 4.527 ) and 
      (bondedto (attr store1 < 150.499810435  and attr store1 > 149.299810435 ) or 
       bondedto (attr store1 < 55.0200631883  and attr store1 > 53.8200631883 ))) 
6 0.1 0.1 peak 1676 volume 3.937 ppm1 4.577 ppm2 8.159
 
! ############### hot_mothernoesy_072403.1677 folded -
assi (attr store1 < 9.016 and attr store1 > 8.816 )
     ((attr store1 < 2.114 and attr store1 > 2.014 ) and 
      (bondedto (attr store1 < 150.523810435  and attr store1 > 149.323810435 ) or 
       bondedto (attr store1 < 55.0440631883  and attr store1 > 53.8440631883 ))) 
6 0.1 0.1 peak 1677 volume 4.0047 ppm1 2.064 ppm2 8.916
 
! ############### hot_mothernoesy_072403.1678 folded +
assi (attr store1 < 7.12 and attr store1 > 6.92 )
     ((attr store1 < 2.029 and attr store1 > 1.929 ) and 
      (bondedto (attr store1 < 126.152873623  and attr store1 > 124.952873623 ) or 
       bondedto (attr store1 < 78.413  and attr store1 > 77.213 ) or 
       bondedto (attr store1 < 30.6731263766  and attr store1 > 29.4731263766 ))) 
6 0.1 0.1 peak 1678 volume 7.84950 ppm1 1.979 ppm2 7.020
 
! ############### hot_mothernoesy_072403.1679 folded -
assi (attr store1 < 8.282 and attr store1 > 8.082 )
     ((attr store1 < 4.589 and attr store1 > 4.489 ) and 
      (bondedto (attr store1 < 150.013810435  and attr store1 > 148.813810435 ) or 
       bondedto (attr store1 < 54.5340631883  and attr store1 > 53.3340631883 ))) 
6 0.1 0.1 peak 1679 volume 3.8839 ppm1 4.539 ppm2 8.182
 
! ############### hot_mothernoesy_072403.1680 folded -
assi (attr store1 < 8.014 and attr store1 > 7.814 )
     ((attr store1 < 4.587 and attr store1 > 4.487 ) and 
      (bondedto (attr store1 < 150.031810435  and attr store1 > 148.831810435 ) or 
       bondedto (attr store1 < 54.5520631883  and attr store1 > 53.3520631883 ))) 
6 0.1 0.1 peak 1680 volume 21.3355 ppm1 4.537 ppm2 7.914
 
! ############### hot_mothernoesy_072403.1681 folded +
assi (attr store1 < 9.017 and attr store1 > 8.817 )
     ((attr store1 < 2.198 and attr store1 > 2.098 ) and 
      (bondedto (attr store1 < 126.015873623  and attr store1 > 124.815873623 ) or 
       bondedto (attr store1 < 78.276  and attr store1 > 77.076 ) or 
       bondedto (attr store1 < 30.5361263766  and attr store1 > 29.3361263766 ))) 
6 0.1 0.1 peak 1681 volume 6.76700 ppm1 2.148 ppm2 8.917
 
! ############### hot_mothernoesy_072403.1682 folded +
assi (attr store1 < 9.019 and attr store1 > 8.819 )
     ((attr store1 < 2.181 and attr store1 > 2.081 ) and 
      (bondedto (attr store1 < 126.022873623  and attr store1 > 124.822873623 ) or 
       bondedto (attr store1 < 78.283  and attr store1 > 77.083 ) or 
       bondedto (attr store1 < 30.5431263766  and attr store1 > 29.3431263766 ))) 
6 0.1 0.1 peak 1682 volume 7.27550 ppm1 2.131 ppm2 8.919
 
! ############### hot_mothernoesy_072403.1683 folded +
assi (attr store1 < 8.844 and attr store1 > 8.644 )
     ((attr store1 < 1.987 and attr store1 > 1.887 ) and 
      (bondedto (attr store1 < 126.102873623  and attr store1 > 124.902873623 ) or 
       bondedto (attr store1 < 78.363  and attr store1 > 77.163 ) or 
       bondedto (attr store1 < 30.6231263766  and attr store1 > 29.4231263766 ))) 
6 0.1 0.1 peak 1683 volume 5.67870 ppm1 1.937 ppm2 8.744
 
! ############### hot_mothernoesy_072403.1684 folded +
assi (attr store1 < 8.153 and attr store1 > 7.953 )
     ((attr store1 < 1.988 and attr store1 > 1.888 ) and 
      (bondedto (attr store1 < 126.067873623  and attr store1 > 124.867873623 ) or 
       bondedto (attr store1 < 78.328  and attr store1 > 77.128 ) or 
       bondedto (attr store1 < 30.5881263766  and attr store1 > 29.3881263766 ))) 
6 0.1 0.1 peak 1684 volume 13.83090 ppm1 1.938 ppm2 8.053
 
! ############### hot_mothernoesy_072403.1685 folded -
assi (attr store1 < 8.038 and attr store1 > 7.838 )
     ((attr store1 < 4.666 and attr store1 > 4.566 ) and 
      (bondedto (attr store1 < 149.977810435  and attr store1 > 148.777810435 ) or 
       bondedto (attr store1 < 54.4980631883  and attr store1 > 53.2980631883 ))) 
6 0.1 0.1 peak 1685 volume 3.35 ppm1 4.616 ppm2 7.938
 
! ############### hot_mothernoesy_072403.1686 folded -
assi (attr store1 < 7.725 and attr store1 > 7.525 )
     ((attr store1 < 4.653 and attr store1 > 4.553 ) and 
      (bondedto (attr store1 < 149.937810435  and attr store1 > 148.737810435 ) or 
       bondedto (attr store1 < 54.4580631883  and attr store1 > 53.2580631883 ))) 
6 0.1 0.1 peak 1686 volume 4.1563 ppm1 4.603 ppm2 7.625
 
! ############### hot_mothernoesy_072403.1687 folded +
assi (attr store1 < 9.019 and attr store1 > 8.819 )
     ((attr store1 < 2.11 and attr store1 > 2.01 ) and 
      (bondedto (attr store1 < 126.007873623  and attr store1 > 124.807873623 ) or 
       bondedto (attr store1 < 78.268  and attr store1 > 77.068 ) or 
       bondedto (attr store1 < 30.5281263766  and attr store1 > 29.3281263766 ))) 
6 0.1 0.1 peak 1687 volume 6.93790 ppm1 2.060 ppm2 8.919
 
! ############### hot_mothernoesy_072403.1688 folded +
assi (attr store1 < 7.52 and attr store1 > 7.32 )
     ((attr store1 < 1.986 and attr store1 > 1.886 ) and 
      (bondedto (attr store1 < 125.982873623  and attr store1 > 124.782873623 ) or 
       bondedto (attr store1 < 78.243  and attr store1 > 77.043 ) or 
       bondedto (attr store1 < 30.5031263766  and attr store1 > 29.3031263766 ))) 
6 0.1 0.1 peak 1688 volume 3.53810 ppm1 1.936 ppm2 7.420
 
! ############### hot_mothernoesy_072403.1689 folded -
assi (attr store1 < 8.317 and attr store1 > 8.117 )
     ((attr store1 < 4.648 and attr store1 > 4.548 ) and 
      (bondedto (attr store1 < 149.849810435  and attr store1 > 148.649810435 ) or 
       bondedto (attr store1 < 54.3700631883  and attr store1 > 53.1700631883 ))) 
6 0.1 0.1 peak 1689 volume 5.5477 ppm1 4.598 ppm2 8.217
 
! ############### hot_mothernoesy_072403.1690 folded -
assi (attr store1 < 7.894 and attr store1 > 7.694 )
     ((attr store1 < 4.647 and attr store1 > 4.547 ) and 
      (bondedto (attr store1 < 149.846810435  and attr store1 > 148.646810435 ) or 
       bondedto (attr store1 < 54.3670631883  and attr store1 > 53.1670631883 ))) 
6 0.1 0.1 peak 1690 volume 16.7471 ppm1 4.597 ppm2 7.794
 
! ############### hot_mothernoesy_072403.1691 folded -
assi (attr store1 < 7.762 and attr store1 > 7.562 )
     ((attr store1 < 4.641 and attr store1 > 4.541 ) and 
      (bondedto (attr store1 < 149.831810435  and attr store1 > 148.631810435 ) or 
       bondedto (attr store1 < 54.3520631883  and attr store1 > 53.1520631883 ))) 
6 0.1 0.1 peak 1691 volume 3.6625 ppm1 4.591 ppm2 7.662
 
! ############### hot_mothernoesy_072403.1692 folded +
assi (attr store1 < 8.544 and attr store1 > 8.344 )
     ((attr store1 < 2.16 and attr store1 > 2.06 ) and 
      (bondedto (attr store1 < 125.710873623  and attr store1 > 124.510873623 ) or 
       bondedto (attr store1 < 77.971  and attr store1 > 76.771 ) or 
       bondedto (attr store1 < 30.2311263766  and attr store1 > 29.0311263766 ))) 
6 0.1 0.1 peak 1692 volume 8.46160 ppm1 2.110 ppm2 8.444
 
! ############### hot_mothernoesy_072403.1693 folded +
assi (attr store1 < 8.15 and attr store1 > 7.95 )
     ((attr store1 < 2.138 and attr store1 > 2.038 ) and 
      (bondedto (attr store1 < 125.664873623  and attr store1 > 124.464873623 ) or 
       bondedto (attr store1 < 77.925  and attr store1 > 76.725 ) or 
       bondedto (attr store1 < 30.1851263766  and attr store1 > 28.9851263766 ))) 
6 0.1 0.1 peak 1693 volume 6.07490 ppm1 2.088 ppm2 8.050
 
! ############### hot_mothernoesy_072403.1694 folded +
assi (attr store1 < 7.943 and attr store1 > 7.743 )
     ((attr store1 < 2.14 and attr store1 > 2.04 ) and 
      (bondedto (attr store1 < 125.685873623  and attr store1 > 124.485873623 ) or 
       bondedto (attr store1 < 77.946  and attr store1 > 76.746 ) or 
       bondedto (attr store1 < 30.2061263766  and attr store1 > 29.0061263766 ))) 
6 0.1 0.1 peak 1694 volume 11.26220 ppm1 2.090 ppm2 7.843
 
! ############### hot_mothernoesy_072403.1695 folded +
assi (attr store1 < 8.542 and attr store1 > 8.342 )
     ((attr store1 < 2.071 and attr store1 > 1.971 ) and 
      (bondedto (attr store1 < 125.658873623  and attr store1 > 124.458873623 ) or 
       bondedto (attr store1 < 77.919  and attr store1 > 76.719 ) or 
       bondedto (attr store1 < 30.1791263766  and attr store1 > 28.9791263766 ))) 
6 0.1 0.1 peak 1695 volume 9.92760 ppm1 2.021 ppm2 8.442
 
! ############### hot_mothernoesy_072403.1696 folded +
assi (attr store1 < 8.164 and attr store1 > 7.964 )
     ((attr store1 < 2.112 and attr store1 > 2.012 ) and 
      (bondedto (attr store1 < 125.630873623  and attr store1 > 124.430873623 ) or 
       bondedto (attr store1 < 77.891  and attr store1 > 76.691 ) or 
       bondedto (attr store1 < 30.1511263766  and attr store1 > 28.9511263766 ))) 
6 0.1 0.1 peak 1696 volume 6.18480 ppm1 2.062 ppm2 8.064
 
! ############### hot_mothernoesy_072403.1697 folded +
assi (attr store1 < 8.039 and attr store1 > 7.839 )
     ((attr store1 < 2.237 and attr store1 > 2.137 ) and 
      (bondedto (attr store1 < 125.493873623  and attr store1 > 124.293873623 ) or 
       bondedto (attr store1 < 77.754  and attr store1 > 76.554 ) or 
       bondedto (attr store1 < 30.0141263766  and attr store1 > 28.8141263766 ))) 
6 0.1 0.1 peak 1697 volume 4.85320 ppm1 2.187 ppm2 7.939
 
! ############### hot_mothernoesy_072403.1698 folded +
assi (attr store1 < 8.413 and attr store1 > 8.213 )
     ((attr store1 < 2.233 and attr store1 > 2.133 ) and 
      (bondedto (attr store1 < 125.503873623  and attr store1 > 124.303873623 ) or 
       bondedto (attr store1 < 77.764  and attr store1 > 76.564 ) or 
       bondedto (attr store1 < 30.0241263766  and attr store1 > 28.8241263766 ))) 
6 0.1 0.1 peak 1698 volume 6.25110 ppm1 2.183 ppm2 8.313
 
! ############### hot_mothernoesy_072403.1699 folded +
assi (attr store1 < 8.032 and attr store1 > 7.832 )
     ((attr store1 < 2.089 and attr store1 > 1.989 ) and 
      (bondedto (attr store1 < 125.518873623  and attr store1 > 124.318873623 ) or 
       bondedto (attr store1 < 77.779  and attr store1 > 76.579 ) or 
       bondedto (attr store1 < 30.0391263766  and attr store1 > 28.8391263766 ))) 
6 0.1 0.1 peak 1699 volume 7.30610 ppm1 2.039 ppm2 7.932
 
! ############### hot_mothernoesy_072403.1700 folded +
assi (attr store1 < 8.4 and attr store1 > 8.2 )
     ((attr store1 < 2.076 and attr store1 > 1.976 ) and 
      (bondedto (attr store1 < 125.497873623  and attr store1 > 124.297873623 ) or 
       bondedto (attr store1 < 77.758  and attr store1 > 76.558 ) or 
       bondedto (attr store1 < 30.0181263766  and attr store1 > 28.8181263766 ))) 
6 0.1 0.1 peak 1700 volume 6.17290 ppm1 2.026 ppm2 8.300
 
! ############### hot_mothernoesy_072403.1701 folded +
assi (attr store1 < 9.454 and attr store1 > 9.254 )
     ((attr store1 < 2.127 and attr store1 > 2.027 ) and 
      (bondedto (attr store1 < 125.324873623  and attr store1 > 124.124873623 ) or 
       bondedto (attr store1 < 77.585  and attr store1 > 76.385 ) or 
       bondedto (attr store1 < 29.8451263766  and attr store1 > 28.6451263766 ))) 
6 0.1 0.1 peak 1701 volume 8.39670 ppm1 2.077 ppm2 9.354
 
! ############### hot_mothernoesy_072403.1702 folded +
assi (attr store1 < 9.455 and attr store1 > 9.255 )
     ((attr store1 < 2.049 and attr store1 > 1.949 ) and 
      (bondedto (attr store1 < 125.318873623  and attr store1 > 124.118873623 ) or 
       bondedto (attr store1 < 77.579  and attr store1 > 76.379 ) or 
       bondedto (attr store1 < 29.8391263766  and attr store1 > 28.6391263766 ))) 
6 0.1 0.1 peak 1702 volume 9.27070 ppm1 1.999 ppm2 9.355
 
! ############### hot_mothernoesy_072403.1703 folded +
assi (attr store1 < 8.016 and attr store1 > 7.816 )
     ((attr store1 < 3.398 and attr store1 > 3.298 ) and 
      (bondedto (attr store1 < 125.192873623  and attr store1 > 123.992873623 ) or 
       bondedto (attr store1 < 77.453  and attr store1 > 76.253 ) or 
       bondedto (attr store1 < 29.7131263766  and attr store1 > 28.5131263766 ))) 
6 0.1 0.1 peak 1703 volume 4.66450 ppm1 3.348 ppm2 7.916
 
! ############### hot_mothernoesy_072403.1704 folded +
assi (attr store1 < 7.407 and attr store1 > 7.207 )
     ((attr store1 < 3.398 and attr store1 > 3.298 ) and 
      (bondedto (attr store1 < 125.207873623  and attr store1 > 124.007873623 ) or 
       bondedto (attr store1 < 77.468  and attr store1 > 76.268 ) or 
       bondedto (attr store1 < 29.7281263766  and attr store1 > 28.5281263766 ))) 
6 0.1 0.1 peak 1704 volume 4.45340 ppm1 3.348 ppm2 7.307
 
! ############### hot_mothernoesy_072403.1705 folded +
assi (attr store1 < 7.747 and attr store1 > 7.547 )
     ((attr store1 < 3.39 and attr store1 > 3.29 ) and 
      (bondedto (attr store1 < 125.205873623  and attr store1 > 124.005873623 ) or 
       bondedto (attr store1 < 77.466  and attr store1 > 76.266 ) or 
       bondedto (attr store1 < 29.7261263766  and attr store1 > 28.5261263766 ))) 
6 0.1 0.1 peak 1705 volume 4.10900 ppm1 3.340 ppm2 7.647
 
! ############### hot_mothernoesy_072403.1706 folded +
assi (attr store1 < 8.014 and attr store1 > 7.814 )
     ((attr store1 < 3.341 and attr store1 > 3.241 ) and 
      (bondedto (attr store1 < 125.224873623  and attr store1 > 124.024873623 ) or 
       bondedto (attr store1 < 77.485  and attr store1 > 76.285 ) or 
       bondedto (attr store1 < 29.7451263766  and attr store1 > 28.5451263766 ))) 
6 0.1 0.1 peak 1706 volume 4.04620 ppm1 3.291 ppm2 7.914
 
! ############### hot_mothernoesy_072403.1707 folded +
assi (attr store1 < 7.749 and attr store1 > 7.549 )
     ((attr store1 < 3.342 and attr store1 > 3.242 ) and 
      (bondedto (attr store1 < 125.207873623  and attr store1 > 124.007873623 ) or 
       bondedto (attr store1 < 77.468  and attr store1 > 76.268 ) or 
       bondedto (attr store1 < 29.7281263766  and attr store1 > 28.5281263766 ))) 
6 0.1 0.1 peak 1707 volume 4.56170 ppm1 3.292 ppm2 7.649
 
! ############### hot_mothernoesy_072403.1708 folded +
assi (attr store1 < 7.406 and attr store1 > 7.206 )
     ((attr store1 < 3.337 and attr store1 > 3.237 ) and 
      (bondedto (attr store1 < 125.192873623  and attr store1 > 123.992873623 ) or 
       bondedto (attr store1 < 77.453  and attr store1 > 76.253 ) or 
       bondedto (attr store1 < 29.7131263766  and attr store1 > 28.5131263766 ))) 
6 0.1 0.1 peak 1708 volume 3.54770 ppm1 3.287 ppm2 7.306
 
! ############### hot_mothernoesy_072403.1709 folded -
assi (attr store1 < 8.252 and attr store1 > 8.052 )
     ((attr store1 < 4.313 and attr store1 > 4.213 ) and 
      (bondedto (attr store1 < 149.112810435  and attr store1 > 147.912810435 ) or 
       bondedto (attr store1 < 53.6330631883  and attr store1 > 52.4330631883 ))) 
6 0.1 0.1 peak 1709 volume 28.1585 ppm1 4.263 ppm2 8.152
 
! ############### hot_mothernoesy_072403.1710 folded -
assi (attr store1 < 8.165 and attr store1 > 7.965 )
     ((attr store1 < 4.313 and attr store1 > 4.213 ) and 
      (bondedto (attr store1 < 149.125810435  and attr store1 > 147.925810435 ) or 
       bondedto (attr store1 < 53.6460631883  and attr store1 > 52.4460631883 ))) 
6 0.1 0.1 peak 1710 volume 24.8761 ppm1 4.263 ppm2 8.065
 
! ############### hot_mothernoesy_072403.1711 folded -
assi (attr store1 < 8.06 and attr store1 > 7.86 )
     ((attr store1 < 4.36 and attr store1 > 4.26 ) and 
      (bondedto (attr store1 < 148.878810435  and attr store1 > 147.678810435 ) or 
       bondedto (attr store1 < 53.3990631883  and attr store1 > 52.1990631883 ))) 
6 0.1 0.1 peak 1711 volume 9.5808 ppm1 4.310 ppm2 7.960
 
! ############### hot_mothernoesy_072403.1712 folded -
assi (attr store1 < 8.566 and attr store1 > 8.366 )
     ((attr store1 < 4.293 and attr store1 > 4.193 ) and 
      (bondedto (attr store1 < 148.904810435  and attr store1 > 147.704810435 ) or 
       bondedto (attr store1 < 53.4250631883  and attr store1 > 52.2250631883 ))) 
6 0.1 0.1 peak 1712 volume 10.3893 ppm1 4.243 ppm2 8.466
 
! ############### hot_mothernoesy_072403.1713 folded -
assi (attr store1 < 7.968 and attr store1 > 7.768 )
     ((attr store1 < 4.293 and attr store1 > 4.193 ) and 
      (bondedto (attr store1 < 148.891810435  and attr store1 > 147.691810435 ) or 
       bondedto (attr store1 < 53.4120631883  and attr store1 > 52.2120631883 ))) 
6 0.1 0.1 peak 1713 volume 13.3127 ppm1 4.243 ppm2 7.868
 
! ############### hot_mothernoesy_072403.1714 folded +
assi (attr store1 < 8.548 and attr store1 > 8.348 )
     ((attr store1 < 2.244 and attr store1 > 2.144 ) and 
      (bondedto (attr store1 < 124.473873623  and attr store1 > 123.273873623 ) or 
       bondedto (attr store1 < 76.734  and attr store1 > 75.534 ) or 
       bondedto (attr store1 < 28.9941263766  and attr store1 > 27.7941263766 ))) 
6 0.1 0.1 peak 1714 volume 3.19390 ppm1 2.194 ppm2 8.448
 
! ############### hot_mothernoesy_072403.1715 folded +
assi (attr store1 < 8.545 and attr store1 > 8.345 )
     ((attr store1 < 2.146 and attr store1 > 2.046 ) and 
      (bondedto (attr store1 < 124.400873623  and attr store1 > 123.200873623 ) or 
       bondedto (attr store1 < 76.661  and attr store1 > 75.461 ) or 
       bondedto (attr store1 < 28.9211263766  and attr store1 > 27.7211263766 ))) 
6 0.1 0.1 peak 1715 volume 3.71200 ppm1 2.096 ppm2 8.445
 
! ############### hot_mothernoesy_072403.1716 folded -
assi (attr store1 < 7.477 and attr store1 > 7.277 )
     ((attr store1 < 4.513 and attr store1 > 4.413 ) and 
      (bondedto (attr store1 < 148.270810435  and attr store1 > 147.070810435 ) or 
       bondedto (attr store1 < 52.7910631883  and attr store1 > 51.5910631883 ))) 
6 0.1 0.1 peak 1716 volume 4.7629 ppm1 4.463 ppm2 7.377
 
! ############### hot_mothernoesy_072403.1717 folded +
assi (attr store1 < 7.658 and attr store1 > 7.458 )
     ((attr store1 < 2.317 and attr store1 > 2.217 ) and 
      (bondedto (attr store1 < 124.244873623  and attr store1 > 123.044873623 ) or 
       bondedto (attr store1 < 76.505  and attr store1 > 75.305 ) or 
       bondedto (attr store1 < 28.7651263766  and attr store1 > 27.5651263766 ))) 
6 0.1 0.1 peak 1717 volume 3.70780 ppm1 2.267 ppm2 7.558
 
! ############### hot_mothernoesy_072403.1718 folded +
assi (attr store1 < 7.318 and attr store1 > 7.118 )
     ((attr store1 < 2.323 and attr store1 > 2.223 ) and 
      (bondedto (attr store1 < 124.273873623  and attr store1 > 123.073873623 ) or 
       bondedto (attr store1 < 76.534  and attr store1 > 75.334 ) or 
       bondedto (attr store1 < 28.7941263766  and attr store1 > 27.5941263766 ))) 
6 0.1 0.1 peak 1718 volume 4.87210 ppm1 2.273 ppm2 7.218
 
! ############### hot_mothernoesy_072403.1719 folded +
assi (attr store1 < 7.314 and attr store1 > 7.114 )
     ((attr store1 < 2.118 and attr store1 > 2.018 ) and 
      (bondedto (attr store1 < 124.269873623  and attr store1 > 123.069873623 ) or 
       bondedto (attr store1 < 76.53  and attr store1 > 75.33 ) or 
       bondedto (attr store1 < 28.7901263766  and attr store1 > 27.5901263766 ))) 
6 0.1 0.1 peak 1719 volume 5.22910 ppm1 2.068 ppm2 7.214
 
! ############### hot_mothernoesy_072403.1720 folded +
assi (attr store1 < 7.733 and attr store1 > 7.533 )
     ((attr store1 < 2.243 and attr store1 > 2.143 ) and 
      (bondedto (attr store1 < 124.186873623  and attr store1 > 122.986873623 ) or 
       bondedto (attr store1 < 76.447  and attr store1 > 75.247 ) or 
       bondedto (attr store1 < 28.7071263766  and attr store1 > 27.5071263766 ))) 
6 0.1 0.1 peak 1720 volume 10.87530 ppm1 2.193 ppm2 7.633
 
! ############### hot_mothernoesy_072403.1721 folded +
assi (attr store1 < 7.12 and attr store1 > 6.92 )
     ((attr store1 < 1.944 and attr store1 > 1.844 ) and 
      (bondedto (attr store1 < 124.076873623  and attr store1 > 122.876873623 ) or 
       bondedto (attr store1 < 76.337  and attr store1 > 75.137 ) or 
       bondedto (attr store1 < 28.5971263766  and attr store1 > 27.3971263766 ))) 
6 0.1 0.1 peak 1721 volume 4.51080 ppm1 1.894 ppm2 7.020
 
! ############### hot_mothernoesy_072403.1722 folded +
assi (attr store1 < 7.119 and attr store1 > 6.919 )
     ((attr store1 < 1.763 and attr store1 > 1.663 ) and 
      (bondedto (attr store1 < 124.133873623  and attr store1 > 122.933873623 ) or 
       bondedto (attr store1 < 76.394  and attr store1 > 75.194 ) or 
       bondedto (attr store1 < 28.6541263766  and attr store1 > 27.4541263766 ))) 
6 0.1 0.1 peak 1722 volume 3.74430 ppm1 1.713 ppm2 7.019
 
! ############### hot_mothernoesy_072403.1723 folded +
assi (attr store1 < 8.165 and attr store1 > 7.965 )
     ((attr store1 < 1.912 and attr store1 > 1.812 ) and 
      (bondedto (attr store1 < 123.828873623  and attr store1 > 122.628873623 ) or 
       bondedto (attr store1 < 76.089  and attr store1 > 74.889 ) or 
       bondedto (attr store1 < 28.3491263766  and attr store1 > 27.1491263766 ))) 
6 0.1 0.1 peak 1723 volume 4.00390 ppm1 1.862 ppm2 8.065
 
! ############### hot_mothernoesy_072403.1724 folded +
assi (attr store1 < 8.152 and attr store1 > 7.952 )
     ((attr store1 < 1.649 and attr store1 > 1.549 ) and 
      (bondedto (attr store1 < 123.726873623  and attr store1 > 122.526873623 ) or 
       bondedto (attr store1 < 75.987  and attr store1 > 74.787 ) or 
       bondedto (attr store1 < 28.2471263766  and attr store1 > 27.0471263766 ))) 
6 0.1 0.1 peak 1724 volume 4.51340 ppm1 1.599 ppm2 8.052
 
! ############### hot_mothernoesy_072403.1725 folded +
assi (attr store1 < 8.147 and attr store1 > 7.947 )
     ((attr store1 < 1.824 and attr store1 > 1.724 ) and 
      (bondedto (attr store1 < 123.652873623  and attr store1 > 122.452873623 ) or 
       bondedto (attr store1 < 75.913  and attr store1 > 74.713 ) or 
       bondedto (attr store1 < 28.1731263766  and attr store1 > 26.9731263766 ))) 
6 0.1 0.1 peak 1725 volume 4.78190 ppm1 1.774 ppm2 8.047
 
! ############### hot_mothernoesy_072403.1726 folded +
assi (attr store1 < 8.112 and attr store1 > 7.912 )
     ((attr store1 < 1.965 and attr store1 > 1.865 ) and 
      (bondedto (attr store1 < 123.590873623  and attr store1 > 122.390873623 ) or 
       bondedto (attr store1 < 75.851  and attr store1 > 74.651 ) or 
       bondedto (attr store1 < 28.1111263766  and attr store1 > 26.9111263766 ))) 
6 0.1 0.1 peak 1726 volume 3.21360 ppm1 1.915 ppm2 8.012
 
! ############### hot_mothernoesy_072403.1727 folded +
assi (attr store1 < 7.896 and attr store1 > 7.696 )
     ((attr store1 < 1.5 and attr store1 > 1.4 ) and 
      (bondedto (attr store1 < 123.574873623  and attr store1 > 122.374873623 ) or 
       bondedto (attr store1 < 75.835  and attr store1 > 74.635 ) or 
       bondedto (attr store1 < 28.0951263766  and attr store1 > 26.8951263766 ))) 
6 0.1 0.1 peak 1727 volume 5.26800 ppm1 1.450 ppm2 7.796
 
! ############### hot_mothernoesy_072403.1728 folded +
assi (attr store1 < 7.895 and attr store1 > 7.695 )
     ((attr store1 < 1.232 and attr store1 > 1.132 ) and 
      (bondedto (attr store1 < 123.574873623  and attr store1 > 122.374873623 ) or 
       bondedto (attr store1 < 75.835  and attr store1 > 74.635 ) or 
       bondedto (attr store1 < 28.0951263766  and attr store1 > 26.8951263766 ))) 
6 0.1 0.1 peak 1728 volume 4.89450 ppm1 1.182 ppm2 7.795
 
! ############### hot_mothernoesy_072403.1731 folded +
assi (attr store1 < 8.092 and attr store1 > 7.892 )
     ((attr store1 < 0.977 and attr store1 > 0.877 ) and 
      (bondedto (attr store1 < 123.142873623  and attr store1 > 121.942873623 ) or 
       bondedto (attr store1 < 75.403  and attr store1 > 74.203 ) or 
       bondedto (attr store1 < 27.6631263766  and attr store1 > 26.4631263766 ))) 
6 0.1 0.1 peak 1731 volume 3.91440 ppm1 0.927 ppm2 7.992
 
! ############### hot_mothernoesy_072403.1732 folded +
assi (attr store1 < 8.161 and attr store1 > 7.961 )
     ((attr store1 < 1.772 and attr store1 > 1.672 ) and 
      (bondedto (attr store1 < 123.041873623  and attr store1 > 121.841873623 ) or 
       bondedto (attr store1 < 75.302  and attr store1 > 74.102 ) or 
       bondedto (attr store1 < 27.5621263766  and attr store1 > 26.3621263766 ))) 
6 0.1 0.1 peak 1732 volume 5.22670 ppm1 1.722 ppm2 8.061
 
! ############### hot_mothernoesy_072403.1734 folded +
assi (attr store1 < 7.222 and attr store1 > 7.022 )
     ((attr store1 < 0.944 and attr store1 > 0.844 ) and 
      (bondedto (attr store1 < 123.073873623  and attr store1 > 121.873873623 ) or 
       bondedto (attr store1 < 75.334  and attr store1 > 74.134 ) or 
       bondedto (attr store1 < 27.5941263766  and attr store1 > 26.3941263766 ))) 
6 0.1 0.1 peak 1734 volume 5.99330 ppm1 0.894 ppm2 7.122
 
! ############### hot_mothernoesy_072403.1735 folded +
assi (attr store1 < 7.601 and attr store1 > 7.401 )
     ((attr store1 < 1.875 and attr store1 > 1.775 ) and 
      (bondedto (attr store1 < 122.910873623  and attr store1 > 121.710873623 ) or 
       bondedto (attr store1 < 75.171  and attr store1 > 73.971 ) or 
       bondedto (attr store1 < 27.4311263766  and attr store1 > 26.2311263766 ))) 
6 0.1 0.1 peak 1735 volume 6.23590 ppm1 1.825 ppm2 7.501
 
! ############### hot_mothernoesy_072403.1736 folded +
assi (attr store1 < 7.743 and attr store1 > 7.543 )
     ((attr store1 < 1.623 and attr store1 > 1.523 ) and 
      (bondedto (attr store1 < 122.615873623  and attr store1 > 121.415873623 ) or 
       bondedto (attr store1 < 74.876  and attr store1 > 73.676 ) or 
       bondedto (attr store1 < 27.1361263766  and attr store1 > 25.9361263766 ))) 
6 0.1 0.1 peak 1736 volume 4.90950 ppm1 1.573 ppm2 7.643
 
! ############### hot_mothernoesy_072403.1739 folded +
assi (attr store1 < 7.737 and attr store1 > 7.537 )
     ((attr store1 < 0.862 and attr store1 > 0.762 ) and 
      (bondedto (attr store1 < 121.759873623  and attr store1 > 120.559873623 ) or 
       bondedto (attr store1 < 74.02  and attr store1 > 72.82 ) or 
       bondedto (attr store1 < 26.2801263766  and attr store1 > 25.0801263766 ))) 
6 0.1 0.1 peak 1739 volume 3.88730 ppm1 0.812 ppm2 7.637
 
! ############### hot_mothernoesy_072403.1740 folded +
assi (attr store1 < 6.989 and attr store1 > 6.789 )
     ((attr store1 < 0.863 and attr store1 > 0.763 ) and 
      (bondedto (attr store1 < 121.722873623  and attr store1 > 120.522873623 ) or 
       bondedto (attr store1 < 73.983  and attr store1 > 72.783 ) or 
       bondedto (attr store1 < 26.2431263766  and attr store1 > 25.0431263766 ))) 
6 0.1 0.1 peak 1740 volume 9.66210 ppm1 0.813 ppm2 6.889
 
! ############### hot_mothernoesy_072403.1742 folded +
assi (attr store1 < 7.983 and attr store1 > 7.783 )
     ((attr store1 < 1.437 and attr store1 > 1.337 ) and 
      (bondedto (attr store1 < 121.408873623  and attr store1 > 120.208873623 ) or 
       bondedto (attr store1 < 73.669  and attr store1 > 72.469 ) or 
       bondedto (attr store1 < 25.9291263766  and attr store1 > 24.7291263766 ))) 
6 0.1 0.1 peak 1742 volume 4.34900 ppm1 1.387 ppm2 7.883
 
! ############### hot_mothernoesy_072403.1744 folded +
assi (attr store1 < 7.605 and attr store1 > 7.405 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 121.167873623  and attr store1 > 119.967873623 ) or 
       bondedto (attr store1 < 73.428  and attr store1 > 72.228 ) or 
       bondedto (attr store1 < 25.6881263766  and attr store1 > 24.4881263766 ))) 
6 0.1 0.1 peak 1744 volume 4.36930 ppm1 0.990 ppm2 7.505
 
! ############### hot_mothernoesy_072403.1745 folded +
assi (attr store1 < 7.985 and attr store1 > 7.785 )
     ((attr store1 < 0.207 and attr store1 > 0.107 ) and 
      (bondedto (attr store1 < 121.108873623  and attr store1 > 119.908873623 ) or 
       bondedto (attr store1 < 73.369  and attr store1 > 72.169 ) or 
       bondedto (attr store1 < 25.6291263766  and attr store1 > 24.4291263766 ))) 
6 0.1 0.1 peak 1745 volume 3.17110 ppm1 0.157 ppm2 7.885
 
! ############### hot_mothernoesy_072403.1750 folded +
assi (attr store1 < 8.026 and attr store1 > 7.826 )
     ((attr store1 < 1.041 and attr store1 > 0.941 ) and 
      (bondedto (attr store1 < 121.038873623  and attr store1 > 119.838873623 ) or 
       bondedto (attr store1 < 73.299  and attr store1 > 72.099 ) or 
       bondedto (attr store1 < 25.5591263766  and attr store1 > 24.3591263766 ))) 
6 0.1 0.1 peak 1750 volume 4.65560 ppm1 0.991 ppm2 7.926
 
! ############### hot_mothernoesy_072403.1751 folded +
assi (attr store1 < 6.973 and attr store1 > 6.773 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 121.011873623  and attr store1 > 119.811873623 ) or 
       bondedto (attr store1 < 73.272  and attr store1 > 72.072 ) or 
       bondedto (attr store1 < 25.5321263766  and attr store1 > 24.3321263766 ))) 
6 0.1 0.1 peak 1751 volume 3.33290 ppm1 0.990 ppm2 6.873
 
! ############### hot_mothernoesy_072403.1753 folded +
assi (attr store1 < 8.487 and attr store1 > 8.287 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 120.971873623  and attr store1 > 119.771873623 ) or 
       bondedto (attr store1 < 73.232  and attr store1 > 72.032 ) or 
       bondedto (attr store1 < 25.4921263766  and attr store1 > 24.2921263766 ))) 
6 0.1 0.1 peak 1753 volume 7.58160 ppm1 0.990 ppm2 8.387
 
! ############### hot_mothernoesy_072403.1755 folded +
assi (attr store1 < 8.859 and attr store1 > 8.659 )
     ((attr store1 < 1.605 and attr store1 > 1.505 ) and 
      (bondedto (attr store1 < 120.115873623  and attr store1 > 118.915873623 ) or 
       bondedto (attr store1 < 72.376  and attr store1 > 71.176 ) or 
       bondedto (attr store1 < 24.6361263766  and attr store1 > 23.4361263766 ))) 
6 0.1 0.1 peak 1755 volume 4.94440 ppm1 1.555 ppm2 8.759
 
! ############### hot_mothernoesy_072403.1756 folded +
assi (attr store1 < 7.392 and attr store1 > 7.192 )
     ((attr store1 < 1.603 and attr store1 > 1.503 ) and 
      (bondedto (attr store1 < 120.105873623  and attr store1 > 118.905873623 ) or 
       bondedto (attr store1 < 72.366  and attr store1 > 71.166 ) or 
       bondedto (attr store1 < 24.6261263766  and attr store1 > 23.4261263766 ))) 
6 0.1 0.1 peak 1756 volume 11.07660 ppm1 1.553 ppm2 7.292
 
! ############### hot_mothernoesy_072403.1757 folded +
assi (attr store1 < 7.271 and attr store1 > 7.071 )
     ((attr store1 < 1.604 and attr store1 > 1.504 ) and 
      (bondedto (attr store1 < 120.098873623  and attr store1 > 118.898873623 ) or 
       bondedto (attr store1 < 72.359  and attr store1 > 71.159 ) or 
       bondedto (attr store1 < 24.6191263766  and attr store1 > 23.4191263766 ))) 
6 0.1 0.1 peak 1757 volume 12.44540 ppm1 1.554 ppm2 7.171
 
! ############### hot_mothernoesy_072403.1758 folded +
assi (attr store1 < 7.082 and attr store1 > 6.882 )
     ((attr store1 < 1.606 and attr store1 > 1.506 ) and 
      (bondedto (attr store1 < 120.092873623  and attr store1 > 118.892873623 ) or 
       bondedto (attr store1 < 72.353  and attr store1 > 71.153 ) or 
       bondedto (attr store1 < 24.6131263766  and attr store1 > 23.4131263766 ))) 
6 0.1 0.1 peak 1758 volume 4.95920 ppm1 1.556 ppm2 6.982
 
! ############### hot_mothernoesy_072403.1759 folded +
assi (attr store1 < 7.988 and attr store1 > 7.788 )
     ((attr store1 < 1.001 and attr store1 > 0.901 ) and 
      (bondedto (attr store1 < 119.787873623  and attr store1 > 118.587873623 ) or 
       bondedto (attr store1 < 72.048  and attr store1 > 70.848 ) or 
       bondedto (attr store1 < 24.3081263766  and attr store1 > 23.1081263766 ))) 
6 0.1 0.1 peak 1759 volume 4.38440 ppm1 0.951 ppm2 7.888
 
! ############### hot_mothernoesy_072403.1760 folded +
assi (attr store1 < 8.87 and attr store1 > 8.67 )
     ((attr store1 < 0.997 and attr store1 > 0.897 ) and 
      (bondedto (attr store1 < 119.839873623  and attr store1 > 118.639873623 ) or 
       bondedto (attr store1 < 72.1  and attr store1 > 70.9 ) or 
       bondedto (attr store1 < 24.3601263766  and attr store1 > 23.1601263766 ))) 
6 0.1 0.1 peak 1760 volume 3.37430 ppm1 0.947 ppm2 8.770
 
! ############### hot_mothernoesy_072403.1761 folded +
assi (attr store1 < 8.735 and attr store1 > 8.535 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.623873623  and attr store1 > 118.423873623 ) or 
       bondedto (attr store1 < 71.884  and attr store1 > 70.684 ) or 
       bondedto (attr store1 < 24.1441263766  and attr store1 > 22.9441263766 ))) 
6 0.1 0.1 peak 1761 volume 16.63310 ppm1 1.526 ppm2 8.635
 
! ############### hot_mothernoesy_072403.1762 folded +
assi (attr store1 < 8.063 and attr store1 > 7.863 )
     ((attr store1 < 1.576 and attr store1 > 1.476 ) and 
      (bondedto (attr store1 < 119.618873623  and attr store1 > 118.418873623 ) or 
       bondedto (attr store1 < 71.879  and attr store1 > 70.679 ) or 
       bondedto (attr store1 < 24.1391263766  and attr store1 > 22.9391263766 ))) 
6 0.1 0.1 peak 1762 volume 3.35270 ppm1 1.526 ppm2 7.963
 
! ############### hot_mothernoesy_072403.1763 folded +
assi (attr store1 < 7.075 and attr store1 > 6.875 )
     ((attr store1 < 1.579 and attr store1 > 1.479 ) and 
      (bondedto (attr store1 < 119.630873623  and attr store1 > 118.430873623 ) or 
       bondedto (attr store1 < 71.891  and attr store1 > 70.691 ) or 
       bondedto (attr store1 < 24.1511263766  and attr store1 > 22.9511263766 ))) 
6 0.1 0.1 peak 1763 volume 3.68980 ppm1 1.529 ppm2 6.975
 
! ############### hot_mothernoesy_072403.1764 folded -
assi (attr store1 < 8.46 and attr store1 > 8.26 )
     ((attr store1 < 3.912 and attr store1 > 3.812 ) and 
      (bondedto (attr store1 < 143.503810435  and attr store1 > 142.303810435 ) or 
       bondedto (attr store1 < 48.0240631883  and attr store1 > 46.8240631883 ))) 
6 0.1 0.1 peak 1764 volume 3.9005 ppm1 3.862 ppm2 8.360
 
! ############### hot_mothernoesy_072403.1765 folded -
assi (attr store1 < 8.467 and attr store1 > 8.267 )
     ((attr store1 < 3.551 and attr store1 > 3.451 ) and 
      (bondedto (attr store1 < 143.490810435  and attr store1 > 142.290810435 ) or 
       bondedto (attr store1 < 48.0110631883  and attr store1 > 46.8110631883 ))) 
6 0.1 0.1 peak 1765 volume 3.4555 ppm1 3.501 ppm2 8.367
 
! ############### hot_mothernoesy_072403.1768 folded +
assi (attr store1 < 8.391 and attr store1 > 8.191 )
     ((attr store1 < 0.857 and attr store1 > 0.757 ) and 
      (bondedto (attr store1 < 119.264873623  and attr store1 > 118.064873623 ) or 
       bondedto (attr store1 < 71.525  and attr store1 > 70.325 ) or 
       bondedto (attr store1 < 23.7851263766  and attr store1 > 22.5851263766 ))) 
6 0.1 0.1 peak 1768 volume 4.88650 ppm1 0.807 ppm2 8.291
 
! ############### hot_mothernoesy_072403.1769 folded +
assi (attr store1 < 8.095 and attr store1 > 7.895 )
     ((attr store1 < 0.856 and attr store1 > 0.756 ) and 
      (bondedto (attr store1 < 119.283873623  and attr store1 > 118.083873623 ) or 
       bondedto (attr store1 < 71.544  and attr store1 > 70.344 ) or 
       bondedto (attr store1 < 23.8041263766  and attr store1 > 22.6041263766 ))) 
6 0.1 0.1 peak 1769 volume 5.31210 ppm1 0.806 ppm2 7.995
 
! ############### hot_mothernoesy_072403.1770 folded +
assi (attr store1 < 7.271 and attr store1 > 7.071 )
     ((attr store1 < 0.857 and attr store1 > 0.757 ) and 
      (bondedto (attr store1 < 119.267873623  and attr store1 > 118.067873623 ) or 
       bondedto (attr store1 < 71.528  and attr store1 > 70.328 ) or 
       bondedto (attr store1 < 23.7881263766  and attr store1 > 22.5881263766 ))) 
6 0.1 0.1 peak 1770 volume 8.29310 ppm1 0.807 ppm2 7.171
 
! ############### hot_mothernoesy_072403.1771 folded -
assi (attr store1 < 7.859 and attr store1 > 7.659 )
     ((attr store1 < 1.19 and attr store1 > 1.09 ) and 
      (bondedto (attr store1 < 143.138810435  and attr store1 > 141.938810435 ) or 
       bondedto (attr store1 < 47.6590631883  and attr store1 > 46.4590631883 ))) 
6 0.1 0.1 peak 1771 volume 7.8981 ppm1 1.140 ppm2 7.759
 
! ############### hot_mothernoesy_072403.1773 folded +
assi (attr store1 < 7.883 and attr store1 > 7.683 )
     ((attr store1 < 0.852 and attr store1 > 0.752 ) and 
      (bondedto (attr store1 < 119.201873623  and attr store1 > 118.001873623 ) or 
       bondedto (attr store1 < 71.462  and attr store1 > 70.262 ) or 
       bondedto (attr store1 < 23.7221263766  and attr store1 > 22.5221263766 ))) 
6 0.1 0.1 peak 1773 volume 7.20260 ppm1 0.802 ppm2 7.783
 
! ############### hot_mothernoesy_072403.1774 folded +
assi (attr store1 < 7.737 and attr store1 > 7.537 )
     ((attr store1 < 0.851 and attr store1 > 0.751 ) and 
      (bondedto (attr store1 < 119.182873623  and attr store1 > 117.982873623 ) or 
       bondedto (attr store1 < 71.443  and attr store1 > 70.243 ) or 
       bondedto (attr store1 < 23.7031263766  and attr store1 > 22.5031263766 ))) 
6 0.1 0.1 peak 1774 volume 8.87880 ppm1 0.801 ppm2 7.637
 
! ############### hot_mothernoesy_072403.1775 folded +
assi (attr store1 < 7.632 and attr store1 > 7.432 )
     ((attr store1 < 0.852 and attr store1 > 0.752 ) and 
      (bondedto (attr store1 < 119.182873623  and attr store1 > 117.982873623 ) or 
       bondedto (attr store1 < 71.443  and attr store1 > 70.243 ) or 
       bondedto (attr store1 < 23.7031263766  and attr store1 > 22.5031263766 ))) 
6 0.1 0.1 peak 1775 volume 4.95220 ppm1 0.802 ppm2 7.532
 
! ############### hot_mothernoesy_072403.1776 folded +
assi (attr store1 < 7.012 and attr store1 > 6.812 )
     ((attr store1 < 0.851 and attr store1 > 0.751 ) and 
      (bondedto (attr store1 < 119.202873623  and attr store1 > 118.002873623 ) or 
       bondedto (attr store1 < 71.463  and attr store1 > 70.263 ) or 
       bondedto (attr store1 < 23.7231263766  and attr store1 > 22.5231263766 ))) 
6 0.1 0.1 peak 1776 volume 7.26690 ppm1 0.801 ppm2 6.912
 
! ############### hot_mothernoesy_072403.1777 folded +
assi (attr store1 < 8.507 and attr store1 > 8.307 )
     ((attr store1 < 0.99 and attr store1 > 0.89 ) and 
      (bondedto (attr store1 < 118.942873623  and attr store1 > 117.742873623 ) or 
       bondedto (attr store1 < 71.203  and attr store1 > 70.003 ) or 
       bondedto (attr store1 < 23.4631263766  and attr store1 > 22.2631263766 ))) 
6 0.1 0.1 peak 1777 volume 5.45210 ppm1 0.940 ppm2 8.407
 
! ############### hot_mothernoesy_072403.1778 folded +
assi (attr store1 < 7.986 and attr store1 > 7.786 )
     ((attr store1 < 0.991 and attr store1 > 0.891 ) and 
      (bondedto (attr store1 < 118.956873623  and attr store1 > 117.756873623 ) or 
       bondedto (attr store1 < 71.217  and attr store1 > 70.017 ) or 
       bondedto (attr store1 < 23.4771263766  and attr store1 > 22.2771263766 ))) 
6 0.1 0.1 peak 1778 volume 5.92050 ppm1 0.941 ppm2 7.886
 
! ############### hot_mothernoesy_072403.1781 folded +
assi (attr store1 < 7.21 and attr store1 > 7.01 )
     ((attr store1 < 0.989 and attr store1 > 0.889 ) and 
      (bondedto (attr store1 < 118.891873623  and attr store1 > 117.691873623 ) or 
       bondedto (attr store1 < 71.152  and attr store1 > 69.952 ) or 
       bondedto (attr store1 < 23.4121263766  and attr store1 > 22.2121263766 ))) 
6 0.1 0.1 peak 1781 volume 4.45660 ppm1 0.939 ppm2 7.110
 
! ############### hot_mothernoesy_072403.1783 folded +
assi (attr store1 < 7.216 and attr store1 > 7.016 )
     ((attr store1 < 0.779 and attr store1 > 0.679 ) and 
      (bondedto (attr store1 < 118.850873623  and attr store1 > 117.650873623 ) or 
       bondedto (attr store1 < 71.111  and attr store1 > 69.911 ) or 
       bondedto (attr store1 < 23.3711263766  and attr store1 > 22.1711263766 ))) 
6 0.1 0.1 peak 1783 volume 8.84290 ppm1 0.729 ppm2 7.116
 
! ############### hot_mothernoesy_072403.1784 folded +
assi (attr store1 < 6.992 and attr store1 > 6.792 )
     ((attr store1 < 0.779 and attr store1 > 0.679 ) and 
      (bondedto (attr store1 < 118.855873623  and attr store1 > 117.655873623 ) or 
       bondedto (attr store1 < 71.116  and attr store1 > 69.916 ) or 
       bondedto (attr store1 < 23.3761263766  and attr store1 > 22.1761263766 ))) 
6 0.1 0.1 peak 1784 volume 6.69790 ppm1 0.729 ppm2 6.892
 
! ############### hot_mothernoesy_072403.1785 folded +
assi (attr store1 < 6.461 and attr store1 > 6.261 )
     ((attr store1 < 0.778 and attr store1 > 0.678 ) and 
      (bondedto (attr store1 < 118.854873623  and attr store1 > 117.654873623 ) or 
       bondedto (attr store1 < 71.115  and attr store1 > 69.915 ) or 
       bondedto (attr store1 < 23.3751263766  and attr store1 > 22.1751263766 ))) 
6 0.1 0.1 peak 1785 volume 5.87320 ppm1 0.728 ppm2 6.361
 
! ############### hot_mothernoesy_072403.1786 folded +
assi (attr store1 < 8.567 and attr store1 > 8.367 )
     ((attr store1 < 0.777 and attr store1 > 0.677 ) and 
      (bondedto (attr store1 < 118.873873623  and attr store1 > 117.673873623 ) or 
       bondedto (attr store1 < 71.134  and attr store1 > 69.934 ) or 
       bondedto (attr store1 < 23.3941263766  and attr store1 > 22.1941263766 ))) 
6 0.1 0.1 peak 1786 volume 3.36440 ppm1 0.727 ppm2 8.467
 
! ############### hot_mothernoesy_072403.1791 folded +
assi (attr store1 < 7.976 and attr store1 > 7.776 )
     ((attr store1 < 0.66 and attr store1 > 0.56 ) and 
      (bondedto (attr store1 < 118.804873623  and attr store1 > 117.604873623 ) or 
       bondedto (attr store1 < 71.065  and attr store1 > 69.865 ) or 
       bondedto (attr store1 < 23.3251263766  and attr store1 > 22.1251263766 ))) 
6 0.1 0.1 peak 1791 volume 4.20060 ppm1 0.610 ppm2 7.876
 
! ############### hot_mothernoesy_072403.1792 folded +
assi (attr store1 < 8.046 and attr store1 > 7.846 )
     ((attr store1 < 1.19 and attr store1 > 1.09 ) and 
      (bondedto (attr store1 < 118.736873623  and attr store1 > 117.536873623 ) or 
       bondedto (attr store1 < 70.997  and attr store1 > 69.797 ) or 
       bondedto (attr store1 < 23.2571263766  and attr store1 > 22.0571263766 ))) 
6 0.1 0.1 peak 1792 volume 9.76090 ppm1 1.140 ppm2 7.946
 
! ############### hot_mothernoesy_072403.1796 folded +
assi (attr store1 < 8.566 and attr store1 > 8.366 )
     ((attr store1 < 1.02 and attr store1 > 0.92 ) and 
      (bondedto (attr store1 < 118.081873623  and attr store1 > 116.881873623 ) or 
       bondedto (attr store1 < 70.342  and attr store1 > 69.142 ) or 
       bondedto (attr store1 < 22.6021263766  and attr store1 > 21.4021263766 ))) 
6 0.1 0.1 peak 1796 volume 5.52920 ppm1 0.970 ppm2 8.466
 
! ############### hot_mothernoesy_072403.1797 folded +
assi (attr store1 < 7.651 and attr store1 > 7.451 )
     ((attr store1 < 1.02 and attr store1 > 0.92 ) and 
      (bondedto (attr store1 < 118.064873623  and attr store1 > 116.864873623 ) or 
       bondedto (attr store1 < 70.325  and attr store1 > 69.125 ) or 
       bondedto (attr store1 < 22.5851263766  and attr store1 > 21.3851263766 ))) 
6 0.1 0.1 peak 1797 volume 18.45480 ppm1 0.970 ppm2 7.551
 
! ############### hot_mothernoesy_072403.1798 folded +
assi (attr store1 < 7.308 and attr store1 > 7.108 )
     ((attr store1 < 1.02 and attr store1 > 0.92 ) and 
      (bondedto (attr store1 < 118.079873623  and attr store1 > 116.879873623 ) or 
       bondedto (attr store1 < 70.34  and attr store1 > 69.14 ) or 
       bondedto (attr store1 < 22.6001263766  and attr store1 > 21.4001263766 ))) 
6 0.1 0.1 peak 1798 volume 5.75110 ppm1 0.970 ppm2 7.208
 
! ############### hot_mothernoesy_072403.1799 folded +
assi (attr store1 < 7.202 and attr store1 > 7.002 )
     ((attr store1 < 1.022 and attr store1 > 0.922 ) and 
      (bondedto (attr store1 < 118.060873623  and attr store1 > 116.860873623 ) or 
       bondedto (attr store1 < 70.321  and attr store1 > 69.121 ) or 
       bondedto (attr store1 < 22.5811263766  and attr store1 > 21.3811263766 ))) 
6 0.1 0.1 peak 1799 volume 5.04300 ppm1 0.972 ppm2 7.102
 
! ############### hot_mothernoesy_072403.1800 folded -
assi (attr store1 < 8.576 and attr store1 > 8.376 )
     ((attr store1 < 4.041 and attr store1 > 3.941 ) and 
      (bondedto (attr store1 < 141.376810435  and attr store1 > 140.176810435 ) or 
       bondedto (attr store1 < 45.8970631883  and attr store1 > 44.6970631883 ))) 
6 0.1 0.1 peak 1800 volume 8.375 ppm1 3.991 ppm2 8.476
 
! ############### hot_mothernoesy_072403.1803 folded +
assi (attr store1 < 8.043 and attr store1 > 7.843 )
     ((attr store1 < 1.058 and attr store1 > 0.958 ) and 
      (bondedto (attr store1 < 117.156873623  and attr store1 > 115.956873623 ) or 
       bondedto (attr store1 < 69.417  and attr store1 > 68.217 ) or 
       bondedto (attr store1 < 21.6771263766  and attr store1 > 20.4771263766 ))) 
6 0.1 0.1 peak 1803 volume 7.92110 ppm1 1.008 ppm2 7.943
 
! ############### hot_mothernoesy_072403.1807 folded +
assi (attr store1 < 7.989 and attr store1 > 7.789 )
     ((attr store1 < 1.076 and attr store1 > 0.976 ) and 
      (bondedto (attr store1 < 116.086873623  and attr store1 > 114.886873623 ) or 
       bondedto (attr store1 < 68.347  and attr store1 > 67.147 ) or 
       bondedto (attr store1 < 20.6071263766  and attr store1 > 19.4071263766 ))) 
6 0.1 0.1 peak 1807 volume 4.21850 ppm1 1.026 ppm2 7.889
 
! ############### hot_mothernoesy_072403.1809 folded -
assi (attr store1 < 8.153 and attr store1 > 7.953 )
     ((attr store1 < 3.261 and attr store1 > 3.161 ) and 
      (bondedto (attr store1 < 139.664810435  and attr store1 > 138.464810435 ) or 
       bondedto (attr store1 < 44.1850631883  and attr store1 > 42.9850631883 ))) 
6 0.1 0.1 peak 1809 volume 5.7513 ppm1 3.211 ppm2 8.053
 
! ############### hot_mothernoesy_072403.1810 folded -
assi (attr store1 < 7.497 and attr store1 > 7.297 )
     ((attr store1 < 3.258 and attr store1 > 3.158 ) and 
      (bondedto (attr store1 < 139.659810435  and attr store1 > 138.459810435 ) or 
       bondedto (attr store1 < 44.1800631883  and attr store1 > 42.9800631883 ))) 
6 0.1 0.1 peak 1810 volume 3.5898 ppm1 3.208 ppm2 7.397
 
! ############### hot_mothernoesy_072403.1811 folded -
assi (attr store1 < 7.118 and attr store1 > 6.918 )
     ((attr store1 < 3.261 and attr store1 > 3.161 ) and 
      (bondedto (attr store1 < 139.630810435  and attr store1 > 138.430810435 ) or 
       bondedto (attr store1 < 44.1510631883  and attr store1 > 42.9510631883 ))) 
6 0.1 0.1 peak 1811 volume 4.4116 ppm1 3.211 ppm2 7.018
 
! ############### hot_mothernoesy_072403.1812 folded -
assi (attr store1 < 7.038 and attr store1 > 6.838 )
     ((attr store1 < 3.258 and attr store1 > 3.158 ) and 
      (bondedto (attr store1 < 139.626810435  and attr store1 > 138.426810435 ) or 
       bondedto (attr store1 < 44.1470631883  and attr store1 > 42.9470631883 ))) 
6 0.1 0.1 peak 1812 volume 4.8242 ppm1 3.208 ppm2 6.938
 
! ############### hot_mothernoesy_072403.1813 folded -
assi (attr store1 < 9.451 and attr store1 > 9.251 )
     ((attr store1 < 1.569 and attr store1 > 1.469 ) and 
      (bondedto (attr store1 < 139.502810435  and attr store1 > 138.302810435 ) or 
       bondedto (attr store1 < 44.0230631883  and attr store1 > 42.8230631883 ))) 
6 0.1 0.1 peak 1813 volume 6.5618 ppm1 1.519 ppm2 9.351
 
! ############### hot_mothernoesy_072403.1814 folded -
assi (attr store1 < 8.245 and attr store1 > 8.045 )
     ((attr store1 < 1.46 and attr store1 > 1.36 ) and 
      (bondedto (attr store1 < 139.504810435  and attr store1 > 138.304810435 ) or 
       bondedto (attr store1 < 44.0250631883  and attr store1 > 42.8250631883 ))) 
6 0.1 0.1 peak 1814 volume 7.9092 ppm1 1.410 ppm2 8.145
 
! ############### hot_mothernoesy_072403.1815 folded -
assi (attr store1 < 8.165 and attr store1 > 7.965 )
     ((attr store1 < 1.444 and attr store1 > 1.344 ) and 
      (bondedto (attr store1 < 139.412810435  and attr store1 > 138.212810435 ) or 
       bondedto (attr store1 < 43.9330631883  and attr store1 > 42.7330631883 ))) 
6 0.1 0.1 peak 1815 volume 9.0969 ppm1 1.394 ppm2 8.065
 
! ############### hot_mothernoesy_072403.1816 folded -
assi (attr store1 < 8.567 and attr store1 > 8.367 )
     ((attr store1 < 1.359 and attr store1 > 1.259 ) and 
      (bondedto (attr store1 < 139.345810435  and attr store1 > 138.145810435 ) or 
       bondedto (attr store1 < 43.8660631883  and attr store1 > 42.6660631883 ))) 
6 0.1 0.1 peak 1816 volume 6.7161 ppm1 1.309 ppm2 8.467
 
! ############### hot_mothernoesy_072403.1817 folded +
assi (attr store1 < 8.51 and attr store1 > 8.31 )
     ((attr store1 < 3.542 and attr store1 > 3.442 ) and 
      (bondedto (attr store1 < 115.355873623  and attr store1 > 114.155873623 ) or 
       bondedto (attr store1 < 67.616  and attr store1 > 66.416 ) or 
       bondedto (attr store1 < 19.8761263766  and attr store1 > 18.6761263766 ))) 
6 0.1 0.1 peak 1817 volume 3.36510 ppm1 3.492 ppm2 8.410
 
! ############### hot_mothernoesy_072403.1818 folded -
assi (attr store1 < 7.226 and attr store1 > 7.026 )
     ((attr store1 < 1.513 and attr store1 > 1.413 ) and 
      (bondedto (attr store1 < 139.183810435  and attr store1 > 137.983810435 ) or 
       bondedto (attr store1 < 43.7040631883  and attr store1 > 42.5040631883 ))) 
6 0.1 0.1 peak 1818 volume 3.7593 ppm1 1.463 ppm2 7.126
 
! ############### hot_mothernoesy_072403.1819 folded -
assi (attr store1 < 8.565 and attr store1 > 8.365 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 139.143810435  and attr store1 > 137.943810435 ) or 
       bondedto (attr store1 < 43.6640631883  and attr store1 > 42.4640631883 ))) 
6 0.1 0.1 peak 1819 volume 6.093 ppm1 1.465 ppm2 8.465
 
! ############### hot_mothernoesy_072403.1820 folded -
assi (attr store1 < 7.121 and attr store1 > 6.921 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 139.151810435  and attr store1 > 137.951810435 ) or 
       bondedto (attr store1 < 43.6720631883  and attr store1 > 42.4720631883 ))) 
6 0.1 0.1 peak 1820 volume 4.3527 ppm1 1.465 ppm2 7.021
 
! ############### hot_mothernoesy_072403.1821 folded +
assi (attr store1 < 7.876 and attr store1 > 7.676 )
     ((attr store1 < 4.169 and attr store1 > 4.069 ) and 
      (bondedto (attr store1 < 115.037873623  and attr store1 > 113.837873623 ) or 
       bondedto (attr store1 < 67.298  and attr store1 > 66.098 ) or 
       bondedto (attr store1 < 19.5581263766  and attr store1 > 18.3581263766 ))) 
6 0.1 0.1 peak 1821 volume 3.20930 ppm1 4.119 ppm2 7.776
 
! ############### hot_mothernoesy_072403.1822 folded +
assi (attr store1 < 9.451 and attr store1 > 9.251 )
     ((attr store1 < 1.569 and attr store1 > 1.469 ) and 
      (bondedto (attr store1 < 115.057873623  and attr store1 > 113.857873623 ) or 
       bondedto (attr store1 < 67.318  and attr store1 > 66.118 ) or 
       bondedto (attr store1 < 19.5781263766  and attr store1 > 18.3781263766 ))) 
6 0.1 0.1 peak 1822 volume 23.46180 ppm1 1.519 ppm2 9.351
 
! ############### hot_mothernoesy_072403.1823 folded -
assi (attr store1 < 8.736 and attr store1 > 8.536 )
     ((attr store1 < 3.323 and attr store1 > 3.223 ) and 
      (bondedto (attr store1 < 138.969810435  and attr store1 > 137.769810435 ) or 
       bondedto (attr store1 < 43.4900631883  and attr store1 > 42.2900631883 ))) 
6 0.1 0.1 peak 1823 volume 3.3162 ppm1 3.273 ppm2 8.636
 
! ############### hot_mothernoesy_072403.1824 folded -
assi (attr store1 < 8.739 and attr store1 > 8.539 )
     ((attr store1 < 3.111 and attr store1 > 3.011 ) and 
      (bondedto (attr store1 < 138.923810435  and attr store1 > 137.723810435 ) or 
       bondedto (attr store1 < 43.4440631883  and attr store1 > 42.2440631883 ))) 
6 0.1 0.1 peak 1824 volume 3.8351 ppm1 3.061 ppm2 8.639
 
! ############### hot_mothernoesy_072403.1825 folded -
assi (attr store1 < 9.45 and attr store1 > 9.25 )
     ((attr store1 < 1.095 and attr store1 > 0.995 ) and 
      (bondedto (attr store1 < 138.962810435  and attr store1 > 137.762810435 ) or 
       bondedto (attr store1 < 43.4830631883  and attr store1 > 42.2830631883 ))) 
6 0.1 0.1 peak 1825 volume 6.2339 ppm1 1.045 ppm2 9.350
 
! ############### hot_mothernoesy_072403.1826 folded -
assi (attr store1 < 7.316 and attr store1 > 7.116 )
     ((attr store1 < 1.097 and attr store1 > 0.997 ) and 
      (bondedto (attr store1 < 138.969810435  and attr store1 > 137.769810435 ) or 
       bondedto (attr store1 < 43.4900631883  and attr store1 > 42.2900631883 ))) 
6 0.1 0.1 peak 1826 volume 6.103 ppm1 1.047 ppm2 7.216
 
! ############### hot_mothernoesy_072403.1827 folded +
assi (attr store1 < 7.221 and attr store1 > 7.021 )
     ((attr store1 < 1.566 and attr store1 > 1.466 ) and 
      (bondedto (attr store1 < 114.967873623  and attr store1 > 113.767873623 ) or 
       bondedto (attr store1 < 67.228  and attr store1 > 66.028 ) or 
       bondedto (attr store1 < 19.4881263766  and attr store1 > 18.2881263766 ))) 
6 0.1 0.1 peak 1827 volume 4.80520 ppm1 1.516 ppm2 7.121
 
! ############### hot_mothernoesy_072403.1828 folded +
assi (attr store1 < 8.247 and attr store1 > 8.047 )
     ((attr store1 < 1.461 and attr store1 > 1.361 ) and 
      (bondedto (attr store1 < 114.985873623  and attr store1 > 113.785873623 ) or 
       bondedto (attr store1 < 67.246  and attr store1 > 66.046 ) or 
       bondedto (attr store1 < 19.5061263766  and attr store1 > 18.3061263766 ))) 
6 0.1 0.1 peak 1828 volume 34.51530 ppm1 1.411 ppm2 8.147
 
! ############### hot_mothernoesy_072403.1829 folded +
assi (attr store1 < 8.164 and attr store1 > 7.964 )
     ((attr store1 < 1.443 and attr store1 > 1.343 ) and 
      (bondedto (attr store1 < 115.011873623  and attr store1 > 113.811873623 ) or 
       bondedto (attr store1 < 67.272  and attr store1 > 66.072 ) or 
       bondedto (attr store1 < 19.5321263766  and attr store1 > 18.3321263766 ))) 
6 0.1 0.1 peak 1829 volume 27.35850 ppm1 1.393 ppm2 8.064
 
! ############### hot_mothernoesy_072403.1830 folded +
assi (attr store1 < 8.566 and attr store1 > 8.366 )
     ((attr store1 < 1.358 and attr store1 > 1.258 ) and 
      (bondedto (attr store1 < 114.958873623  and attr store1 > 113.758873623 ) or 
       bondedto (attr store1 < 67.219  and attr store1 > 66.019 ) or 
       bondedto (attr store1 < 19.4791263766  and attr store1 > 18.2791263766 ))) 
6 0.1 0.1 peak 1830 volume 21.55790 ppm1 1.308 ppm2 8.466
 
! ############### hot_mothernoesy_072403.1831 folded +
assi (attr store1 < 7.246 and attr store1 > 7.046 )
     ((attr store1 < 1.358 and attr store1 > 1.258 ) and 
      (bondedto (attr store1 < 114.943873623  and attr store1 > 113.743873623 ) or 
       bondedto (attr store1 < 67.204  and attr store1 > 66.004 ) or 
       bondedto (attr store1 < 19.4641263766  and attr store1 > 18.2641263766 ))) 
6 0.1 0.1 peak 1831 volume 3.24700 ppm1 1.308 ppm2 7.146
 
! ############### hot_mothernoesy_072403.1833 folded +
assi (attr store1 < 8.291 and attr store1 > 8.091 )
     ((attr store1 < 4.116 and attr store1 > 4.016 ) and 
      (bondedto (attr store1 < 114.862873623  and attr store1 > 113.662873623 ) or 
       bondedto (attr store1 < 67.123  and attr store1 > 65.923 ) or 
       bondedto (attr store1 < 19.3831263766  and attr store1 > 18.1831263766 ))) 
6 0.1 0.1 peak 1833 volume 3.67600 ppm1 4.066 ppm2 8.191
 
! ############### hot_mothernoesy_072403.1834 folded +
assi (attr store1 < 8.039 and attr store1 > 7.839 )
     ((attr store1 < 3.958 and attr store1 > 3.858 ) and 
      (bondedto (attr store1 < 114.847873623  and attr store1 > 113.647873623 ) or 
       bondedto (attr store1 < 67.108  and attr store1 > 65.908 ) or 
       bondedto (attr store1 < 19.3681263766  and attr store1 > 18.1681263766 ))) 
6 0.1 0.1 peak 1834 volume 3.18550 ppm1 3.908 ppm2 7.939
 
! ############### hot_mothernoesy_072403.1839 folded +
assi (attr store1 < 7.394 and attr store1 > 7.194 )
     ((attr store1 < 1.516 and attr store1 > 1.416 ) and 
      (bondedto (attr store1 < 114.737873623  and attr store1 > 113.537873623 ) or 
       bondedto (attr store1 < 66.998  and attr store1 > 65.798 ) or 
       bondedto (attr store1 < 19.2581263766  and attr store1 > 18.0581263766 ))) 
6 0.1 0.1 peak 1839 volume 12.18740 ppm1 1.466 ppm2 7.294
 
! ############### hot_mothernoesy_072403.1841 folded +
assi (attr store1 < 7.124 and attr store1 > 6.924 )
     ((attr store1 < 1.515 and attr store1 > 1.415 ) and 
      (bondedto (attr store1 < 114.734873623  and attr store1 > 113.534873623 ) or 
       bondedto (attr store1 < 66.995  and attr store1 > 65.795 ) or 
       bondedto (attr store1 < 19.2551263766  and attr store1 > 18.0551263766 ))) 
6 0.1 0.1 peak 1841 volume 15.66580 ppm1 1.465 ppm2 7.024
 
! ############### hot_mothernoesy_072403.1842 folded -
assi (attr store1 < 8.452 and attr store1 > 8.252 )
     ((attr store1 < 1.295 and attr store1 > 1.195 ) and 
      (bondedto (attr store1 < 138.572810435  and attr store1 > 137.372810435 ) or 
       bondedto (attr store1 < 43.0930631883  and attr store1 > 41.8930631883 ))) 
6 0.1 0.1 peak 1842 volume 4.5486 ppm1 1.245 ppm2 8.352
 
! ############### hot_mothernoesy_072403.1843 folded +
assi (attr store1 < 7.984 and attr store1 > 7.784 )
     ((attr store1 < 1.4 and attr store1 > 1.3 ) and 
      (bondedto (attr store1 < 114.626873623  and attr store1 > 113.426873623 ) or 
       bondedto (attr store1 < 66.887  and attr store1 > 65.687 ) or 
       bondedto (attr store1 < 19.1471263766  and attr store1 > 17.9471263766 ))) 
6 0.1 0.1 peak 1843 volume 13.23740 ppm1 1.350 ppm2 7.884
 
! ############### hot_mothernoesy_072403.1844 folded +
assi (attr store1 < 6.981 and attr store1 > 6.781 )
     ((attr store1 < 1.4 and attr store1 > 1.3 ) and 
      (bondedto (attr store1 < 114.635873623  and attr store1 > 113.435873623 ) or 
       bondedto (attr store1 < 66.896  and attr store1 > 65.696 ) or 
       bondedto (attr store1 < 19.1561263766  and attr store1 > 17.9561263766 ))) 
6 0.1 0.1 peak 1844 volume 4.35210 ppm1 1.350 ppm2 6.881
 
! ############### hot_mothernoesy_072403.1848 folded +
assi (attr store1 < 7.656 and attr store1 > 7.456 )
     ((attr store1 < 1.095 and attr store1 > 0.995 ) and 
      (bondedto (attr store1 < 114.567873623  and attr store1 > 113.367873623 ) or 
       bondedto (attr store1 < 66.828  and attr store1 > 65.628 ) or 
       bondedto (attr store1 < 19.0881263766  and attr store1 > 17.8881263766 ))) 
6 0.1 0.1 peak 1848 volume 4.66860 ppm1 1.045 ppm2 7.556
 
! ############### hot_mothernoesy_072403.1853 folded -
assi (attr store1 < 8.287 and attr store1 > 8.087 )
     ((attr store1 < 1.728 and attr store1 > 1.628 ) and 
      (bondedto (attr store1 < 138.189810435  and attr store1 > 136.989810435 ) or 
       bondedto (attr store1 < 42.7100631883  and attr store1 > 41.5100631883 ))) 
6 0.1 0.1 peak 1853 volume 5.316 ppm1 1.678 ppm2 8.187
 
! ############### hot_mothernoesy_072403.1854 folded +
assi (attr store1 < 8.868 and attr store1 > 8.668 )
     ((attr store1 < 1.295 and attr store1 > 1.195 ) and 
      (bondedto (attr store1 < 114.115873623  and attr store1 > 112.915873623 ) or 
       bondedto (attr store1 < 66.376  and attr store1 > 65.176 ) or 
       bondedto (attr store1 < 18.6361263766  and attr store1 > 17.4361263766 ))) 
6 0.1 0.1 peak 1854 volume 6.73240 ppm1 1.245 ppm2 8.768
 
! ############### hot_mothernoesy_072403.1860 folded -
assi (attr store1 < 7.605 and attr store1 > 7.405 )
     ((attr store1 < 1.852 and attr store1 > 1.752 ) and 
      (bondedto (attr store1 < 137.903810435  and attr store1 > 136.703810435 ) or 
       bondedto (attr store1 < 42.4240631883  and attr store1 > 41.2240631883 ))) 
6 0.1 0.1 peak 1860 volume 4.7506 ppm1 1.802 ppm2 7.505
 
! ############### hot_mothernoesy_072403.1861 folded -
assi (attr store1 < 7.74 and attr store1 > 7.54 )
     ((attr store1 < 1.813 and attr store1 > 1.713 ) and 
      (bondedto (attr store1 < 137.906810435  and attr store1 > 136.706810435 ) or 
       bondedto (attr store1 < 42.4270631883  and attr store1 > 41.2270631883 ))) 
6 0.1 0.1 peak 1861 volume 4.3804 ppm1 1.763 ppm2 7.640
 
! ############### hot_mothernoesy_072403.1862 folded -
assi (attr store1 < 7.605 and attr store1 > 7.405 )
     ((attr store1 < 1.701 and attr store1 > 1.601 ) and 
      (bondedto (attr store1 < 137.905810435  and attr store1 > 136.705810435 ) or 
       bondedto (attr store1 < 42.4260631883  and attr store1 > 41.2260631883 ))) 
6 0.1 0.1 peak 1862 volume 3.9384 ppm1 1.651 ppm2 7.505
 
! ############### hot_mothernoesy_072403.1863 folded -
assi (attr store1 < 7.741 and attr store1 > 7.541 )
     ((attr store1 < 1.622 and attr store1 > 1.522 ) and 
      (bondedto (attr store1 < 137.927810435  and attr store1 > 136.727810435 ) or 
       bondedto (attr store1 < 42.4480631883  and attr store1 > 41.2480631883 ))) 
6 0.1 0.1 peak 1863 volume 4.4619 ppm1 1.572 ppm2 7.641
 
! ############### hot_mothernoesy_072403.1864 folded -
assi (attr store1 < 8.162 and attr store1 > 7.962 )
     ((attr store1 < 1.612 and attr store1 > 1.512 ) and 
      (bondedto (attr store1 < 137.782810435  and attr store1 > 136.582810435 ) or 
       bondedto (attr store1 < 42.3030631883  and attr store1 > 41.1030631883 ))) 
6 0.1 0.1 peak 1864 volume 4.5742 ppm1 1.562 ppm2 8.062
 
! ############### hot_mothernoesy_072403.1865 folded -
assi (attr store1 < 8.16 and attr store1 > 7.96 )
     ((attr store1 < 1.856 and attr store1 > 1.756 ) and 
      (bondedto (attr store1 < 137.753810435  and attr store1 > 136.553810435 ) or 
       bondedto (attr store1 < 42.2740631883  and attr store1 > 41.0740631883 ))) 
6 0.1 0.1 peak 1865 volume 6.6193 ppm1 1.806 ppm2 8.060
 
! ############### hot_mothernoesy_072403.1871 folded +
assi (attr store1 < 6.994 and attr store1 > 6.794 )
     ((attr store1 < 1.728 and attr store1 > 1.628 ) and 
      (bondedto (attr store1 < 113.747873623  and attr store1 > 112.547873623 ) or 
       bondedto (attr store1 < 66.008  and attr store1 > 64.808 ) or 
       bondedto (attr store1 < 18.2681263766  and attr store1 > 17.0681263766 ))) 
6 0.1 0.1 peak 1871 volume 5.81160 ppm1 1.678 ppm2 6.894
 
! ############### hot_mothernoesy_072403.1872 folded -
assi (attr store1 < 8.465 and attr store1 > 8.265 )
     ((attr store1 < 2.856 and attr store1 > 2.756 ) and 
      (bondedto (attr store1 < 137.588810435  and attr store1 > 136.388810435 ) or 
       bondedto (attr store1 < 42.1090631883  and attr store1 > 40.9090631883 ))) 
6 0.1 0.1 peak 1872 volume 3.6205 ppm1 2.806 ppm2 8.365
 
! ############### hot_mothernoesy_072403.1874 folded -
assi (attr store1 < 8.47 and attr store1 > 8.27 )
     ((attr store1 < 2.645 and attr store1 > 2.545 ) and 
      (bondedto (attr store1 < 137.575810435  and attr store1 > 136.375810435 ) or 
       bondedto (attr store1 < 42.0960631883  and attr store1 > 40.8960631883 ))) 
6 0.1 0.1 peak 1874 volume 4.353 ppm1 2.595 ppm2 8.370
 
! ############### hot_mothernoesy_072403.1875 folded +
assi (attr store1 < 8.247 and attr store1 > 8.047 )
     ((attr store1 < 0.951 and attr store1 > 0.851 ) and 
      (bondedto (attr store1 < 113.560873623  and attr store1 > 112.360873623 ) or 
       bondedto (attr store1 < 65.821  and attr store1 > 64.621 ) or 
       bondedto (attr store1 < 18.0811263766  and attr store1 > 16.8811263766 ))) 
6 0.1 0.1 peak 1875 volume 6.44460 ppm1 0.901 ppm2 8.147
 
! ############### hot_mothernoesy_072403.1876 folded +
assi (attr store1 < 7.895 and attr store1 > 7.695 )
     ((attr store1 < 0.95 and attr store1 > 0.85 ) and 
      (bondedto (attr store1 < 113.567873623  and attr store1 > 112.367873623 ) or 
       bondedto (attr store1 < 65.828  and attr store1 > 64.628 ) or 
       bondedto (attr store1 < 18.0881263766  and attr store1 > 16.8881263766 ))) 
6 0.1 0.1 peak 1876 volume 7.24010 ppm1 0.900 ppm2 7.795
 
! ############### hot_mothernoesy_072403.1877 folded -
assi (attr store1 < 8.391 and attr store1 > 8.191 )
     ((attr store1 < 2.727 and attr store1 > 2.627 ) and 
      (bondedto (attr store1 < 137.217810435  and attr store1 > 136.017810435 ) or 
       bondedto (attr store1 < 41.7380631883  and attr store1 > 40.5380631883 ))) 
6 0.1 0.1 peak 1877 volume 5.0478 ppm1 2.677 ppm2 8.291
 
! ############### hot_mothernoesy_072403.1880 folded +
assi (attr store1 < 8.428 and attr store1 > 8.228 )
     ((attr store1 < 4.22 and attr store1 > 4.12 ) and 
      (bondedto (attr store1 < 112.627873623  and attr store1 > 111.427873623 ) or 
       bondedto (attr store1 < 64.888  and attr store1 > 63.688 ) or 
       bondedto (attr store1 < 17.1481263766  and attr store1 > 15.9481263766 ))) 
6 0.1 0.1 peak 1880 volume 3.80520 ppm1 4.170 ppm2 8.328
 
! ############### hot_mothernoesy_072403.1881 folded +
assi (attr store1 < 8.426 and attr store1 > 8.226 )
     ((attr store1 < 4.048 and attr store1 > 3.948 ) and 
      (bondedto (attr store1 < 112.601873623  and attr store1 > 111.401873623 ) or 
       bondedto (attr store1 < 64.862  and attr store1 > 63.662 ) or 
       bondedto (attr store1 < 17.1221263766  and attr store1 > 15.9221263766 ))) 
6 0.1 0.1 peak 1881 volume 4.07540 ppm1 3.998 ppm2 8.326
 
! ############### hot_mothernoesy_072403.1882 folded +
assi (attr store1 < 8.465 and attr store1 > 8.265 )
     ((attr store1 < 3.922 and attr store1 > 3.822 ) and 
      (bondedto (attr store1 < 112.537873623  and attr store1 > 111.337873623 ) or 
       bondedto (attr store1 < 64.798  and attr store1 > 63.598 ) or 
       bondedto (attr store1 < 17.0581263766  and attr store1 > 15.8581263766 ))) 
6 0.1 0.1 peak 1882 volume 3.74660 ppm1 3.872 ppm2 8.365
 
! ############### hot_mothernoesy_072403.1883 folded +
assi (attr store1 < 8.285 and attr store1 > 8.085 )
     ((attr store1 < 3.922 and attr store1 > 3.822 ) and 
      (bondedto (attr store1 < 112.553873623  and attr store1 > 111.353873623 ) or 
       bondedto (attr store1 < 64.814  and attr store1 > 63.614 ) or 
       bondedto (attr store1 < 17.0741263766  and attr store1 > 15.8741263766 ))) 
6 0.1 0.1 peak 1883 volume 3.57920 ppm1 3.872 ppm2 8.185
 
! ############### hot_mothernoesy_072403.1886 folded +
assi (attr store1 < 8.565 and attr store1 > 8.365 )
     ((attr store1 < 4.456 and attr store1 > 4.356 ) and 
      (bondedto (attr store1 < 112.101873623  and attr store1 > 110.901873623 ) or 
       bondedto (attr store1 < 64.362  and attr store1 > 63.162 ) or 
       bondedto (attr store1 < 16.6221263766  and attr store1 > 15.4221263766 ))) 
6 0.1 0.1 peak 1886 volume 18.36340 ppm1 4.406 ppm2 8.465
 
! ############### hot_mothernoesy_072403.1887 folded +
assi (attr store1 < 8.869 and attr store1 > 8.669 )
     ((attr store1 < 2.178 and attr store1 > 2.078 ) and 
      (bondedto (attr store1 < 112.035873623  and attr store1 > 110.835873623 ) or 
       bondedto (attr store1 < 64.296  and attr store1 > 63.096 ) or 
       bondedto (attr store1 < 16.5561263766  and attr store1 > 15.3561263766 ))) 
6 0.1 0.1 peak 1887 volume 3.44540 ppm1 2.128 ppm2 8.769
 
! ############### hot_mothernoesy_072403.1888 folded +
assi (attr store1 < 8.562 and attr store1 > 8.362 )
     ((attr store1 < 2.175 and attr store1 > 2.075 ) and 
      (bondedto (attr store1 < 112.045873623  and attr store1 > 110.845873623 ) or 
       bondedto (attr store1 < 64.306  and attr store1 > 63.106 ) or 
       bondedto (attr store1 < 16.5661263766  and attr store1 > 15.3661263766 ))) 
6 0.1 0.1 peak 1888 volume 3.49480 ppm1 2.125 ppm2 8.462
 
! ############### hot_mothernoesy_072403.1889 folded +
assi (attr store1 < 7.229 and attr store1 > 7.029 )
     ((attr store1 < 2.176 and attr store1 > 2.076 ) and 
      (bondedto (attr store1 < 112.033873623  and attr store1 > 110.833873623 ) or 
       bondedto (attr store1 < 64.294  and attr store1 > 63.094 ) or 
       bondedto (attr store1 < 16.5541263766  and attr store1 > 15.3541263766 ))) 
6 0.1 0.1 peak 1889 volume 6.78120 ppm1 2.126 ppm2 7.129
 
! ############### hot_mothernoesy_072403.1890 folded +
assi (attr store1 < 7.876 and attr store1 > 7.676 )
     ((attr store1 < 2.177 and attr store1 > 2.077 ) and 
      (bondedto (attr store1 < 112.026873623  and attr store1 > 110.826873623 ) or 
       bondedto (attr store1 < 64.287  and attr store1 > 63.087 ) or 
       bondedto (attr store1 < 16.5471263766  and attr store1 > 15.3471263766 ))) 
6 0.1 0.1 peak 1890 volume 5.94340 ppm1 2.127 ppm2 7.776
 
! ############### hot_mothernoesy_072403.1891 folded +
assi (attr store1 < 7.391 and attr store1 > 7.191 )
     ((attr store1 < 2.175 and attr store1 > 2.075 ) and 
      (bondedto (attr store1 < 112.020873623  and attr store1 > 110.820873623 ) or 
       bondedto (attr store1 < 64.281  and attr store1 > 63.081 ) or 
       bondedto (attr store1 < 16.5411263766  and attr store1 > 15.3411263766 ))) 
6 0.1 0.1 peak 1891 volume 6.31600 ppm1 2.125 ppm2 7.291
 
! ############### hot_mothernoesy_072403.1893 folded +
assi (attr store1 < 7.879 and attr store1 > 7.679 )
     ((attr store1 < 4.077 and attr store1 > 3.977 ) and 
      (bondedto (attr store1 < 111.762873623  and attr store1 > 110.562873623 ) or 
       bondedto (attr store1 < 64.023  and attr store1 > 62.823 ) or 
       bondedto (attr store1 < 16.2831263766  and attr store1 > 15.0831263766 ))) 
6 0.1 0.1 peak 1893 volume 3.60360 ppm1 4.027 ppm2 7.779
 
! ############### hot_mothernoesy_072403.1894 folded +
assi (attr store1 < 9.017 and attr store1 > 8.817 )
     ((attr store1 < 4.412 and attr store1 > 4.312 ) and 
      (bondedto (attr store1 < 111.667873623  and attr store1 > 110.467873623 ) or 
       bondedto (attr store1 < 63.928  and attr store1 > 62.728 ) or 
       bondedto (attr store1 < 16.1881263766  and attr store1 > 14.9881263766 ))) 
6 0.1 0.1 peak 1894 volume 14.86890 ppm1 4.362 ppm2 8.917
 
! ############### hot_mothernoesy_072403.1895 folded +
assi (attr store1 < 7.045 and attr store1 > 6.845 )
     ((attr store1 < 2.814 and attr store1 > 2.714 ) and 
      (bondedto (attr store1 < 111.384873623  and attr store1 > 110.184873623 ) or 
       bondedto (attr store1 < 63.645  and attr store1 > 62.445 ) or 
       bondedto (attr store1 < 15.9051263766  and attr store1 > 14.7051263766 ))) 
6 0.1 0.1 peak 1895 volume 3.58180 ppm1 2.764 ppm2 6.945
 
! ############### hot_mothernoesy_072403.1897 folded -
assi (attr store1 < 7.969 and attr store1 > 7.769 )
     ((attr store1 < 3.168 and attr store1 > 3.068 ) and 
      (bondedto (attr store1 < 134.819810435  and attr store1 > 133.619810435 ) or 
       bondedto (attr store1 < 39.3400631883  and attr store1 > 38.1400631883 ))) 
6 0.1 0.1 peak 1897 volume 5.6257 ppm1 3.118 ppm2 7.869
 
! ############### hot_mothernoesy_072403.1898 folded -
assi (attr store1 < 7.969 and attr store1 > 7.769 )
     ((attr store1 < 3.051 and attr store1 > 2.951 ) and 
      (bondedto (attr store1 < 134.801810435  and attr store1 > 133.601810435 ) or 
       bondedto (attr store1 < 39.3220631883  and attr store1 > 38.1220631883 ))) 
6 0.1 0.1 peak 1898 volume 5.8401 ppm1 3.001 ppm2 7.869
 
! ############### hot_mothernoesy_072403.1903 folded +
assi (attr store1 < 8.417 and attr store1 > 8.217 )
     ((attr store1 < 4.117 and attr store1 > 4.017 ) and 
      (bondedto (attr store1 < 110.805873623  and attr store1 > 109.605873623 ) or 
       bondedto (attr store1 < 63.066  and attr store1 > 61.866 ) or 
       bondedto (attr store1 < 15.3261263766  and attr store1 > 14.1261263766 ))) 
6 0.1 0.1 peak 1903 volume 9.02140 ppm1 4.067 ppm2 8.317
 
! ############### hot_mothernoesy_072403.1904 folded -
assi (attr store1 < 7.719 and attr store1 > 7.519 )
     ((attr store1 < 2.753 and attr store1 > 2.653 ) and 
      (bondedto (attr store1 < 134.654810435  and attr store1 > 133.454810435 ) or 
       bondedto (attr store1 < 39.1750631883  and attr store1 > 37.9750631883 ))) 
6 0.1 0.1 peak 1904 volume 3.4535 ppm1 2.703 ppm2 7.619
 
! ############### hot_mothernoesy_072403.1905 folded -
assi (attr store1 < 7.717 and attr store1 > 7.517 )
     ((attr store1 < 2.62 and attr store1 > 2.52 ) and 
      (bondedto (attr store1 < 134.660810435  and attr store1 > 133.460810435 ) or 
       bondedto (attr store1 < 39.1810631883  and attr store1 > 37.9810631883 ))) 
6 0.1 0.1 peak 1905 volume 4.1173 ppm1 2.570 ppm2 7.617
 
! ############### hot_mothernoesy_072403.1906 folded -
assi (attr store1 < 7.042 and attr store1 > 6.842 )
     ((attr store1 < 2.815 and attr store1 > 2.715 ) and 
      (bondedto (attr store1 < 134.529810435  and attr store1 > 133.329810435 ) or 
       bondedto (attr store1 < 39.0500631883  and attr store1 > 37.8500631883 ))) 
6 0.1 0.1 peak 1906 volume 21.5738 ppm1 2.765 ppm2 6.942
 
! ############### hot_mothernoesy_072403.1907 folded -
assi (attr store1 < 8.247 and attr store1 > 8.047 )
     ((attr store1 < 1.924 and attr store1 > 1.824 ) and 
      (bondedto (attr store1 < 134.565810435  and attr store1 > 133.365810435 ) or 
       bondedto (attr store1 < 39.0860631883  and attr store1 > 37.8860631883 ))) 
6 0.1 0.1 peak 1907 volume 4.5112 ppm1 1.874 ppm2 8.147
 
! ############### hot_mothernoesy_072403.1909 folded +
assi (attr store1 < 8.107 and attr store1 > 7.907 )
     ((attr store1 < 3.215 and attr store1 > 3.115 ) and 
      (bondedto (attr store1 < 110.546873623  and attr store1 > 109.346873623 ) or 
       bondedto (attr store1 < 62.807  and attr store1 > 61.607 ) or 
       bondedto (attr store1 < 15.0671263766  and attr store1 > 13.8671263766 ))) 
6 0.1 0.1 peak 1909 volume 7.76150 ppm1 3.165 ppm2 8.007
 
! ############### hot_mothernoesy_072403.1912 folded +
assi (attr store1 < 8.462 and attr store1 > 8.262 )
     ((attr store1 < 3.212 and attr store1 > 3.112 ) and 
      (bondedto (attr store1 < 110.511873623  and attr store1 > 109.311873623 ) or 
       bondedto (attr store1 < 62.772  and attr store1 > 61.572 ) or 
       bondedto (attr store1 < 15.0321263766  and attr store1 > 13.8321263766 ))) 
6 0.1 0.1 peak 1912 volume 5.31180 ppm1 3.162 ppm2 8.362
 
! ############### hot_mothernoesy_072403.1915 folded +
assi (attr store1 < 8.246 and attr store1 > 8.046 )
     ((attr store1 < 4.075 and attr store1 > 3.975 ) and 
      (bondedto (attr store1 < 110.325873623  and attr store1 > 109.125873623 ) or 
       bondedto (attr store1 < 62.586  and attr store1 > 61.386 ) or 
       bondedto (attr store1 < 14.8461263766  and attr store1 > 13.6461263766 ))) 
6 0.1 0.1 peak 1915 volume 16.30880 ppm1 4.025 ppm2 8.146
 
! ############### hot_mothernoesy_072403.1916 folded +
assi (attr store1 < 7.895 and attr store1 > 7.695 )
     ((attr store1 < 4.073 and attr store1 > 3.973 ) and 
      (bondedto (attr store1 < 110.328873623  and attr store1 > 109.128873623 ) or 
       bondedto (attr store1 < 62.589  and attr store1 > 61.389 ) or 
       bondedto (attr store1 < 14.8491263766  and attr store1 > 13.6491263766 ))) 
6 0.1 0.1 peak 1916 volume 9.38450 ppm1 4.023 ppm2 7.795
 
! ############### hot_mothernoesy_072403.1918 folded -
assi (attr store1 < 8.037 and attr store1 > 7.837 )
     ((attr store1 < 3.141 and attr store1 > 3.041 ) and 
      (bondedto (attr store1 < 134.061810435  and attr store1 > 132.861810435 ) or 
       bondedto (attr store1 < 38.5820631883  and attr store1 > 37.3820631883 ))) 
6 0.1 0.1 peak 1918 volume 5.0531 ppm1 3.091 ppm2 7.937
 
! ############### hot_mothernoesy_072403.1919 folded -
assi (attr store1 < 7.961 and attr store1 > 7.761 )
     ((attr store1 < 3.134 and attr store1 > 3.034 ) and 
      (bondedto (attr store1 < 134.079810435  and attr store1 > 132.879810435 ) or 
       bondedto (attr store1 < 38.6000631883  and attr store1 > 37.4000631883 ))) 
6 0.1 0.1 peak 1919 volume 4.1787 ppm1 3.084 ppm2 7.861
 
! ############### hot_mothernoesy_072403.1920 folded -
assi (attr store1 < 8.039 and attr store1 > 7.839 )
     ((attr store1 < 3.023 and attr store1 > 2.923 ) and 
      (bondedto (attr store1 < 134.038810435  and attr store1 > 132.838810435 ) or 
       bondedto (attr store1 < 38.5590631883  and attr store1 > 37.3590631883 ))) 
6 0.1 0.1 peak 1920 volume 5.5544 ppm1 2.973 ppm2 7.939
 
! ############### hot_mothernoesy_072403.1921 folded -
assi (attr store1 < 7.968 and attr store1 > 7.768 )
     ((attr store1 < 3.027 and attr store1 > 2.927 ) and 
      (bondedto (attr store1 < 134.016810435  and attr store1 > 132.816810435 ) or 
       bondedto (attr store1 < 38.5370631883  and attr store1 > 37.3370631883 ))) 
6 0.1 0.1 peak 1921 volume 5.2046 ppm1 2.977 ppm2 7.868
 
! ############### hot_mothernoesy_072403.1926 folded +
assi (attr store1 < 7.657 and attr store1 > 7.457 )
     ((attr store1 < 4.042 and attr store1 > 3.942 ) and 
      (bondedto (attr store1 < 109.925873623  and attr store1 > 108.725873623 ) or 
       bondedto (attr store1 < 62.186  and attr store1 > 60.986 ) or 
       bondedto (attr store1 < 14.4461263766  and attr store1 > 13.2461263766 ))) 
6 0.1 0.1 peak 1926 volume 3.87960 ppm1 3.992 ppm2 7.557
 
! ############### hot_mothernoesy_072403.1930 folded +
assi (attr store1 < 8.734 and attr store1 > 8.534 )
     ((attr store1 < 3.902 and attr store1 > 3.802 ) and 
      (bondedto (attr store1 < 109.513873623  and attr store1 > 108.313873623 ) or 
       bondedto (attr store1 < 61.774  and attr store1 > 60.574 ) or 
       bondedto (attr store1 < 14.0341263766  and attr store1 > 12.8341263766 ))) 
6 0.1 0.1 peak 1930 volume 3.42960 ppm1 3.852 ppm2 8.634
 
! ############### hot_mothernoesy_072403.1932 folded -
assi (attr store1 < 7.978 and attr store1 > 7.778 )
     ((attr store1 < 3.234 and attr store1 > 3.134 ) and 
      (bondedto (attr store1 < 133.252810435  and attr store1 > 132.052810435 ) or 
       bondedto (attr store1 < 37.7730631883  and attr store1 > 36.5730631883 ))) 
6 0.1 0.1 peak 1932 volume 5.5255 ppm1 3.184 ppm2 7.878
 
! ############### hot_mothernoesy_072403.1934 folded -
assi (attr store1 < 7.978 and attr store1 > 7.778 )
     ((attr store1 < 2.874 and attr store1 > 2.774 ) and 
      (bondedto (attr store1 < 133.239810435  and attr store1 > 132.039810435 ) or 
       bondedto (attr store1 < 37.7600631883  and attr store1 > 36.5600631883 ))) 
6 0.1 0.1 peak 1934 volume 5.876 ppm1 2.824 ppm2 7.878
 
! ############### hot_mothernoesy_072403.1935 folded -
assi (attr store1 < 7.587 and attr store1 > 7.387 )
     ((attr store1 < 2.872 and attr store1 > 2.772 ) and 
      (bondedto (attr store1 < 133.262810435  and attr store1 > 132.062810435 ) or 
       bondedto (attr store1 < 37.7830631883  and attr store1 > 36.5830631883 ))) 
6 0.1 0.1 peak 1935 volume 5.858 ppm1 2.822 ppm2 7.487
 
! ############### hot_mothernoesy_072403.1936 folded -
assi (attr store1 < 6.88 and attr store1 > 6.68 )
     ((attr store1 < 2.872 and attr store1 > 2.772 ) and 
      (bondedto (attr store1 < 133.228810435  and attr store1 > 132.028810435 ) or 
       bondedto (attr store1 < 37.7490631883  and attr store1 > 36.5490631883 ))) 
6 0.1 0.1 peak 1936 volume 3.6378 ppm1 2.822 ppm2 6.780
 
! ############### hot_mothernoesy_072403.1937 folded -
assi (attr store1 < 7.859 and attr store1 > 7.659 )
     ((attr store1 < 3.032 and attr store1 > 2.932 ) and 
      (bondedto (attr store1 < 133.109810435  and attr store1 > 131.909810435 ) or 
       bondedto (attr store1 < 37.6300631883  and attr store1 > 36.4300631883 ))) 
6 0.1 0.1 peak 1937 volume 3.2457 ppm1 2.982 ppm2 7.759
 
! ############### hot_mothernoesy_072403.1938 folded -
assi (attr store1 < 9.026 and attr store1 > 8.826 )
     ((attr store1 < 2.937 and attr store1 > 2.837 ) and 
      (bondedto (attr store1 < 133.131810435  and attr store1 > 131.931810435 ) or 
       bondedto (attr store1 < 37.6520631883  and attr store1 > 36.4520631883 ))) 
6 0.1 0.1 peak 1938 volume 3.2205 ppm1 2.887 ppm2 8.926
 
! ############### hot_mothernoesy_072403.1939 folded -
assi (attr store1 < 7.857 and attr store1 > 7.657 )
     ((attr store1 < 2.937 and attr store1 > 2.837 ) and 
      (bondedto (attr store1 < 133.121810435  and attr store1 > 131.921810435 ) or 
       bondedto (attr store1 < 37.6420631883  and attr store1 > 36.4420631883 ))) 
6 0.1 0.1 peak 1939 volume 3.7133 ppm1 2.887 ppm2 7.757
 
! ############### hot_mothernoesy_072403.1941 folded -
assi (attr store1 < 9.452 and attr store1 > 9.252 )
     ((attr store1 < 2.499 and attr store1 > 2.399 ) and 
      (bondedto (attr store1 < 132.941810435  and attr store1 > 131.741810435 ) or 
       bondedto (attr store1 < 37.4620631883  and attr store1 > 36.2620631883 ))) 
6 0.1 0.1 peak 1941 volume 5.8122 ppm1 2.449 ppm2 9.352
 
! ############### hot_mothernoesy_072403.1942 folded -
assi (attr store1 < 9.454 and attr store1 > 9.254 )
     ((attr store1 < 2.372 and attr store1 > 2.272 ) and 
      (bondedto (attr store1 < 132.926810435  and attr store1 > 131.726810435 ) or 
       bondedto (attr store1 < 37.4470631883  and attr store1 > 36.2470631883 ))) 
6 0.1 0.1 peak 1942 volume 5.4565 ppm1 2.322 ppm2 9.354
 
! ############### hot_mothernoesy_072403.1943 folded -
assi (attr store1 < 8.545 and attr store1 > 8.345 )
     ((attr store1 < 2.275 and attr store1 > 2.175 ) and 
      (bondedto (attr store1 < 132.950810435  and attr store1 > 131.750810435 ) or 
       bondedto (attr store1 < 37.4710631883  and attr store1 > 36.2710631883 ))) 
6 0.1 0.1 peak 1943 volume 4.2025 ppm1 2.225 ppm2 8.445
 
! ############### hot_mothernoesy_072403.1944 folded -
assi (attr store1 < 8.545 and attr store1 > 8.345 )
     ((attr store1 < 2.361 and attr store1 > 2.261 ) and 
      (bondedto (attr store1 < 132.914810435  and attr store1 > 131.714810435 ) or 
       bondedto (attr store1 < 37.4350631883  and attr store1 > 36.2350631883 ))) 
6 0.1 0.1 peak 1944 volume 4.4577 ppm1 2.311 ppm2 8.445
 
! ############### hot_mothernoesy_072403.1946 folded -
assi (attr store1 < 7.94 and attr store1 > 7.74 )
     ((attr store1 < 2.422 and attr store1 > 2.322 ) and 
      (bondedto (attr store1 < 132.636810435  and attr store1 > 131.436810435 ) or 
       bondedto (attr store1 < 37.1570631883  and attr store1 > 35.9570631883 ))) 
6 0.1 0.1 peak 1946 volume 7.2035 ppm1 2.372 ppm2 7.840
 
! ############### hot_mothernoesy_072403.1947 folded +
assi (attr store1 < 8.159 and attr store1 > 7.959 )
     ((attr store1 < 3.938 and attr store1 > 3.838 ) and 
      (bondedto (attr store1 < 108.760873623  and attr store1 > 107.560873623 ) or 
       bondedto (attr store1 < 61.021  and attr store1 > 59.821 ) or 
       bondedto (attr store1 < 13.2811263766  and attr store1 > 12.0811263766 ))) 
6 0.1 0.1 peak 1947 volume 4.33670 ppm1 3.888 ppm2 8.059
 
! ############### hot_mothernoesy_072403.1952 folded -
assi (attr store1 < 7.939 and attr store1 > 7.739 )
     ((attr store1 < 2.326 and attr store1 > 2.226 ) and 
      (bondedto (attr store1 < 132.630810435  and attr store1 > 131.430810435 ) or 
       bondedto (attr store1 < 37.1510631883  and attr store1 > 35.9510631883 ))) 
6 0.1 0.1 peak 1952 volume 6.9699 ppm1 2.276 ppm2 7.839
 
! ############### hot_mothernoesy_072403.1953 folded +
assi (attr store1 < 7.881 and attr store1 > 7.681 )
     ((attr store1 < 4.352 and attr store1 > 4.252 ) and 
      (bondedto (attr store1 < 108.610873623  and attr store1 > 107.410873623 ) or 
       bondedto (attr store1 < 60.871  and attr store1 > 59.671 ) or 
       bondedto (attr store1 < 13.1311263766  and attr store1 > 11.9311263766 ))) 
6 0.1 0.1 peak 1953 volume 5.22810 ppm1 4.302 ppm2 7.781
 
! ############### hot_mothernoesy_072403.1954 folded +
assi (attr store1 < 7.601 and attr store1 > 7.401 )
     ((attr store1 < 4.353 and attr store1 > 4.253 ) and 
      (bondedto (attr store1 < 108.645873623  and attr store1 > 107.445873623 ) or 
       bondedto (attr store1 < 60.906  and attr store1 > 59.706 ) or 
       bondedto (attr store1 < 13.1661263766  and attr store1 > 11.9661263766 ))) 
6 0.1 0.1 peak 1954 volume 4.37550 ppm1 4.303 ppm2 7.501
 
! ############### hot_mothernoesy_072403.1955 folded +
assi (attr store1 < 9.454 and attr store1 > 9.254 )
     ((attr store1 < 4.093 and attr store1 > 3.993 ) and 
      (bondedto (attr store1 < 108.406873623  and attr store1 > 107.206873623 ) or 
       bondedto (attr store1 < 60.667  and attr store1 > 59.467 ) or 
       bondedto (attr store1 < 12.9271263766  and attr store1 > 11.7271263766 ))) 
6 0.1 0.1 peak 1955 volume 9.74600 ppm1 4.043 ppm2 9.354
 
! ############### hot_mothernoesy_072403.1956 folded +
assi (attr store1 < 8.567 and attr store1 > 8.367 )
     ((attr store1 < 4.092 and attr store1 > 3.992 ) and 
      (bondedto (attr store1 < 108.414873623  and attr store1 > 107.214873623 ) or 
       bondedto (attr store1 < 60.675  and attr store1 > 59.475 ) or 
       bondedto (attr store1 < 12.9351263766  and attr store1 > 11.7351263766 ))) 
6 0.1 0.1 peak 1956 volume 3.73710 ppm1 4.042 ppm2 8.467
 
! ############### hot_mothernoesy_072403.1959 folded +
assi (attr store1 < 9.272 and attr store1 > 9.072 )
     ((attr store1 < 4.247 and attr store1 > 4.147 ) and 
      (bondedto (attr store1 < 108.328873623  and attr store1 > 107.128873623 ) or 
       bondedto (attr store1 < 60.589  and attr store1 > 59.389 ) or 
       bondedto (attr store1 < 12.8491263766  and attr store1 > 11.6491263766 ))) 
6 0.1 0.1 peak 1959 volume 4.08780 ppm1 4.197 ppm2 9.172
 
! ############### hot_mothernoesy_072403.1960 folded -
assi (attr store1 < 9.02 and attr store1 > 8.82 )
     ((attr store1 < 2.384 and attr store1 > 2.284 ) and 
      (bondedto (attr store1 < 132.114810435  and attr store1 > 130.914810435 ) or 
       bondedto (attr store1 < 36.6350631883  and attr store1 > 35.4350631883 ))) 
6 0.1 0.1 peak 1960 volume 10.7561 ppm1 2.334 ppm2 8.920
 
! ############### hot_mothernoesy_072403.1962 folded +
assi (attr store1 < 7.518 and attr store1 > 7.318 )
     ((attr store1 < 4.32 and attr store1 > 4.22 ) and 
      (bondedto (attr store1 < 108.002873623  and attr store1 > 106.802873623 ) or 
       bondedto (attr store1 < 60.263  and attr store1 > 59.063 ) or 
       bondedto (attr store1 < 12.5231263766  and attr store1 > 11.3231263766 ))) 
6 0.1 0.1 peak 1962 volume 6.36850 ppm1 4.270 ppm2 7.418
 
! ############### hot_mothernoesy_072403.1963 folded +
assi (attr store1 < 8.547 and attr store1 > 8.347 )
     ((attr store1 < 4.205 and attr store1 > 4.105 ) and 
      (bondedto (attr store1 < 107.941873623  and attr store1 > 106.741873623 ) or 
       bondedto (attr store1 < 60.202  and attr store1 > 59.002 ) or 
       bondedto (attr store1 < 12.4621263766  and attr store1 > 11.2621263766 ))) 
6 0.1 0.1 peak 1963 volume 9.16480 ppm1 4.155 ppm2 8.447
 
! ############### hot_mothernoesy_072403.1964 folded +
assi (attr store1 < 7.944 and attr store1 > 7.744 )
     ((attr store1 < 4.206 and attr store1 > 4.106 ) and 
      (bondedto (attr store1 < 107.950873623  and attr store1 > 106.750873623 ) or 
       bondedto (attr store1 < 60.211  and attr store1 > 59.011 ) or 
       bondedto (attr store1 < 12.4711263766  and attr store1 > 11.2711263766 ))) 
6 0.1 0.1 peak 1964 volume 4.22270 ppm1 4.156 ppm2 7.844
 
! ############### hot_mothernoesy_072403.1965 folded +
assi (attr store1 < 8.847 and attr store1 > 8.647 )
     ((attr store1 < 4.201 and attr store1 > 4.101 ) and 
      (bondedto (attr store1 < 107.953873623  and attr store1 > 106.753873623 ) or 
       bondedto (attr store1 < 60.214  and attr store1 > 59.014 ) or 
       bondedto (attr store1 < 12.4741263766  and attr store1 > 11.2741263766 ))) 
6 0.1 0.1 peak 1965 volume 4.44860 ppm1 4.151 ppm2 8.747
 
! ############### hot_mothernoesy_072403.1966 folded +
assi (attr store1 < 8.405 and attr store1 > 8.205 )
     ((attr store1 < 4.028 and attr store1 > 3.928 ) and 
      (bondedto (attr store1 < 107.864873623  and attr store1 > 106.664873623 ) or 
       bondedto (attr store1 < 60.125  and attr store1 > 58.925 ) or 
       bondedto (attr store1 < 12.3851263766  and attr store1 > 11.1851263766 ))) 
6 0.1 0.1 peak 1966 volume 7.48470 ppm1 3.978 ppm2 8.305
 
! ############### hot_mothernoesy_072403.1967 folded +
assi (attr store1 < 8.848 and attr store1 > 8.648 )
     ((attr store1 < 4.017 and attr store1 > 3.917 ) and 
      (bondedto (attr store1 < 107.867873623  and attr store1 > 106.667873623 ) or 
       bondedto (attr store1 < 60.128  and attr store1 > 58.928 ) or 
       bondedto (attr store1 < 12.3881263766  and attr store1 > 11.1881263766 ))) 
6 0.1 0.1 peak 1967 volume 3.92790 ppm1 3.967 ppm2 8.748
 
! ############### hot_mothernoesy_072403.1968 folded +
assi (attr store1 < 8.151 and attr store1 > 7.951 )
     ((attr store1 < 4.02 and attr store1 > 3.92 ) and 
      (bondedto (attr store1 < 107.863873623  and attr store1 > 106.663873623 ) or 
       bondedto (attr store1 < 60.124  and attr store1 > 58.924 ) or 
       bondedto (attr store1 < 12.3841263766  and attr store1 > 11.1841263766 ))) 
6 0.1 0.1 peak 1968 volume 9.27200 ppm1 3.970 ppm2 8.051
 
! ############### hot_mothernoesy_072403.1969 folded +
assi (attr store1 < 7.867 and attr store1 > 7.667 )
     ((attr store1 < 4.019 and attr store1 > 3.919 ) and 
      (bondedto (attr store1 < 107.864873623  and attr store1 > 106.664873623 ) or 
       bondedto (attr store1 < 60.125  and attr store1 > 58.925 ) or 
       bondedto (attr store1 < 12.3851263766  and attr store1 > 11.1851263766 ))) 
6 0.1 0.1 peak 1969 volume 4.00590 ppm1 3.969 ppm2 7.767
 
! ############### hot_mothernoesy_072403.1970 folded -
assi (attr store1 < 7.412 and attr store1 > 7.212 )
     ((attr store1 < 2.52 and attr store1 > 2.42 ) and 
      (bondedto (attr store1 < 131.785810435  and attr store1 > 130.585810435 ) or 
       bondedto (attr store1 < 36.3060631883  and attr store1 > 35.1060631883 ))) 
6 0.1 0.1 peak 1970 volume 6.0793 ppm1 2.470 ppm2 7.312
 
! ############### hot_mothernoesy_072403.1971 folded -
assi (attr store1 < 7.41 and attr store1 > 7.21 )
     ((attr store1 < 2.369 and attr store1 > 2.269 ) and 
      (bondedto (attr store1 < 131.785810435  and attr store1 > 130.585810435 ) or 
       bondedto (attr store1 < 36.3060631883  and attr store1 > 35.1060631883 ))) 
6 0.1 0.1 peak 1971 volume 5.8362 ppm1 2.319 ppm2 7.310
 
! ############### hot_mothernoesy_072403.1972 folded +
assi (attr store1 < 8.651 and attr store1 > 8.451 )
     ((attr store1 < 4.124 and attr store1 > 4.024 ) and 
      (bondedto (attr store1 < 107.520873623  and attr store1 > 106.320873623 ) or 
       bondedto (attr store1 < 59.781  and attr store1 > 58.581 ) or 
       bondedto (attr store1 < 12.0411263766  and attr store1 > 10.8411263766 ))) 
6 0.1 0.1 peak 1972 volume 5.85970 ppm1 4.074 ppm2 8.551
 
! ############### hot_mothernoesy_072403.1973 folded +
assi (attr store1 < 7.975 and attr store1 > 7.775 )
     ((attr store1 < 4.118 and attr store1 > 4.018 ) and 
      (bondedto (attr store1 < 107.508873623  and attr store1 > 106.308873623 ) or 
       bondedto (attr store1 < 59.769  and attr store1 > 58.569 ) or 
       bondedto (attr store1 < 12.0291263766  and attr store1 > 10.8291263766 ))) 
6 0.1 0.1 peak 1973 volume 5.71040 ppm1 4.068 ppm2 7.875
 
! ############### hot_mothernoesy_072403.1974 folded +
assi (attr store1 < 6.896 and attr store1 > 6.696 )
     ((attr store1 < 3.767 and attr store1 > 3.667 ) and 
      (bondedto (attr store1 < 107.435873623  and attr store1 > 106.235873623 ) or 
       bondedto (attr store1 < 59.696  and attr store1 > 58.496 ) or 
       bondedto (attr store1 < 11.9561263766  and attr store1 > 10.7561263766 ))) 
6 0.1 0.1 peak 1974 volume 7.57260 ppm1 3.717 ppm2 6.796
 
! ############### hot_mothernoesy_072403.1975 folded +
assi (attr store1 < 8.141 and attr store1 > 7.941 )
     ((attr store1 < 4.058 and attr store1 > 3.958 ) and 
      (bondedto (attr store1 < 107.342873623  and attr store1 > 106.142873623 ) or 
       bondedto (attr store1 < 59.603  and attr store1 > 58.403 ) or 
       bondedto (attr store1 < 11.8631263766  and attr store1 > 10.6631263766 ))) 
6 0.1 0.1 peak 1975 volume 5.08720 ppm1 4.008 ppm2 8.041
 
! ############### hot_mothernoesy_072403.1976 folded +
assi (attr store1 < 8.086 and attr store1 > 7.886 )
     ((attr store1 < 4.056 and attr store1 > 3.956 ) and 
      (bondedto (attr store1 < 107.322873623  and attr store1 > 106.122873623 ) or 
       bondedto (attr store1 < 59.583  and attr store1 > 58.383 ) or 
       bondedto (attr store1 < 11.8431263766  and attr store1 > 10.6431263766 ))) 
6 0.1 0.1 peak 1976 volume 4.08970 ppm1 4.006 ppm2 7.986
 
! ############### hot_mothernoesy_072403.1977 folded +
assi (attr store1 < 7.941 and attr store1 > 7.741 )
     ((attr store1 < 4.059 and attr store1 > 3.959 ) and 
      (bondedto (attr store1 < 107.345873623  and attr store1 > 106.145873623 ) or 
       bondedto (attr store1 < 59.606  and attr store1 > 58.406 ) or 
       bondedto (attr store1 < 11.8661263766  and attr store1 > 10.6661263766 ))) 
6 0.1 0.1 peak 1977 volume 8.35500 ppm1 4.009 ppm2 7.841
 
! ############### hot_mothernoesy_072403.1978 folded +
assi (attr store1 < 8.432 and attr store1 > 8.232 )
     ((attr store1 < 4.499 and attr store1 > 4.399 ) and 
      (bondedto (attr store1 < 106.930873623  and attr store1 > 105.730873623 ) or 
       bondedto (attr store1 < 59.191  and attr store1 > 57.991 ) or 
       bondedto (attr store1 < 11.4511263766  and attr store1 > 10.2511263766 ))) 
6 0.1 0.1 peak 1978 volume 4.78610 ppm1 4.449 ppm2 8.332
 
! ############### hot_mothernoesy_072403.1980 folded +
assi (attr store1 < 8.783 and attr store1 > 8.583 )
     ((attr store1 < 4.502 and attr store1 > 4.402 ) and 
      (bondedto (attr store1 < 106.873873623  and attr store1 > 105.673873623 ) or 
       bondedto (attr store1 < 59.134  and attr store1 > 57.934 ) or 
       bondedto (attr store1 < 11.3941263766  and attr store1 > 10.1941263766 ))) 
6 0.1 0.1 peak 1980 volume 5.57300 ppm1 4.452 ppm2 8.683
 
! ############### hot_mothernoesy_072403.1981 folded +
assi (attr store1 < 8.858 and attr store1 > 8.658 )
     ((attr store1 < 3.972 and attr store1 > 3.872 ) and 
      (bondedto (attr store1 < 106.837873623  and attr store1 > 105.637873623 ) or 
       bondedto (attr store1 < 59.098  and attr store1 > 57.898 ) or 
       bondedto (attr store1 < 11.3581263766  and attr store1 > 10.1581263766 ))) 
6 0.1 0.1 peak 1981 volume 3.33040 ppm1 3.922 ppm2 8.758
 
! ############### hot_mothernoesy_072403.1982 folded +
assi (attr store1 < 8.834 and attr store1 > 8.634 )
     ((attr store1 < 4.012 and attr store1 > 3.912 ) and 
      (bondedto (attr store1 < 106.742873623  and attr store1 > 105.542873623 ) or 
       bondedto (attr store1 < 59.003  and attr store1 > 57.803 ) or 
       bondedto (attr store1 < 11.2631263766  and attr store1 > 10.0631263766 ))) 
6 0.1 0.1 peak 1982 volume 3.59900 ppm1 3.962 ppm2 8.734
 
! ############### hot_mothernoesy_072403.1983 folded +
assi (attr store1 < 8.8 and attr store1 > 8.6 )
     ((attr store1 < 4.014 and attr store1 > 3.914 ) and 
      (bondedto (attr store1 < 106.737873623  and attr store1 > 105.537873623 ) or 
       bondedto (attr store1 < 58.998  and attr store1 > 57.798 ) or 
       bondedto (attr store1 < 11.2581263766  and attr store1 > 10.0581263766 ))) 
6 0.1 0.1 peak 1983 volume 3.27740 ppm1 3.964 ppm2 8.700
 
! ############### hot_mothernoesy_072403.1984 folded +
assi (attr store1 < 7.732 and attr store1 > 7.532 )
     ((attr store1 < 4.186 and attr store1 > 4.086 ) and 
      (bondedto (attr store1 < 106.673873623  and attr store1 > 105.473873623 ) or 
       bondedto (attr store1 < 58.934  and attr store1 > 57.734 ) or 
       bondedto (attr store1 < 11.1941263766  and attr store1 > 9.9941263766 ))) 
6 0.1 0.1 peak 1984 volume 9.25190 ppm1 4.136 ppm2 7.632
 
! ############### hot_mothernoesy_072403.1985 folded +
assi (attr store1 < 8.547 and attr store1 > 8.347 )
     ((attr store1 < 4.013 and attr store1 > 3.913 ) and 
      (bondedto (attr store1 < 106.700873623  and attr store1 > 105.500873623 ) or 
       bondedto (attr store1 < 58.961  and attr store1 > 57.761 ) or 
       bondedto (attr store1 < 11.2211263766  and attr store1 > 10.0211263766 ))) 
6 0.1 0.1 peak 1985 volume 4.11310 ppm1 3.963 ppm2 8.447
 
! ############### hot_mothernoesy_072403.1986 folded +
assi (attr store1 < 8.147 and attr store1 > 7.947 )
     ((attr store1 < 4.012 and attr store1 > 3.912 ) and 
      (bondedto (attr store1 < 106.667873623  and attr store1 > 105.467873623 ) or 
       bondedto (attr store1 < 58.928  and attr store1 > 57.728 ) or 
       bondedto (attr store1 < 11.1881263766  and attr store1 > 9.9881263766 ))) 
6 0.1 0.1 peak 1986 volume 4.90900 ppm1 3.962 ppm2 8.047
 
! ############### hot_mothernoesy_072403.1987 folded +
assi (attr store1 < 7.316 and attr store1 > 7.116 )
     ((attr store1 < 4.077 and attr store1 > 3.977 ) and 
      (bondedto (attr store1 < 106.587873623  and attr store1 > 105.387873623 ) or 
       bondedto (attr store1 < 58.848  and attr store1 > 57.648 ) or 
       bondedto (attr store1 < 11.1081263766  and attr store1 > 9.9081263766 ))) 
6 0.1 0.1 peak 1987 volume 6.30640 ppm1 4.027 ppm2 7.216
 
! ############### hot_mothernoesy_072403.1988 folded +
assi (attr store1 < 7.121 and attr store1 > 6.921 )
     ((attr store1 < 4.077 and attr store1 > 3.977 ) and 
      (bondedto (attr store1 < 106.559873623  and attr store1 > 105.359873623 ) or 
       bondedto (attr store1 < 58.82  and attr store1 > 57.62 ) or 
       bondedto (attr store1 < 11.0801263766  and attr store1 > 9.8801263766 ))) 
6 0.1 0.1 peak 1988 volume 3.65670 ppm1 4.027 ppm2 7.021
 
! ############### hot_mothernoesy_072403.1989 folded +
assi (attr store1 < 7.413 and attr store1 > 7.213 )
     ((attr store1 < 3.937 and attr store1 > 3.837 ) and 
      (bondedto (attr store1 < 106.534873623  and attr store1 > 105.334873623 ) or 
       bondedto (attr store1 < 58.795  and attr store1 > 57.595 ) or 
       bondedto (attr store1 < 11.0551263766  and attr store1 > 9.8551263766 ))) 
6 0.1 0.1 peak 1989 volume 3.34310 ppm1 3.887 ppm2 7.313
 
! ############### hot_mothernoesy_072403.1990 folded +
assi (attr store1 < 7.12 and attr store1 > 6.92 )
     ((attr store1 < 3.936 and attr store1 > 3.836 ) and 
      (bondedto (attr store1 < 106.530873623  and attr store1 > 105.330873623 ) or 
       bondedto (attr store1 < 58.791  and attr store1 > 57.591 ) or 
       bondedto (attr store1 < 11.0511263766  and attr store1 > 9.8511263766 ))) 
6 0.1 0.1 peak 1990 volume 9.26850 ppm1 3.886 ppm2 7.020
 
! ############### hot_mothernoesy_072403.1991 folded +
assi (attr store1 < 8.466 and attr store1 > 8.266 )
     ((attr store1 < 4.559 and attr store1 > 4.459 ) and 
      (bondedto (attr store1 < 106.411873623  and attr store1 > 105.211873623 ) or 
       bondedto (attr store1 < 58.672  and attr store1 > 57.472 ) or 
       bondedto (attr store1 < 10.9321263766  and attr store1 > 9.7321263766 ))) 
6 0.1 0.1 peak 1991 volume 10.53720 ppm1 4.509 ppm2 8.366
 
! ############### hot_mothernoesy_072403.1992 folded +
assi (attr store1 < 8.288 and attr store1 > 8.088 )
     ((attr store1 < 4.562 and attr store1 > 4.462 ) and 
      (bondedto (attr store1 < 106.374873623  and attr store1 > 105.174873623 ) or 
       bondedto (attr store1 < 58.635  and attr store1 > 57.435 ) or 
       bondedto (attr store1 < 10.8951263766  and attr store1 > 9.6951263766 ))) 
6 0.1 0.1 peak 1992 volume 4.37460 ppm1 4.512 ppm2 8.188
 
! ############### hot_mothernoesy_072403.1993 folded +
assi (attr store1 < 8.176 and attr store1 > 7.976 )
     ((attr store1 < 4.599 and attr store1 > 4.499 ) and 
      (bondedto (attr store1 < 106.286873623  and attr store1 > 105.086873623 ) or 
       bondedto (attr store1 < 58.547  and attr store1 > 57.347 ) or 
       bondedto (attr store1 < 10.8071263766  and attr store1 > 9.6071263766 ))) 
6 0.1 0.1 peak 1993 volume 13.59120 ppm1 4.549 ppm2 8.076
 
! ############### hot_mothernoesy_072403.1994 folded +
assi (attr store1 < 8.112 and attr store1 > 7.912 )
     ((attr store1 < 4.054 and attr store1 > 3.954 ) and 
      (bondedto (attr store1 < 106.292873623  and attr store1 > 105.092873623 ) or 
       bondedto (attr store1 < 58.553  and attr store1 > 57.353 ) or 
       bondedto (attr store1 < 10.8131263766  and attr store1 > 9.6131263766 ))) 
6 0.1 0.1 peak 1994 volume 4.95490 ppm1 4.004 ppm2 8.012
 
! ############### hot_mothernoesy_072403.1995 folded -
assi (attr store1 < 8.157 and attr store1 > 7.957 )
     ((attr store1 < 2.462 and attr store1 > 2.362 ) and 
      (bondedto (attr store1 < 130.128810435  and attr store1 > 128.928810435 ) or 
       bondedto (attr store1 < 34.6490631883  and attr store1 > 33.4490631883 ))) 
6 0.1 0.1 peak 1995 volume 3.4819 ppm1 2.412 ppm2 8.057
 
! ############### hot_mothernoesy_072403.1996 folded -
assi (attr store1 < 8.041 and attr store1 > 7.841 )
     ((attr store1 < 2.465 and attr store1 > 2.365 ) and 
      (bondedto (attr store1 < 130.130810435  and attr store1 > 128.930810435 ) or 
       bondedto (attr store1 < 34.6510631883  and attr store1 > 33.4510631883 ))) 
6 0.1 0.1 peak 1996 volume 10.7436 ppm1 2.415 ppm2 7.941
 
! ############### hot_mothernoesy_072403.1997 folded +
assi (attr store1 < 7.977 and attr store1 > 7.777 )
     ((attr store1 < 4.597 and attr store1 > 4.497 ) and 
      (bondedto (attr store1 < 106.202873623  and attr store1 > 105.002873623 ) or 
       bondedto (attr store1 < 58.463  and attr store1 > 57.263 ) or 
       bondedto (attr store1 < 10.7231263766  and attr store1 > 9.5231263766 ))) 
6 0.1 0.1 peak 1997 volume 10.45880 ppm1 4.547 ppm2 7.877
 
! ############### hot_mothernoesy_072403.1999 folded +
assi (attr store1 < 8.277 and attr store1 > 8.077 )
     ((attr store1 < 4.486 and attr store1 > 4.386 ) and 
      (bondedto (attr store1 < 106.236873623  and attr store1 > 105.036873623 ) or 
       bondedto (attr store1 < 58.497  and attr store1 > 57.297 ) or 
       bondedto (attr store1 < 10.7571263766  and attr store1 > 9.5571263766 ))) 
6 0.1 0.1 peak 1999 volume 10.89600 ppm1 4.436 ppm2 8.177
 
! ############### hot_mothernoesy_072403.2000 folded +
assi (attr store1 < 7.042 and attr store1 > 6.842 )
     ((attr store1 < 4.486 and attr store1 > 4.386 ) and 
      (bondedto (attr store1 < 106.221873623  and attr store1 > 105.021873623 ) or 
       bondedto (attr store1 < 58.482  and attr store1 > 57.282 ) or 
       bondedto (attr store1 < 10.7421263766  and attr store1 > 9.5421263766 ))) 
6 0.1 0.1 peak 2000 volume 16.67500 ppm1 4.436 ppm2 6.942
 
! ############### hot_mothernoesy_072403.2001 folded -
assi (attr store1 < 7.625 and attr store1 > 7.425 )
     ((attr store1 < 2.463 and attr store1 > 2.363 ) and 
      (bondedto (attr store1 < 130.089810435  and attr store1 > 128.889810435 ) or 
       bondedto (attr store1 < 34.6100631883  and attr store1 > 33.4100631883 ))) 
6 0.1 0.1 peak 2001 volume 9.5802 ppm1 2.413 ppm2 7.525
 
! ############### hot_mothernoesy_072403.2002 folded -
assi (attr store1 < 7.02 and attr store1 > 6.82 )
     ((attr store1 < 2.462 and attr store1 > 2.362 ) and 
      (bondedto (attr store1 < 130.100810435  and attr store1 > 128.900810435 ) or 
       bondedto (attr store1 < 34.6210631883  and attr store1 > 33.4210631883 ))) 
6 0.1 0.1 peak 2002 volume 3.4611 ppm1 2.412 ppm2 6.920
 
! ############### hot_mothernoesy_072403.2003 folded +
assi (attr store1 < 8.308 and attr store1 > 8.108 )
     ((attr store1 < 4.584 and attr store1 > 4.484 ) and 
      (bondedto (attr store1 < 106.093873623  and attr store1 > 104.893873623 ) or 
       bondedto (attr store1 < 58.354  and attr store1 > 57.154 ) or 
       bondedto (attr store1 < 10.6141263766  and attr store1 > 9.4141263766 ))) 
6 0.1 0.1 peak 2003 volume 4.57780 ppm1 4.534 ppm2 8.208
 
! ############### hot_mothernoesy_072403.2004 folded +
assi (attr store1 < 7.746 and attr store1 > 7.546 )
     ((attr store1 < 4.585 and attr store1 > 4.485 ) and 
      (bondedto (attr store1 < 106.074873623  and attr store1 > 104.874873623 ) or 
       bondedto (attr store1 < 58.335  and attr store1 > 57.135 ) or 
       bondedto (attr store1 < 10.5951263766  and attr store1 > 9.3951263766 ))) 
6 0.1 0.1 peak 2004 volume 7.84410 ppm1 4.535 ppm2 7.646
 
! ############### hot_mothernoesy_072403.2005 folded +
assi (attr store1 < 7.408 and attr store1 > 7.208 )
     ((attr store1 < 4.585 and attr store1 > 4.485 ) and 
      (bondedto (attr store1 < 106.092873623  and attr store1 > 104.892873623 ) or 
       bondedto (attr store1 < 58.353  and attr store1 > 57.153 ) or 
       bondedto (attr store1 < 10.6131263766  and attr store1 > 9.4131263766 ))) 
6 0.1 0.1 peak 2005 volume 4.64260 ppm1 4.535 ppm2 7.308
 
! ############### hot_mothernoesy_072403.2006 folded -
assi (attr store1 < 7.731 and attr store1 > 7.531 )
     ((attr store1 < 2.6 and attr store1 > 2.5 ) and 
      (bondedto (attr store1 < 129.953810435  and attr store1 > 128.753810435 ) or 
       bondedto (attr store1 < 34.4740631883  and attr store1 > 33.2740631883 ))) 
6 0.1 0.1 peak 2006 volume 8.7439 ppm1 2.550 ppm2 7.631
 
! ############### hot_mothernoesy_072403.2007 folded -
assi (attr store1 < 7.737 and attr store1 > 7.537 )
     ((attr store1 < 2.465 and attr store1 > 2.365 ) and 
      (bondedto (attr store1 < 129.936810435  and attr store1 > 128.736810435 ) or 
       bondedto (attr store1 < 34.4570631883  and attr store1 > 33.2570631883 ))) 
6 0.1 0.1 peak 2007 volume 10.7291 ppm1 2.415 ppm2 7.637
 
! ############### hot_mothernoesy_072403.2008 folded -
assi (attr store1 < 7.314 and attr store1 > 7.114 )
     ((attr store1 < 2.447 and attr store1 > 2.347 ) and 
      (bondedto (attr store1 < 129.848810435  and attr store1 > 128.648810435 ) or 
       bondedto (attr store1 < 34.3690631883  and attr store1 > 33.1690631883 ))) 
6 0.1 0.1 peak 2008 volume 5.1414 ppm1 2.397 ppm2 7.214
 
! ############### hot_mothernoesy_072403.2009 folded -
assi (attr store1 < 6.948 and attr store1 > 6.748 )
     ((attr store1 < 2.454 and attr store1 > 2.354 ) and 
      (bondedto (attr store1 < 129.900810435  and attr store1 > 128.700810435 ) or 
       bondedto (attr store1 < 34.4210631883  and attr store1 > 33.2210631883 ))) 
6 0.1 0.1 peak 2009 volume 4.1843 ppm1 2.404 ppm2 6.848
 
! ############### hot_mothernoesy_072403.2010 folded +
assi (attr store1 < 7.978 and attr store1 > 7.778 )
     ((attr store1 < 4.212 and attr store1 > 4.112 ) and 
      (bondedto (attr store1 < 105.904873623  and attr store1 > 104.704873623 ) or 
       bondedto (attr store1 < 58.165  and attr store1 > 56.965 ) or 
       bondedto (attr store1 < 10.4251263766  and attr store1 > 9.2251263766 ))) 
6 0.1 0.1 peak 2010 volume 6.60230 ppm1 4.162 ppm2 7.878
 
! ############### hot_mothernoesy_072403.2011 folded -
assi (attr store1 < 7.743 and attr store1 > 7.543 )
     ((attr store1 < 2.385 and attr store1 > 2.285 ) and 
      (bondedto (attr store1 < 129.834810435  and attr store1 > 128.634810435 ) or 
       bondedto (attr store1 < 34.3550631883  and attr store1 > 33.1550631883 ))) 
6 0.1 0.1 peak 2011 volume 4.8862 ppm1 2.335 ppm2 7.643
 
! ############### hot_mothernoesy_072403.2012 folded -
assi (attr store1 < 7.316 and attr store1 > 7.116 )
     ((attr store1 < 2.388 and attr store1 > 2.288 ) and 
      (bondedto (attr store1 < 129.808810435  and attr store1 > 128.608810435 ) or 
       bondedto (attr store1 < 34.3290631883  and attr store1 > 33.1290631883 ))) 
6 0.1 0.1 peak 2012 volume 5.6207 ppm1 2.338 ppm2 7.216
 
! ############### hot_mothernoesy_072403.2013 folded -
assi (attr store1 < 6.942 and attr store1 > 6.742 )
     ((attr store1 < 2.38 and attr store1 > 2.28 ) and 
      (bondedto (attr store1 < 129.835810435  and attr store1 > 128.635810435 ) or 
       bondedto (attr store1 < 34.3560631883  and attr store1 > 33.1560631883 ))) 
6 0.1 0.1 peak 2013 volume 3.7456 ppm1 2.330 ppm2 6.842
 
! ############### hot_mothernoesy_072403.2014 folded -
assi (attr store1 < 7.646 and attr store1 > 7.446 )
     ((attr store1 < 2.366 and attr store1 > 2.266 ) and 
      (bondedto (attr store1 < 129.826810435  and attr store1 > 128.626810435 ) or 
       bondedto (attr store1 < 34.3470631883  and attr store1 > 33.1470631883 ))) 
6 0.1 0.1 peak 2014 volume 3.9622 ppm1 2.316 ppm2 7.546
 
! ############### hot_mothernoesy_072403.2016 folded -
assi (attr store1 < 8.791 and attr store1 > 8.591 )
     ((attr store1 < 2.491 and attr store1 > 2.391 ) and 
      (bondedto (attr store1 < 129.502810435  and attr store1 > 128.302810435 ) or 
       bondedto (attr store1 < 34.0230631883  and attr store1 > 32.8230631883 ))) 
6 0.1 0.1 peak 2016 volume 3.3347 ppm1 2.441 ppm2 8.691
 
! ############### hot_mothernoesy_072403.2017 folded -
assi (attr store1 < 8.55 and attr store1 > 8.35 )
     ((attr store1 < 2.486 and attr store1 > 2.386 ) and 
      (bondedto (attr store1 < 129.485810435  and attr store1 > 128.285810435 ) or 
       bondedto (attr store1 < 34.0060631883  and attr store1 > 32.8060631883 ))) 
6 0.1 0.1 peak 2017 volume 3.8331 ppm1 2.436 ppm2 8.450
 
! ############### hot_mothernoesy_072403.2018 folded -
assi (attr store1 < 8.029 and attr store1 > 7.829 )
     ((attr store1 < 2.488 and attr store1 > 2.388 ) and 
      (bondedto (attr store1 < 129.497810435  and attr store1 > 128.297810435 ) or 
       bondedto (attr store1 < 34.0180631883  and attr store1 > 32.8180631883 ))) 
6 0.1 0.1 peak 2018 volume 17.8645 ppm1 2.438 ppm2 7.929
 
! ############### hot_mothernoesy_072403.2019 folded -
assi (attr store1 < 7.032 and attr store1 > 6.832 )
     ((attr store1 < 2.488 and attr store1 > 2.388 ) and 
      (bondedto (attr store1 < 129.513810435  and attr store1 > 128.313810435 ) or 
       bondedto (attr store1 < 34.0340631883  and attr store1 > 32.8340631883 ))) 
6 0.1 0.1 peak 2019 volume 8.0441 ppm1 2.438 ppm2 6.932
 
! ############### hot_mothernoesy_072403.2020 folded -
assi (attr store1 < 8.259 and attr store1 > 8.059 )
     ((attr store1 < 1.926 and attr store1 > 1.826 ) and 
      (bondedto (attr store1 < 129.348810435  and attr store1 > 128.148810435 ) or 
       bondedto (attr store1 < 33.8690631883  and attr store1 > 32.6690631883 ))) 
6 0.1 0.1 peak 2020 volume 4.8919 ppm1 1.876 ppm2 8.159
 
! ############### hot_mothernoesy_072403.2021 folded -
assi (attr store1 < 8.542 and attr store1 > 8.342 )
     ((attr store1 < 1.914 and attr store1 > 1.814 ) and 
      (bondedto (attr store1 < 129.312810435  and attr store1 > 128.112810435 ) or 
       bondedto (attr store1 < 33.8330631883  and attr store1 > 32.6330631883 ))) 
6 0.1 0.1 peak 2021 volume 6.6906 ppm1 1.864 ppm2 8.442
 
! ############### hot_mothernoesy_072403.2022 folded -
assi (attr store1 < 8.259 and attr store1 > 8.059 )
     ((attr store1 < 1.857 and attr store1 > 1.757 ) and 
      (bondedto (attr store1 < 129.353810435  and attr store1 > 128.153810435 ) or 
       bondedto (attr store1 < 33.8740631883  and attr store1 > 32.6740631883 ))) 
6 0.1 0.1 peak 2022 volume 4.3217 ppm1 1.807 ppm2 8.159
 
! ############### hot_mothernoesy_072403.2023 folded -
assi (attr store1 < 8.538 and attr store1 > 8.338 )
     ((attr store1 < 1.82 and attr store1 > 1.72 ) and 
      (bondedto (attr store1 < 129.333810435  and attr store1 > 128.133810435 ) or 
       bondedto (attr store1 < 33.8540631883  and attr store1 > 32.6540631883 ))) 
6 0.1 0.1 peak 2023 volume 5.912 ppm1 1.770 ppm2 8.438
 
! ############### hot_mothernoesy_072403.2024 folded +
assi (attr store1 < 9.45 and attr store1 > 9.25 )
     ((attr store1 < 3.95 and attr store1 > 3.85 ) and 
      (bondedto (attr store1 < 105.370873623  and attr store1 > 104.170873623 ) or 
       bondedto (attr store1 < 57.631  and attr store1 > 56.431 ) or 
       bondedto (attr store1 < 9.8911263766  and attr store1 > 8.6911263766 ))) 
6 0.1 0.1 peak 2024 volume 7.05780 ppm1 3.900 ppm2 9.350
 
! ############### hot_mothernoesy_072403.2025 folded -
assi (attr store1 < 8.418 and attr store1 > 8.218 )
     ((attr store1 < 1.919 and attr store1 > 1.819 ) and 
      (bondedto (attr store1 < 129.223810435  and attr store1 > 128.023810435 ) or 
       bondedto (attr store1 < 33.7440631883  and attr store1 > 32.5440631883 ))) 
6 0.1 0.1 peak 2025 volume 3.3653 ppm1 1.869 ppm2 8.318
 
! ############### hot_mothernoesy_072403.2028 folded +
assi (attr store1 < 8.431 and attr store1 > 8.231 )
     ((attr store1 < 4.39 and attr store1 > 4.29 ) and 
      (bondedto (attr store1 < 105.037873623  and attr store1 > 103.837873623 ) or 
       bondedto (attr store1 < 57.298  and attr store1 > 56.098 ) or 
       bondedto (attr store1 < 9.5581263766  and attr store1 > 8.3581263766 ))) 
6 0.1 0.1 peak 2028 volume 11.57390 ppm1 4.340 ppm2 8.331
 
! ############### hot_mothernoesy_072403.2029 folded +
assi (attr store1 < 8.256 and attr store1 > 8.056 )
     ((attr store1 < 4.39 and attr store1 > 4.29 ) and 
      (bondedto (attr store1 < 105.048873623  and attr store1 > 103.848873623 ) or 
       bondedto (attr store1 < 57.309  and attr store1 > 56.109 ) or 
       bondedto (attr store1 < 9.5691263766  and attr store1 > 8.3691263766 ))) 
6 0.1 0.1 peak 2029 volume 6.93040 ppm1 4.340 ppm2 8.156
 
! ############### hot_mothernoesy_072403.2030 folded +
assi (attr store1 < 8.871 and attr store1 > 8.671 )
     ((attr store1 < 4.275 and attr store1 > 4.175 ) and 
      (bondedto (attr store1 < 105.064873623  and attr store1 > 103.864873623 ) or 
       bondedto (attr store1 < 57.325  and attr store1 > 56.125 ) or 
       bondedto (attr store1 < 9.5851263766  and attr store1 > 8.3851263766 ))) 
6 0.1 0.1 peak 2030 volume 3.43120 ppm1 4.225 ppm2 8.771
 
! ############### hot_mothernoesy_072403.2031 folded +
assi (attr store1 < 7.876 and attr store1 > 7.676 )
     ((attr store1 < 4.278 and attr store1 > 4.178 ) and 
      (bondedto (attr store1 < 105.035873623  and attr store1 > 103.835873623 ) or 
       bondedto (attr store1 < 57.296  and attr store1 > 56.096 ) or 
       bondedto (attr store1 < 9.5561263766  and attr store1 > 8.3561263766 ))) 
6 0.1 0.1 peak 2031 volume 4.38710 ppm1 4.228 ppm2 7.776
 
! ############### hot_mothernoesy_072403.2032 folded +
assi (attr store1 < 8.559 and attr store1 > 8.359 )
     ((attr store1 < 4.355 and attr store1 > 4.255 ) and 
      (bondedto (attr store1 < 104.906873623  and attr store1 > 103.706873623 ) or 
       bondedto (attr store1 < 57.167  and attr store1 > 55.967 ) or 
       bondedto (attr store1 < 9.4271263766  and attr store1 > 8.2271263766 ))) 
6 0.1 0.1 peak 2032 volume 13.42250 ppm1 4.305 ppm2 8.459
 
! ############### hot_mothernoesy_072403.2033 folded +
assi (attr store1 < 8.503 and attr store1 > 8.303 )
     ((attr store1 < 4.335 and attr store1 > 4.235 ) and 
      (bondedto (attr store1 < 104.865873623  and attr store1 > 103.665873623 ) or 
       bondedto (attr store1 < 57.126  and attr store1 > 55.926 ) or 
       bondedto (attr store1 < 9.3861263766  and attr store1 > 8.1861263766 ))) 
6 0.1 0.1 peak 2033 volume 10.36580 ppm1 4.285 ppm2 8.403
 
! ############### hot_mothernoesy_072403.2034 folded +
assi (attr store1 < 8.316 and attr store1 > 8.116 )
     ((attr store1 < 4.333 and attr store1 > 4.233 ) and 
      (bondedto (attr store1 < 104.883873623  and attr store1 > 103.683873623 ) or 
       bondedto (attr store1 < 57.144  and attr store1 > 55.944 ) or 
       bondedto (attr store1 < 9.4041263766  and attr store1 > 8.2041263766 ))) 
6 0.1 0.1 peak 2034 volume 4.21000 ppm1 4.283 ppm2 8.216
 
! ############### hot_mothernoesy_072403.2035 folded -
assi (attr store1 < 8.059 and attr store1 > 7.859 )
     ((attr store1 < 2.141 and attr store1 > 2.041 ) and 
      (bondedto (attr store1 < 128.642810435  and attr store1 > 127.442810435 ) or 
       bondedto (attr store1 < 33.1630631883  and attr store1 > 31.9630631883 ))) 
6 0.1 0.1 peak 2035 volume 3.5028 ppm1 2.091 ppm2 7.959
 
! ############### hot_mothernoesy_072403.2036 folded -
assi (attr store1 < 8.094 and attr store1 > 7.894 )
     ((attr store1 < 1.877 and attr store1 > 1.777 ) and 
      (bondedto (attr store1 < 128.582810435  and attr store1 > 127.382810435 ) or 
       bondedto (attr store1 < 33.1030631883  and attr store1 > 31.9030631883 ))) 
6 0.1 0.1 peak 2036 volume 9.3455 ppm1 1.827 ppm2 7.994
 
! ############### hot_mothernoesy_072403.2037 folded -
assi (attr store1 < 7.86 and attr store1 > 7.66 )
     ((attr store1 < 1.879 and attr store1 > 1.779 ) and 
      (bondedto (attr store1 < 128.561810435  and attr store1 > 127.361810435 ) or 
       bondedto (attr store1 < 33.0820631883  and attr store1 > 31.8820631883 ))) 
6 0.1 0.1 peak 2037 volume 4.2869 ppm1 1.829 ppm2 7.760
 
! ############### hot_mothernoesy_072403.2038 folded +
assi (attr store1 < 8.097 and attr store1 > 7.897 )
     ((attr store1 < 4.414 and attr store1 > 4.314 ) and 
      (bondedto (attr store1 < 104.567873623  and attr store1 > 103.367873623 ) or 
       bondedto (attr store1 < 56.828  and attr store1 > 55.628 ) or 
       bondedto (attr store1 < 9.0881263766  and attr store1 > 7.8881263766 ))) 
6 0.1 0.1 peak 2038 volume 11.18320 ppm1 4.364 ppm2 7.997
 
! ############### hot_mothernoesy_072403.2039 folded -
assi (attr store1 < 7.878 and attr store1 > 7.678 )
     ((attr store1 < 3.006 and attr store1 > 2.906 ) and 
      (bondedto (attr store1 < 128.403810435  and attr store1 > 127.203810435 ) or 
       bondedto (attr store1 < 32.9240631883  and attr store1 > 31.7240631883 ))) 
6 0.1 0.1 peak 2039 volume 5.6467 ppm1 2.956 ppm2 7.778
 
! ############### hot_mothernoesy_072403.2040 folded +
assi (attr store1 < 8.039 and attr store1 > 7.839 )
     ((attr store1 < 4.333 and attr store1 > 4.233 ) and 
      (bondedto (attr store1 < 104.250873623  and attr store1 > 103.050873623 ) or 
       bondedto (attr store1 < 56.511  and attr store1 > 55.311 ) or 
       bondedto (attr store1 < 8.7711263766  and attr store1 > 7.5711263766 ))) 
6 0.1 0.1 peak 2040 volume 9.07770 ppm1 4.283 ppm2 7.939
 
! ############### hot_mothernoesy_072403.2041 folded +
assi (attr store1 < 7.604 and attr store1 > 7.404 )
     ((attr store1 < 4.33 and attr store1 > 4.23 ) and 
      (bondedto (attr store1 < 104.277873623  and attr store1 > 103.077873623 ) or 
       bondedto (attr store1 < 56.538  and attr store1 > 55.338 ) or 
       bondedto (attr store1 < 8.7981263766  and attr store1 > 7.5981263766 ))) 
6 0.1 0.1 peak 2041 volume 7.36230 ppm1 4.280 ppm2 7.504
 
! ############### hot_mothernoesy_072403.2042 folded -
assi (attr store1 < 8.734 and attr store1 > 8.534 )
     ((attr store1 < 2.567 and attr store1 > 2.467 ) and 
      (bondedto (attr store1 < 128.077810435  and attr store1 > 126.877810435 ) or 
       bondedto (attr store1 < 32.5980631883  and attr store1 > 31.3980631883 ))) 
6 0.1 0.1 peak 2042 volume 6.1221 ppm1 2.517 ppm2 8.634
 
! ############### hot_mothernoesy_072403.2043 folded -
assi (attr store1 < 8.542 and attr store1 > 8.342 )
     ((attr store1 < 2.375 and attr store1 > 2.275 ) and 
      (bondedto (attr store1 < 128.116810435  and attr store1 > 126.916810435 ) or 
       bondedto (attr store1 < 32.6370631883  and attr store1 > 31.4370631883 ))) 
6 0.1 0.1 peak 2043 volume 4.9479 ppm1 2.325 ppm2 8.442
 
! ############### hot_mothernoesy_072403.2045 folded -
assi (attr store1 < 7.858 and attr store1 > 7.658 )
     ((attr store1 < 1.908 and attr store1 > 1.808 ) and 
      (bondedto (attr store1 < 128.132810435  and attr store1 > 126.932810435 ) or 
       bondedto (attr store1 < 32.6530631883  and attr store1 > 31.4530631883 ))) 
6 0.1 0.1 peak 2045 volume 3.9537 ppm1 1.858 ppm2 7.758
 
! ############### hot_mothernoesy_072403.2046 folded +
assi (attr store1 < 8.039 and attr store1 > 7.839 )
     ((attr store1 < 4.383 and attr store1 > 4.283 ) and 
      (bondedto (attr store1 < 104.150873623  and attr store1 > 102.950873623 ) or 
       bondedto (attr store1 < 56.411  and attr store1 > 55.211 ) or 
       bondedto (attr store1 < 8.6711263766  and attr store1 > 7.4711263766 ))) 
6 0.1 0.1 peak 2046 volume 12.80910 ppm1 4.333 ppm2 7.939
 
! ############### hot_mothernoesy_072403.2047 folded +
assi (attr store1 < 7.409 and attr store1 > 7.209 )
     ((attr store1 < 4.363 and attr store1 > 4.263 ) and 
      (bondedto (attr store1 < 104.120873623  and attr store1 > 102.920873623 ) or 
       bondedto (attr store1 < 56.381  and attr store1 > 55.181 ) or 
       bondedto (attr store1 < 8.6411263766  and attr store1 > 7.4411263766 ))) 
6 0.1 0.1 peak 2047 volume 8.46210 ppm1 4.313 ppm2 7.309
 
! ############### hot_mothernoesy_072403.2048 folded -
assi (attr store1 < 7.861 and attr store1 > 7.661 )
     ((attr store1 < 2.257 and attr store1 > 2.157 ) and 
      (bondedto (attr store1 < 128.008810435  and attr store1 > 126.808810435 ) or 
       bondedto (attr store1 < 32.5290631883  and attr store1 > 31.3290631883 ))) 
6 0.1 0.1 peak 2048 volume 5.037 ppm1 2.207 ppm2 7.761
 
! ############### hot_mothernoesy_072403.2049 folded +
assi (attr store1 < 8.162 and attr store1 > 7.962 )
     ((attr store1 < 4.379 and attr store1 > 4.279 ) and 
      (bondedto (attr store1 < 104.100873623  and attr store1 > 102.900873623 ) or 
       bondedto (attr store1 < 56.361  and attr store1 > 55.161 ) or 
       bondedto (attr store1 < 8.6211263766  and attr store1 > 7.4211263766 ))) 
6 0.1 0.1 peak 2049 volume 15.57520 ppm1 4.329 ppm2 8.062
 
! ############### hot_mothernoesy_072403.2050 folded -
assi (attr store1 < 9.02 and attr store1 > 8.82 )
     ((attr store1 < 2.518 and attr store1 > 2.418 ) and 
      (bondedto (attr store1 < 127.967810435  and attr store1 > 126.767810435 ) or 
       bondedto (attr store1 < 32.4880631883  and attr store1 > 31.2880631883 ))) 
6 0.1 0.1 peak 2050 volume 3.5357 ppm1 2.468 ppm2 8.920
 
! ############### hot_mothernoesy_072403.2051 folded +
assi (attr store1 < 8.461 and attr store1 > 8.261 )
     ((attr store1 < 4.105 and attr store1 > 4.005 ) and 
      (bondedto (attr store1 < 103.924873623  and attr store1 > 102.724873623 ) or 
       bondedto (attr store1 < 56.185  and attr store1 > 54.985 ) or 
       bondedto (attr store1 < 8.4451263766  and attr store1 > 7.2451263766 ))) 
6 0.1 0.1 peak 2051 volume 5.37960 ppm1 4.055 ppm2 8.361
 
! ############### hot_mothernoesy_072403.2054 folded +
assi (attr store1 < 8.318 and attr store1 > 8.118 )
     ((attr store1 < 4.36 and attr store1 > 4.26 ) and 
      (bondedto (attr store1 < 103.856873623  and attr store1 > 102.656873623 ) or 
       bondedto (attr store1 < 56.117  and attr store1 > 54.917 ) or 
       bondedto (attr store1 < 8.3771263766  and attr store1 > 7.1771263766 ))) 
6 0.1 0.1 peak 2054 volume 12.07050 ppm1 4.310 ppm2 8.218
 
! ############### hot_mothernoesy_072403.2055 folded +
assi (attr store1 < 8.292 and attr store1 > 8.092 )
     ((attr store1 < 4.103 and attr store1 > 4.003 ) and 
      (bondedto (attr store1 < 103.903873623  and attr store1 > 102.703873623 ) or 
       bondedto (attr store1 < 56.164  and attr store1 > 54.964 ) or 
       bondedto (attr store1 < 8.4241263766  and attr store1 > 7.2241263766 ))) 
6 0.1 0.1 peak 2055 volume 7.32020 ppm1 4.053 ppm2 8.192
 
! ############### hot_mothernoesy_072403.2056 folded -
assi (attr store1 < 7.859 and attr store1 > 7.659 )
     ((attr store1 < 2.358 and attr store1 > 2.258 ) and 
      (bondedto (attr store1 < 127.736810435  and attr store1 > 126.536810435 ) or 
       bondedto (attr store1 < 32.2570631883  and attr store1 > 31.0570631883 ))) 
6 0.1 0.1 peak 2056 volume 9.5623 ppm1 2.308 ppm2 7.759
 
! ############### hot_mothernoesy_072403.2057 folded -
assi (attr store1 < 8.038 and attr store1 > 7.838 )
     ((attr store1 < 2.353 and attr store1 > 2.253 ) and 
      (bondedto (attr store1 < 127.721810435  and attr store1 > 126.521810435 ) or 
       bondedto (attr store1 < 32.2420631883  and attr store1 > 31.0420631883 ))) 
6 0.1 0.1 peak 2057 volume 5.5872 ppm1 2.303 ppm2 7.938
 
! ############### hot_mothernoesy_072403.2058 folded +
assi (attr store1 < 8.566 and attr store1 > 8.366 )
     ((attr store1 < 2.972 and attr store1 > 2.872 ) and 
      (bondedto (attr store1 < 103.773873623  and attr store1 > 102.573873623 ) or 
       bondedto (attr store1 < 56.034  and attr store1 > 54.834 ) or 
       bondedto (attr store1 < 8.2941263766  and attr store1 > 7.0941263766 ))) 
6 0.1 0.1 peak 2058 volume 5.83800 ppm1 2.922 ppm2 8.466
 
! ############### hot_mothernoesy_072403.2059 folded +
assi (attr store1 < 7.474 and attr store1 > 7.274 )
     ((attr store1 < 2.968 and attr store1 > 2.868 ) and 
      (bondedto (attr store1 < 103.736873623  and attr store1 > 102.536873623 ) or 
       bondedto (attr store1 < 55.997  and attr store1 > 54.797 ) or 
       bondedto (attr store1 < 8.2571263766  and attr store1 > 7.0571263766 ))) 
6 0.1 0.1 peak 2059 volume 3.20160 ppm1 2.918 ppm2 7.374
 
! ############### hot_mothernoesy_072403.2060 folded +
assi (attr store1 < 7.414 and attr store1 > 7.214 )
     ((attr store1 < 2.974 and attr store1 > 2.874 ) and 
      (bondedto (attr store1 < 103.714873623  and attr store1 > 102.514873623 ) or 
       bondedto (attr store1 < 55.975  and attr store1 > 54.775 ) or 
       bondedto (attr store1 < 8.2351263766  and attr store1 > 7.0351263766 ))) 
6 0.1 0.1 peak 2060 volume 3.52290 ppm1 2.924 ppm2 7.314
 
! ############### hot_mothernoesy_072403.2061 folded -
assi (attr store1 < 8.502 and attr store1 > 8.302 )
     ((attr store1 < 2.33 and attr store1 > 2.23 ) and 
      (bondedto (attr store1 < 127.417810435  and attr store1 > 126.217810435 ) or 
       bondedto (attr store1 < 31.9380631883  and attr store1 > 30.7380631883 ))) 
6 0.1 0.1 peak 2061 volume 4.3726 ppm1 2.280 ppm2 8.402
 
! ############### hot_mothernoesy_072403.2062 folded +
assi (attr store1 < 7.989 and attr store1 > 7.789 )
     ((attr store1 < 4.024 and attr store1 > 3.924 ) and 
      (bondedto (attr store1 < 103.497873623  and attr store1 > 102.297873623 ) or 
       bondedto (attr store1 < 55.758  and attr store1 > 54.558 ) or 
       bondedto (attr store1 < 8.0181263766  and attr store1 > 6.8181263766 ))) 
6 0.1 0.1 peak 2062 volume 3.83420 ppm1 3.974 ppm2 7.889
 
! ############### hot_mothernoesy_072403.2063 folded -
assi (attr store1 < 7.648 and attr store1 > 7.448 )
     ((attr store1 < 2.121 and attr store1 > 2.021 ) and 
      (bondedto (attr store1 < 127.367810435  and attr store1 > 126.167810435 ) or 
       bondedto (attr store1 < 31.8880631883  and attr store1 > 30.6880631883 ))) 
6 0.1 0.1 peak 2063 volume 4.2632 ppm1 2.071 ppm2 7.548
 
! ############### hot_mothernoesy_072403.2064 folded -
assi (attr store1 < 8.564 and attr store1 > 8.364 )
     ((attr store1 < 2.116 and attr store1 > 2.016 ) and 
      (bondedto (attr store1 < 127.367810435  and attr store1 > 126.167810435 ) or 
       bondedto (attr store1 < 31.8880631883  and attr store1 > 30.6880631883 ))) 
6 0.1 0.1 peak 2064 volume 3.453 ppm1 2.066 ppm2 8.464
 
! ############### hot_mothernoesy_072403.2065 folded -
assi (attr store1 < -0.383 and attr store1 > -0.583 )
     ((attr store1 < 7.359 and attr store1 > 7.259 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 2065 volume 9.5022 ppm1 7.309 ppm2 -0.483
 
! ############### hot_mothernoesy_072403.2067 folded +
assi (attr store1 < 3.427 and attr store1 > 3.227 )
     ((attr store1 < 7.696 and attr store1 > 7.596 ) and 
      (bondedto (attr store1 < 121.632873623  and attr store1 > 120.432873623 ) or 
       bondedto (attr store1 < 73.893  and attr store1 > 72.693 ) or 
       bondedto (attr store1 < 26.1531263766  and attr store1 > 24.9531263766 ))) 
6 0.1 0.1 peak 2067 volume 3.99600 ppm1 7.646 ppm2 3.327
 
! ############### hot_mothernoesy_072403.2069 folded +
assi (attr store1 < 3.161 and attr store1 > 2.961 )
     ((attr store1 < 7.031 and attr store1 > 6.931 ) and 
      (bondedto (attr store1 < 119.174873623  and attr store1 > 117.974873623 ) or 
       bondedto (attr store1 < 71.435  and attr store1 > 70.235 ) or 
       bondedto (attr store1 < 23.6951263766  and attr store1 > 22.4951263766 ))) 
6 0.1 0.1 peak 2069 volume 3.07170 ppm1 6.981 ppm2 3.061
 
! ############### hot_mothernoesy_072403.2071 folded +
assi (attr store1 < 1.644 and attr store1 > 1.444 )
     ((attr store1 < 7.033 and attr store1 > 6.933 ) and 
      (bondedto (attr store1 < 119.148873623  and attr store1 > 117.948873623 ) or 
       bondedto (attr store1 < 71.409  and attr store1 > 70.209 ) or 
       bondedto (attr store1 < 23.6691263766  and attr store1 > 22.4691263766 ))) 
6 0.1 0.1 peak 2071 volume 6.09090 ppm1 6.983 ppm2 1.544
 
! ############### hot_mothernoesy_072403.2074 folded +
assi (attr store1 < 1.939 and attr store1 > 1.739 )
     ((attr store1 < 7.028 and attr store1 > 6.928 ) and 
      (bondedto (attr store1 < 119.063873623  and attr store1 > 117.863873623 ) or 
       bondedto (attr store1 < 71.324  and attr store1 > 70.124 ) or 
       bondedto (attr store1 < 23.5841263766  and attr store1 > 22.3841263766 ))) 
6 0.1 0.1 peak 2074 volume 3.16100 ppm1 6.978 ppm2 1.839
 
! ############### hot_mothernoesy_072403.2075 folded +
assi (attr store1 < 2.868 and attr store1 > 2.668 )
     ((attr store1 < 6.785 and attr store1 > 6.685 ) and 
      (bondedto (attr store1 < 118.959873623  and attr store1 > 117.759873623 ) or 
       bondedto (attr store1 < 71.22  and attr store1 > 70.02 ) or 
       bondedto (attr store1 < 23.4801263766  and attr store1 > 22.2801263766 ))) 
6 0.1 0.1 peak 2075 volume 3.04690 ppm1 6.735 ppm2 2.768
 
! ############### hot_mothernoesy_072403.2077 folded +
assi (attr store1 < 1.094 and attr store1 > 0.894 )
     ((attr store1 < 6.97 and attr store1 > 6.87 ) and 
      (bondedto (attr store1 < 118.516873623  and attr store1 > 117.316873623 ) or 
       bondedto (attr store1 < 70.777  and attr store1 > 69.577 ) or 
       bondedto (attr store1 < 23.0371263766  and attr store1 > 21.8371263766 ))) 
6 0.1 0.1 peak 2077 volume 5.33770 ppm1 6.920 ppm2 0.994
 
! ############### hot_mothernoesy_072403.2078 folded +
assi (attr store1 < 0.912 and attr store1 > 0.712 )
     ((attr store1 < 6.963 and attr store1 > 6.863 ) and 
      (bondedto (attr store1 < 118.546873623  and attr store1 > 117.346873623 ) or 
       bondedto (attr store1 < 70.807  and attr store1 > 69.607 ) or 
       bondedto (attr store1 < 23.0671263766  and attr store1 > 21.8671263766 ))) 
6 0.1 0.1 peak 2078 volume 3.15130 ppm1 6.913 ppm2 0.812
 
! ############### hot_mothernoesy_072403.2082 folded +
assi (attr store1 < 3.097 and attr store1 > 2.897 )
     ((attr store1 < 6.504 and attr store1 > 6.404 ) and 
      (bondedto (attr store1 < 117.824873623  and attr store1 > 116.624873623 ) or 
       bondedto (attr store1 < 70.085  and attr store1 > 68.885 ) or 
       bondedto (attr store1 < 22.3451263766  and attr store1 > 21.1451263766 ))) 
6 0.1 0.1 peak 2082 volume 3.02110 ppm1 6.454 ppm2 2.997
 
! ############### hot_mothernoesy_072403.2093 folded -
assi (attr store1 < -0.385 and attr store1 > -0.585 )
     ((attr store1 < 7.473 and attr store1 > 7.373 ) and 
      (bondedto (attr store1 < 139.348810435  and attr store1 > 138.148810435 ) or 
       bondedto (attr store1 < 43.8690631883  and attr store1 > 42.6690631883 ))) 
6 0.1 0.1 peak 2093 volume 4.3403 ppm1 7.423 ppm2 -0.485
 
! ############### hot_mothernoesy_072403.2096 folded -
assi (attr store1 < 4.538 and attr store1 > 4.338 )
     ((attr store1 < 6.994 and attr store1 > 6.894 ) and 
      (bondedto (attr store1 < 133.954810435  and attr store1 > 132.754810435 ) or 
       bondedto (attr store1 < 38.4750631883  and attr store1 > 37.2750631883 ))) 
6 0.1 0.1 peak 2096 volume 5.91 ppm1 6.944 ppm2 4.438
 
! ############### hot_mothernoesy_072403.2099 folded -
assi (attr store1 < 1.648 and attr store1 > 1.448 )
     ((attr store1 < 7.221 and attr store1 > 7.121 ) and 
      (bondedto (attr store1 < 133.923810435  and attr store1 > 132.723810435 ) or 
       bondedto (attr store1 < 38.4440631883  and attr store1 > 37.2440631883 ))) 
6 0.1 0.1 peak 2099 volume 5.8975 ppm1 7.171 ppm2 1.548
 
! ############### hot_mothernoesy_072403.2100 folded -
assi (attr store1 < 0.907 and attr store1 > 0.707 )
     ((attr store1 < 7.216 and attr store1 > 7.116 ) and 
      (bondedto (attr store1 < 133.930810435  and attr store1 > 132.730810435 ) or 
       bondedto (attr store1 < 38.4510631883  and attr store1 > 37.2510631883 ))) 
6 0.1 0.1 peak 2100 volume 3.3488 ppm1 7.166 ppm2 0.807
 
! ############### hot_mothernoesy_072403.2101 folded -
assi (attr store1 < 2.866 and attr store1 > 2.666 )
     ((attr store1 < 6.992 and attr store1 > 6.892 ) and 
      (bondedto (attr store1 < 133.938810435  and attr store1 > 132.738810435 ) or 
       bondedto (attr store1 < 38.4590631883  and attr store1 > 37.2590631883 ))) 
6 0.1 0.1 peak 2101 volume 12.1316 ppm1 6.942 ppm2 2.766
 
! ############### hot_mothernoesy_072403.2110 folded +
assi (attr store1 < 3.1 and attr store1 > 2.9 )
     ((attr store1 < 7.195 and attr store1 > 7.095 ) and 
      (bondedto (attr store1 < 109.237873623  and attr store1 > 108.037873623 ) or 
       bondedto (attr store1 < 61.498  and attr store1 > 60.298 ) or 
       bondedto (attr store1 < 13.7581263766  and attr store1 > 12.5581263766 ))) 
6 0.1 0.1 peak 2110 volume 3.95930 ppm1 7.145 ppm2 3.000
 
! ############### hot_mothernoesy_072403.2111 folded +
assi (attr store1 < 3.216 and attr store1 > 3.016 )
     ((attr store1 < 7.2 and attr store1 > 7.1 ) and 
      (bondedto (attr store1 < 109.199873623  and attr store1 > 107.999873623 ) or 
       bondedto (attr store1 < 61.46  and attr store1 > 60.26 ) or 
       bondedto (attr store1 < 13.7201263766  and attr store1 > 12.5201263766 ))) 
6 0.1 0.1 peak 2111 volume 3.61400 ppm1 7.150 ppm2 3.116
 
! ############### hot_mothernoesy_072403.2112 folded +
assi (attr store1 < 2.865 and attr store1 > 2.665 )
     ((attr store1 < 6.992 and attr store1 > 6.892 ) and 
      (bondedto (attr store1 < 109.126873623  and attr store1 > 107.926873623 ) or 
       bondedto (attr store1 < 61.387  and attr store1 > 60.187 ) or 
       bondedto (attr store1 < 13.6471263766  and attr store1 > 12.4471263766 ))) 
6 0.1 0.1 peak 2112 volume 6.24260 ppm1 6.942 ppm2 2.765
 
! ############### hot_mothernoesy_072403.2115 folded -
assi (attr store1 < 1.645 and attr store1 > 1.445 )
     ((attr store1 < 7.35 and attr store1 > 7.25 ) and 
      (bondedto (attr store1 < 132.700810435  and attr store1 > 131.500810435 ) or 
       bondedto (attr store1 < 37.2210631883  and attr store1 > 36.0210631883 ))) 
6 0.1 0.1 peak 2115 volume 3.0771 ppm1 7.300 ppm2 1.545
 
! ############### hot_mothernoesy_072403.2117 folded +
assi (attr store1 < -0.385 and attr store1 > -0.585 )
     ((attr store1 < 7.356 and attr store1 > 7.256 ) and 
      (bondedto (attr store1 < 104.405873623  and attr store1 > 103.205873623 ) or 
       bondedto (attr store1 < 56.666  and attr store1 > 55.466 ) or 
       bondedto (attr store1 < 8.9261263766  and attr store1 > 7.7261263766 ))) 
6 0.1 0.1 peak 2117 volume 11.37600 ppm1 7.306 ppm2 -0.485
 
! ############### hot_mothernoesy_072403.2118 folded -
assi (attr store1 < 3.4 and attr store1 > 3.2 )
     ((attr store1 < 7.354 and attr store1 > 7.254 ) and 
      (bondedto (attr store1 < 128.211810435  and attr store1 > 127.011810435 ) or 
       bondedto (attr store1 < 32.7320631883  and attr store1 > 31.5320631883 ))) 
6 0.1 0.1 peak 2118 volume 5.4201 ppm1 7.304 ppm2 3.300
 
! ############### hot_mothernoesy_072403.2119 folded +
assi (attr store1 < -0.385 and attr store1 > -0.585 )
     ((attr store1 < 7.356 and attr store1 > 7.256 ) and 
      (bondedto (attr store1 < 103.930873623  and attr store1 > 102.730873623 ) or 
       bondedto (attr store1 < 56.191  and attr store1 > 54.991 ) or 
       bondedto (attr store1 < 8.4511263766  and attr store1 > 7.2511263766 ))) 
6 0.1 0.1 peak 2119 volume 3.47310 ppm1 7.306 ppm2 -0.485
 
! ############### hot_mothernoesy_072403.2121 folded +
assi (attr store1 < 3.449 and attr store1 > 3.249 )
     ((attr store1 < 7.359 and attr store1 > 7.259 ) and 
      (bondedto (attr store1 < 103.497873623  and attr store1 > 102.297873623 ) or 
       bondedto (attr store1 < 55.758  and attr store1 > 54.558 ) or 
       bondedto (attr store1 < 8.0181263766  and attr store1 > 6.8181263766 ))) 
6 0.1 0.1 peak 2121 volume 3.58820 ppm1 7.309 ppm2 3.349
 
! ############### hot_mothernoesy_072403.2122 folded +
assi (attr store1 < 3.388 and attr store1 > 3.188 )
     ((attr store1 < 7.36 and attr store1 > 7.26 ) and 
      (bondedto (attr store1 < 103.497873623  and attr store1 > 102.297873623 ) or 
       bondedto (attr store1 < 55.758  and attr store1 > 54.558 ) or 
       bondedto (attr store1 < 8.0181263766  and attr store1 > 6.8181263766 ))) 
6 0.1 0.1 peak 2122 volume 4.10250 ppm1 7.310 ppm2 3.288
 
! ############### hot_mothernoesy_072403.2123 folded -
assi (attr store1 < -0.387 and attr store1 > -0.587 )
     ((attr store1 < 7.356 and attr store1 > 7.256 ) and 
      (bondedto (attr store1 < 127.367810435  and attr store1 > 126.167810435 ) or 
       bondedto (attr store1 < 31.8880631883  and attr store1 > 30.6880631883 ))) 
6 0.1 0.1 peak 2123 volume 9.5022 ppm1 7.306 ppm2 -0.487
 
! ############### hot_mothernoesy_072403.2124 folded -
assi (attr store1 < 7.52 and attr store1 > 7.32 )
     ((attr store1 < 7.47 and attr store1 > 7.37 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 2124 volume 4.6074 ppm1 7.420 ppm2 7.420
 
! ############### hot_mothernoesy_072403.2131 folded +
assi (attr store1 < 7.245 and attr store1 > 7.045 )
     ((attr store1 < 6.897 and attr store1 > 6.797 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 2131 volume 3.82510 ppm1 6.847 ppm2 7.145
 
! ############### hot_mothernoesy_072403.2132 folded +
assi (attr store1 < 6.946 and attr store1 > 6.746 )
     ((attr store1 < 6.896 and attr store1 > 6.796 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 2132 volume 10.07580 ppm1 6.846 ppm2 6.846
 
! ############### hot_mothernoesy_072403.2134 folded +
assi (attr store1 < 6.833 and attr store1 > 6.633 )
     ((attr store1 < 6.784 and attr store1 > 6.684 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 2134 volume 4.75940 ppm1 6.734 ppm2 6.733
 
! ############### hot_mothernoesy_072403.2136 folded +
assi (attr store1 < 7.404 and attr store1 > 7.204 )
     ((attr store1 < 7.354 and attr store1 > 7.254 ) and 
      (bondedto (attr store1 < 127.274873623  and attr store1 > 126.074873623 ) or 
       bondedto (attr store1 < 79.535  and attr store1 > 78.335 ) or 
       bondedto (attr store1 < 31.7951263766  and attr store1 > 30.5951263766 ))) 
6 0.1 0.1 peak 2136 volume 200.14980 ppm1 7.304 ppm2 7.304
 
! ############### hot_mothernoesy_072403.2139 folded -
assi (attr store1 < 6.943 and attr store1 > 6.743 )
     ((attr store1 < 6.895 and attr store1 > 6.795 ) and 
      (bondedto (attr store1 < 149.593810435  and attr store1 > 148.393810435 ) or 
       bondedto (attr store1 < 54.1140631883  and attr store1 > 52.9140631883 ))) 
6 0.1 0.1 peak 2139 volume 13.3479 ppm1 6.845 ppm2 6.843
 
! ############### hot_mothernoesy_072403.2140 folded -
assi (attr store1 < 6.832 and attr store1 > 6.632 )
     ((attr store1 < 6.781 and attr store1 > 6.681 ) and 
      (bondedto (attr store1 < 149.597810435  and attr store1 > 148.397810435 ) or 
       bondedto (attr store1 < 54.1180631883  and attr store1 > 52.9180631883 ))) 
6 0.1 0.1 peak 2140 volume 9.2901 ppm1 6.731 ppm2 6.732
 
! ############### hot_mothernoesy_072403.2141 folded +
assi (attr store1 < 7.522 and attr store1 > 7.322 )
     ((attr store1 < 7.233 and attr store1 > 7.133 ) and 
      (bondedto (attr store1 < 125.501873623  and attr store1 > 124.301873623 ) or 
       bondedto (attr store1 < 77.762  and attr store1 > 76.562 ) or 
       bondedto (attr store1 < 30.0221263766  and attr store1 > 28.8221263766 ))) 
6 0.1 0.1 peak 2141 volume 35.77300 ppm1 7.183 ppm2 7.422
 
! ############### hot_mothernoesy_072403.2142 folded +
assi (attr store1 < 7.284 and attr store1 > 7.084 )
     ((attr store1 < 7.233 and attr store1 > 7.133 ) and 
      (bondedto (attr store1 < 125.485873623  and attr store1 > 124.285873623 ) or 
       bondedto (attr store1 < 77.746  and attr store1 > 76.546 ) or 
       bondedto (attr store1 < 30.0061263766  and attr store1 > 28.8061263766 ))) 
6 0.1 0.1 peak 2142 volume 210.18719 ppm1 7.183 ppm2 7.184
 
! ############### hot_mothernoesy_072403.2143 folded +
assi (attr store1 < 7.253 and attr store1 > 7.053 )
     ((attr store1 < 7.205 and attr store1 > 7.105 ) and 
      (bondedto (attr store1 < 122.812873623  and attr store1 > 121.612873623 ) or 
       bondedto (attr store1 < 75.073  and attr store1 > 73.873 ) or 
       bondedto (attr store1 < 27.3331263766  and attr store1 > 26.1331263766 ))) 
6 0.1 0.1 peak 2143 volume 137.08060 ppm1 7.155 ppm2 7.153
 
! ############### hot_mothernoesy_072403.2144 folded -
assi (attr store1 < 7.259 and attr store1 > 7.059 )
     ((attr store1 < 7.696 and attr store1 > 7.596 ) and 
      (bondedto (attr store1 < 146.692810435  and attr store1 > 145.492810435 ) or 
       bondedto (attr store1 < 51.2130631883  and attr store1 > 50.0130631883 ))) 
6 0.1 0.1 peak 2144 volume 36.8746 ppm1 7.646 ppm2 7.159
 
! ############### hot_mothernoesy_072403.2145 folded -
assi (attr store1 < 7.749 and attr store1 > 7.549 )
     ((attr store1 < 7.208 and attr store1 > 7.108 ) and 
      (bondedto (attr store1 < 146.682810435  and attr store1 > 145.482810435 ) or 
       bondedto (attr store1 < 51.2030631883  and attr store1 > 50.0030631883 ))) 
6 0.1 0.1 peak 2145 volume 33.4897 ppm1 7.158 ppm2 7.649
 
! ############### hot_mothernoesy_072403.2146 folded +
assi (attr store1 < 7.26 and attr store1 > 7.06 )
     ((attr store1 < 7.697 and attr store1 > 7.597 ) and 
      (bondedto (attr store1 < 122.169873623  and attr store1 > 120.969873623 ) or 
       bondedto (attr store1 < 74.43  and attr store1 > 73.23 ) or 
       bondedto (attr store1 < 26.6901263766  and attr store1 > 25.4901263766 ))) 
6 0.1 0.1 peak 2146 volume 24.39960 ppm1 7.647 ppm2 7.160
 
! ############### hot_mothernoesy_072403.2147 folded +
assi (attr store1 < 7.748 and attr store1 > 7.548 )
     ((attr store1 < 7.206 and attr store1 > 7.106 ) and 
      (bondedto (attr store1 < 122.153873623  and attr store1 > 120.953873623 ) or 
       bondedto (attr store1 < 74.414  and attr store1 > 73.214 ) or 
       bondedto (attr store1 < 26.6741263766  and attr store1 > 25.4741263766 ))) 
6 0.1 0.1 peak 2147 volume 19.12550 ppm1 7.156 ppm2 7.648
 
! ############### hot_mothernoesy_072403.2148 folded -
assi (attr store1 < 7.268 and attr store1 > 7.068 )
     ((attr store1 < 7.209 and attr store1 > 7.109 ) and 
      (bondedto (attr store1 < 145.885810435  and attr store1 > 144.685810435 ) or 
       bondedto (attr store1 < 50.4060631883  and attr store1 > 49.2060631883 ))) 
6 0.1 0.1 peak 2148 volume 51.8028 ppm1 7.159 ppm2 7.168
 
! ############### hot_mothernoesy_072403.2149 folded -
assi (attr store1 < 7.749 and attr store1 > 7.549 )
     ((attr store1 < 7.204 and attr store1 > 7.104 ) and 
      (bondedto (attr store1 < 145.532810435  and attr store1 > 144.332810435 ) or 
       bondedto (attr store1 < 50.0530631883  and attr store1 > 48.8530631883 ))) 
6 0.1 0.1 peak 2149 volume 33.3122 ppm1 7.154 ppm2 7.649
 
! ############### hot_mothernoesy_072403.2150 folded +
assi (attr store1 < 7.748 and attr store1 > 7.548 )
     ((attr store1 < 7.697 and attr store1 > 7.597 ) and 
      (bondedto (attr store1 < 121.621873623  and attr store1 > 120.421873623 ) or 
       bondedto (attr store1 < 73.882  and attr store1 > 72.682 ) or 
       bondedto (attr store1 < 26.1421263766  and attr store1 > 24.9421263766 ))) 
6 0.1 0.1 peak 2150 volume 173.42470 ppm1 7.647 ppm2 7.648
 
! ############### hot_mothernoesy_072403.2151 folded -
assi (attr store1 < 7.256 and attr store1 > 7.056 )
     ((attr store1 < 7.696 and attr store1 > 7.596 ) and 
      (bondedto (attr store1 < 145.463810435  and attr store1 > 144.263810435 ) or 
       bondedto (attr store1 < 49.9840631883  and attr store1 > 48.7840631883 ))) 
6 0.1 0.1 peak 2151 volume 23.2374 ppm1 7.646 ppm2 7.156
 
! ############### hot_mothernoesy_072403.2152 folded +
assi (attr store1 < 7.256 and attr store1 > 7.056 )
     ((attr store1 < 7.694 and attr store1 > 7.594 ) and 
      (bondedto (attr store1 < 120.937873623  and attr store1 > 119.737873623 ) or 
       bondedto (attr store1 < 73.198  and attr store1 > 71.998 ) or 
       bondedto (attr store1 < 25.4581263766  and attr store1 > 24.2581263766 ))) 
6 0.1 0.1 peak 2152 volume 12.08680 ppm1 7.644 ppm2 7.156
 
! ############### hot_mothernoesy_072403.2153 folded +
assi (attr store1 < 7.749 and attr store1 > 7.549 )
     ((attr store1 < 7.203 and attr store1 > 7.103 ) and 
      (bondedto (attr store1 < 120.935873623  and attr store1 > 119.735873623 ) or 
       bondedto (attr store1 < 73.196  and attr store1 > 71.996 ) or 
       bondedto (attr store1 < 25.4561263766  and attr store1 > 24.2561263766 ))) 
6 0.1 0.1 peak 2153 volume 18.05910 ppm1 7.153 ppm2 7.649
 
! ############### hot_mothernoesy_072403.2154 folded +
assi (attr store1 < 6.785 and attr store1 > 6.585 )
     ((attr store1 < 6.734 and attr store1 > 6.634 ) and 
      (bondedto (attr store1 < 119.237873623  and attr store1 > 118.037873623 ) or 
       bondedto (attr store1 < 71.498  and attr store1 > 70.298 ) or 
       bondedto (attr store1 < 23.7581263766  and attr store1 > 22.5581263766 ))) 
6 0.1 0.1 peak 2154 volume 120.44340 ppm1 6.684 ppm2 6.685
 
! ############### hot_mothernoesy_072403.2156 folded +
assi (attr store1 < 7.081 and attr store1 > 6.881 )
     ((attr store1 < 7.029 and attr store1 > 6.929 ) and 
      (bondedto (attr store1 < 119.138873623  and attr store1 > 117.938873623 ) or 
       bondedto (attr store1 < 71.399  and attr store1 > 70.199 ) or 
       bondedto (attr store1 < 23.6591263766  and attr store1 > 22.4591263766 ))) 
6 0.1 0.1 peak 2156 volume 42.47000 ppm1 6.979 ppm2 6.981
 
! ############### hot_mothernoesy_072403.2157 folded +
assi (attr store1 < 7.082 and attr store1 > 6.882 )
     ((attr store1 < 6.896 and attr store1 > 6.796 ) and 
      (bondedto (attr store1 < 119.121873623  and attr store1 > 117.921873623 ) or 
       bondedto (attr store1 < 71.382  and attr store1 > 70.182 ) or 
       bondedto (attr store1 < 23.6421263766  and attr store1 > 22.4421263766 ))) 
6 0.1 0.1 peak 2157 volume 7.38780 ppm1 6.846 ppm2 6.982
 
! ############### hot_mothernoesy_072403.2158 folded +
assi (attr store1 < 7.039 and attr store1 > 6.839 )
     ((attr store1 < 6.896 and attr store1 > 6.796 ) and 
      (bondedto (attr store1 < 119.154873623  and attr store1 > 117.954873623 ) or 
       bondedto (attr store1 < 71.415  and attr store1 > 70.215 ) or 
       bondedto (attr store1 < 23.6751263766  and attr store1 > 22.4751263766 ))) 
6 0.1 0.1 peak 2158 volume 15.62160 ppm1 6.846 ppm2 6.939
 
! ############### hot_mothernoesy_072403.2159 folded +
assi (attr store1 < 6.945 and attr store1 > 6.745 )
     ((attr store1 < 6.895 and attr store1 > 6.795 ) and 
      (bondedto (attr store1 < 119.123873623  and attr store1 > 117.923873623 ) or 
       bondedto (attr store1 < 71.384  and attr store1 > 70.184 ) or 
       bondedto (attr store1 < 23.6441263766  and attr store1 > 22.4441263766 ))) 
6 0.1 0.1 peak 2159 volume 1191.43750 ppm1 6.845 ppm2 6.845
 
! ############### hot_mothernoesy_072403.2160 folded +
assi (attr store1 < 6.931 and attr store1 > 6.731 )
     ((attr store1 < 6.734 and attr store1 > 6.634 ) and 
      (bondedto (attr store1 < 119.139873623  and attr store1 > 117.939873623 ) or 
       bondedto (attr store1 < 71.4  and attr store1 > 70.2 ) or 
       bondedto (attr store1 < 23.6601263766  and attr store1 > 22.4601263766 ))) 
6 0.1 0.1 peak 2160 volume 12.91460 ppm1 6.684 ppm2 6.831
 
! ############### hot_mothernoesy_072403.2161 folded +
assi (attr store1 < 7.331 and attr store1 > 7.131 )
     ((attr store1 < 6.894 and attr store1 > 6.794 ) and 
      (bondedto (attr store1 < 119.048873623  and attr store1 > 117.848873623 ) or 
       bondedto (attr store1 < 71.309  and attr store1 > 70.109 ) or 
       bondedto (attr store1 < 23.5691263766  and attr store1 > 22.3691263766 ))) 
6 0.1 0.1 peak 2161 volume 3.30330 ppm1 6.844 ppm2 7.231
 
! ############### hot_mothernoesy_072403.2162 folded +
assi (attr store1 < 7.244 and attr store1 > 7.044 )
     ((attr store1 < 6.895 and attr store1 > 6.795 ) and 
      (bondedto (attr store1 < 119.102873623  and attr store1 > 117.902873623 ) or 
       bondedto (attr store1 < 71.363  and attr store1 > 70.163 ) or 
       bondedto (attr store1 < 23.6231263766  and attr store1 > 22.4231263766 ))) 
6 0.1 0.1 peak 2162 volume 171.57381 ppm1 6.845 ppm2 7.144
 
! ############### hot_mothernoesy_072403.2163 folded +
assi (attr store1 < 7.043 and attr store1 > 6.843 )
     ((attr store1 < 6.783 and attr store1 > 6.683 ) and 
      (bondedto (attr store1 < 118.998873623  and attr store1 > 117.798873623 ) or 
       bondedto (attr store1 < 71.259  and attr store1 > 70.059 ) or 
       bondedto (attr store1 < 23.5191263766  and attr store1 > 22.3191263766 ))) 
6 0.1 0.1 peak 2163 volume 105.49460 ppm1 6.733 ppm2 6.943
 
! ############### hot_mothernoesy_072403.2164 folded +
assi (attr store1 < 6.833 and attr store1 > 6.633 )
     ((attr store1 < 6.783 and attr store1 > 6.683 ) and 
      (bondedto (attr store1 < 119.006873623  and attr store1 > 117.806873623 ) or 
       bondedto (attr store1 < 71.267  and attr store1 > 70.067 ) or 
       bondedto (attr store1 < 23.5271263766  and attr store1 > 22.3271263766 ))) 
6 0.1 0.1 peak 2164 volume 917.96448 ppm1 6.733 ppm2 6.733
 
! ############### hot_mothernoesy_072403.2165 folded +
assi (attr store1 < 7.03 and attr store1 > 6.83 )
     ((attr store1 < 6.973 and attr store1 > 6.873 ) and 
      (bondedto (attr store1 < 118.333873623  and attr store1 > 117.133873623 ) or 
       bondedto (attr store1 < 70.594  and attr store1 > 69.394 ) or 
       bondedto (attr store1 < 22.8541263766  and attr store1 > 21.6541263766 ))) 
6 0.1 0.1 peak 2165 volume 16.67730 ppm1 6.923 ppm2 6.930
 
! ############### hot_mothernoesy_072403.2166 folded -
assi (attr store1 < 7.244 and attr store1 > 7.044 )
     ((attr store1 < 6.895 and attr store1 > 6.795 ) and 
      (bondedto (attr store1 < 142.209810435  and attr store1 > 141.009810435 ) or 
       bondedto (attr store1 < 46.7300631883  and attr store1 > 45.5300631883 ))) 
6 0.1 0.1 peak 2166 volume 58.9314 ppm1 6.845 ppm2 7.144
 
! ############### hot_mothernoesy_072403.2167 folded -
assi (attr store1 < 6.945 and attr store1 > 6.745 )
     ((attr store1 < 6.895 and attr store1 > 6.795 ) and 
      (bondedto (attr store1 < 142.202810435  and attr store1 > 141.002810435 ) or 
       bondedto (attr store1 < 46.7230631883  and attr store1 > 45.5230631883 ))) 
6 0.1 0.1 peak 2167 volume 455.87009 ppm1 6.845 ppm2 6.845
 
! ############### hot_mothernoesy_072403.2168 folded -
assi (attr store1 < 7.044 and attr store1 > 6.844 )
     ((attr store1 < 6.784 and attr store1 > 6.684 ) and 
      (bondedto (attr store1 < 142.090810435  and attr store1 > 140.890810435 ) or 
       bondedto (attr store1 < 46.6110631883  and attr store1 > 45.4110631883 ))) 
6 0.1 0.1 peak 2168 volume 28.3973 ppm1 6.734 ppm2 6.944
 
! ############### hot_mothernoesy_072403.2169 folded -
assi (attr store1 < 6.833 and attr store1 > 6.633 )
     ((attr store1 < 6.784 and attr store1 > 6.684 ) and 
      (bondedto (attr store1 < 142.088810435  and attr store1 > 140.888810435 ) or 
       bondedto (attr store1 < 46.6090631883  and attr store1 > 45.4090631883 ))) 
6 0.1 0.1 peak 2169 volume 358.76199 ppm1 6.734 ppm2 6.733
 
! ############### hot_mothernoesy_072403.2171 folded +
assi (attr store1 < 6.555 and attr store1 > 6.355 )
     ((attr store1 < 6.506 and attr store1 > 6.406 ) and 
      (bondedto (attr store1 < 117.837873623  and attr store1 > 116.637873623 ) or 
       bondedto (attr store1 < 70.098  and attr store1 > 68.898 ) or 
       bondedto (attr store1 < 22.3581263766  and attr store1 > 21.1581263766 ))) 
6 0.1 0.1 peak 2171 volume 63.96910 ppm1 6.456 ppm2 6.455
 
! ############### hot_mothernoesy_072403.2172 folded -
assi (attr store1 < 7.003 and attr store1 > 6.803 )
     ((attr store1 < 6.962 and attr store1 > 6.862 ) and 
      (bondedto (attr store1 < 141.523810435  and attr store1 > 140.323810435 ) or 
       bondedto (attr store1 < 46.0440631883  and attr store1 > 44.8440631883 ))) 
6 0.1 0.1 peak 2172 volume 7.1131 ppm1 6.912 ppm2 6.903
 
! ############### hot_mothernoesy_072403.2173 folded -
assi (attr store1 < 6.896 and attr store1 > 6.696 )
     ((attr store1 < 6.506 and attr store1 > 6.406 ) and 
      (bondedto (attr store1 < 140.834810435  and attr store1 > 139.634810435 ) or 
       bondedto (attr store1 < 45.3550631883  and attr store1 > 44.1550631883 ))) 
6 0.1 0.1 peak 2173 volume 6.3722 ppm1 6.456 ppm2 6.796
 
! ############### hot_mothernoesy_072403.2174 folded -
assi (attr store1 < 7.902 and attr store1 > 7.702 )
     ((attr store1 < 7.858 and attr store1 > 7.758 ) and 
      (bondedto (attr store1 < 139.430810435  and attr store1 > 138.230810435 ) or 
       bondedto (attr store1 < 43.9510631883  and attr store1 > 42.7510631883 ))) 
6 0.1 0.1 peak 2174 volume 22.8795 ppm1 7.808 ppm2 7.802
 
! ############### hot_mothernoesy_072403.2175 folded +
assi (attr store1 < 7.606 and attr store1 > 7.406 )
     ((attr store1 < 7.558 and attr store1 > 7.458 ) and 
      (bondedto (attr store1 < 115.450873623  and attr store1 > 114.250873623 ) or 
       bondedto (attr store1 < 67.711  and attr store1 > 66.511 ) or 
       bondedto (attr store1 < 19.9711263766  and attr store1 > 18.7711263766 ))) 
6 0.1 0.1 peak 2175 volume 30.00600 ppm1 7.508 ppm2 7.506
 
! ############### hot_mothernoesy_072403.2176 folded +
assi (attr store1 < 7.343 and attr store1 > 7.143 )
     ((attr store1 < 7.558 and attr store1 > 7.458 ) and 
      (bondedto (attr store1 < 115.450873623  and attr store1 > 114.250873623 ) or 
       bondedto (attr store1 < 67.711  and attr store1 > 66.511 ) or 
       bondedto (attr store1 < 19.9711263766  and attr store1 > 18.7711263766 ))) 
6 0.1 0.1 peak 2176 volume 4.45780 ppm1 7.508 ppm2 7.243
 
! ############### hot_mothernoesy_072403.2177 folded +
assi (attr store1 < 7.284 and attr store1 > 7.084 )
     ((attr store1 < 7.473 and attr store1 > 7.373 ) and 
      (bondedto (attr store1 < 115.475873623  and attr store1 > 114.275873623 ) or 
       bondedto (attr store1 < 67.736  and attr store1 > 66.536 ) or 
       bondedto (attr store1 < 19.9961263766  and attr store1 > 18.7961263766 ))) 
6 0.1 0.1 peak 2177 volume 39.78710 ppm1 7.423 ppm2 7.184
 
! ############### hot_mothernoesy_072403.2178 folded +
assi (attr store1 < 7.522 and attr store1 > 7.322 )
     ((attr store1 < 7.472 and attr store1 > 7.372 ) and 
      (bondedto (attr store1 < 115.430873623  and attr store1 > 114.230873623 ) or 
       bondedto (attr store1 < 67.691  and attr store1 > 66.491 ) or 
       bondedto (attr store1 < 19.9511263766  and attr store1 > 18.7511263766 ))) 
6 0.1 0.1 peak 2178 volume 269.66949 ppm1 7.422 ppm2 7.422
 
! ############### hot_mothernoesy_072403.2179 folded +
assi (attr store1 < 7.901 and attr store1 > 7.701 )
     ((attr store1 < 7.865 and attr store1 > 7.765 ) and 
      (bondedto (attr store1 < 115.107873623  and attr store1 > 113.907873623 ) or 
       bondedto (attr store1 < 67.368  and attr store1 > 66.168 ) or 
       bondedto (attr store1 < 19.6281263766  and attr store1 > 18.4281263766 ))) 
6 0.1 0.1 peak 2179 volume 12.14340 ppm1 7.815 ppm2 7.801
 
! ############### hot_mothernoesy_072403.2180 folded -
assi (attr store1 < 7.522 and attr store1 > 7.322 )
     ((attr store1 < 7.473 and attr store1 > 7.373 ) and 
      (bondedto (attr store1 < 138.370810435  and attr store1 > 137.170810435 ) or 
       bondedto (attr store1 < 42.8910631883  and attr store1 > 41.6910631883 ))) 
6 0.1 0.1 peak 2180 volume 98.1475 ppm1 7.423 ppm2 7.422
 
! ############### hot_mothernoesy_072403.2181 folded -
assi (attr store1 < 7.28 and attr store1 > 7.08 )
     ((attr store1 < 7.473 and attr store1 > 7.373 ) and 
      (bondedto (attr store1 < 138.360810435  and attr store1 > 137.160810435 ) or 
       bondedto (attr store1 < 42.8810631883  and attr store1 > 41.6810631883 ))) 
6 0.1 0.1 peak 2181 volume 13.8208 ppm1 7.423 ppm2 7.180
 
! ############### hot_mothernoesy_072403.2182 folded -
assi (attr store1 < 7.246 and attr store1 > 7.046 )
     ((attr store1 < 7.194 and attr store1 > 7.094 ) and 
      (bondedto (attr store1 < 136.510810435  and attr store1 > 135.310810435 ) or 
       bondedto (attr store1 < 41.0310631883  and attr store1 > 39.8310631883 ))) 
6 0.1 0.1 peak 2182 volume 63.3587 ppm1 7.144 ppm2 7.146
 
! ############### hot_mothernoesy_072403.2183 folded -
assi (attr store1 < 6.947 and attr store1 > 6.747 )
     ((attr store1 < 7.194 and attr store1 > 7.094 ) and 
      (bondedto (attr store1 < 136.535810435  and attr store1 > 135.335810435 ) or 
       bondedto (attr store1 < 41.0560631883  and attr store1 > 39.8560631883 ))) 
6 0.1 0.1 peak 2183 volume 6.6346 ppm1 7.144 ppm2 6.847
 
! ############### hot_mothernoesy_072403.2184 folded -
assi (attr store1 < 7.046 and attr store1 > 6.846 )
     ((attr store1 < 6.992 and attr store1 > 6.892 ) and 
      (bondedto (attr store1 < 136.525810435  and attr store1 > 135.325810435 ) or 
       bondedto (attr store1 < 41.0460631883  and attr store1 > 39.8460631883 ))) 
6 0.1 0.1 peak 2184 volume 33.2897 ppm1 6.942 ppm2 6.946
 
! ############### hot_mothernoesy_072403.2185 folded -
assi (attr store1 < 6.926 and attr store1 > 6.726 )
     ((attr store1 < 6.876 and attr store1 > 6.776 ) and 
      (bondedto (attr store1 < 134.117810435  and attr store1 > 132.917810435 ) or 
       bondedto (attr store1 < 38.6380631883  and attr store1 > 37.4380631883 ))) 
6 0.1 0.1 peak 2185 volume 56.2617 ppm1 6.826 ppm2 6.826
 
! ############### hot_mothernoesy_072403.2186 folded -
assi (attr store1 < 7.099 and attr store1 > 6.899 )
     ((attr store1 < 7.206 and attr store1 > 7.106 ) and 
      (bondedto (attr store1 < 133.944810435  and attr store1 > 132.744810435 ) or 
       bondedto (attr store1 < 38.4650631883  and attr store1 > 37.2650631883 ))) 
6 0.1 0.1 peak 2186 volume 10.1372 ppm1 7.156 ppm2 6.999
 
! ############### hot_mothernoesy_072403.2187 folded -
assi (attr store1 < 7.246 and attr store1 > 7.046 )
     ((attr store1 < 7.195 and attr store1 > 7.095 ) and 
      (bondedto (attr store1 < 134.029810435  and attr store1 > 132.829810435 ) or 
       bondedto (attr store1 < 38.5500631883  and attr store1 > 37.3500631883 ))) 
6 0.1 0.1 peak 2187 volume 580.73639 ppm1 7.145 ppm2 7.146
 
! ############### hot_mothernoesy_072403.2189 folded -
assi (attr store1 < 7.245 and attr store1 > 7.045 )
     ((attr store1 < 7.052 and attr store1 > 6.952 ) and 
      (bondedto (attr store1 < 133.980810435  and attr store1 > 132.780810435 ) or 
       bondedto (attr store1 < 38.5010631883  and attr store1 > 37.3010631883 ))) 
6 0.1 0.1 peak 2189 volume 10.4245 ppm1 7.002 ppm2 7.145
 
! ############### hot_mothernoesy_072403.2190 folded -
assi (attr store1 < 7.042 and attr store1 > 6.842 )
     ((attr store1 < 6.992 and attr store1 > 6.892 ) and 
      (bondedto (attr store1 < 133.924810435  and attr store1 > 132.724810435 ) or 
       bondedto (attr store1 < 38.4450631883  and attr store1 > 37.2450631883 ))) 
6 0.1 0.1 peak 2190 volume 430.9201 ppm1 6.942 ppm2 6.942
 
! ############### hot_mothernoesy_072403.2191 folded -
assi (attr store1 < 6.833 and attr store1 > 6.633 )
     ((attr store1 < 6.992 and attr store1 > 6.892 ) and 
      (bondedto (attr store1 < 133.887810435  and attr store1 > 132.687810435 ) or 
       bondedto (attr store1 < 38.4080631883  and attr store1 > 37.2080631883 ))) 
6 0.1 0.1 peak 2191 volume 46.1211 ppm1 6.942 ppm2 6.733
 
! ############### hot_mothernoesy_072403.2192 folded -
assi (attr store1 < 6.959 and attr store1 > 6.759 )
     ((attr store1 < 6.987 and attr store1 > 6.887 ) and 
      (bondedto (attr store1 < 133.916810435  and attr store1 > 132.716810435 ) or 
       bondedto (attr store1 < 38.4370631883  and attr store1 > 37.2370631883 ))) 
6 0.1 0.1 peak 2192 volume 9.5541 ppm1 6.937 ppm2 6.859
 
! ############### hot_mothernoesy_072403.2193 folded -
assi (attr store1 < 6.893 and attr store1 > 6.693 )
     ((attr store1 < 6.847 and attr store1 > 6.747 ) and 
      (bondedto (attr store1 < 133.488810435  and attr store1 > 132.288810435 ) or 
       bondedto (attr store1 < 38.0090631883  and attr store1 > 36.8090631883 ))) 
6 0.1 0.1 peak 2193 volume 26.1957 ppm1 6.797 ppm2 6.793
 
! ############### hot_mothernoesy_072403.2196 folded +
assi (attr store1 < 7.246 and attr store1 > 7.046 )
     ((attr store1 < 7.196 and attr store1 > 7.096 ) and 
      (bondedto (attr store1 < 109.233873623  and attr store1 > 108.033873623 ) or 
       bondedto (attr store1 < 61.494  and attr store1 > 60.294 ) or 
       bondedto (attr store1 < 13.7541263766  and attr store1 > 12.5541263766 ))) 
6 0.1 0.1 peak 2196 volume 254.65021 ppm1 7.146 ppm2 7.146
 
! ############### hot_mothernoesy_072403.2197 folded +
assi (attr store1 < 6.948 and attr store1 > 6.748 )
     ((attr store1 < 7.196 and attr store1 > 7.096 ) and 
      (bondedto (attr store1 < 109.271873623  and attr store1 > 108.071873623 ) or 
       bondedto (attr store1 < 61.532  and attr store1 > 60.332 ) or 
       bondedto (attr store1 < 13.7921263766  and attr store1 > 12.5921263766 ))) 
6 0.1 0.1 peak 2197 volume 33.44160 ppm1 7.146 ppm2 6.848
 
! ############### hot_mothernoesy_072403.2198 folded +
assi (attr store1 < 6.832 and attr store1 > 6.632 )
     ((attr store1 < 6.992 and attr store1 > 6.892 ) and 
      (bondedto (attr store1 < 109.155873623  and attr store1 > 107.955873623 ) or 
       bondedto (attr store1 < 61.416  and attr store1 > 60.216 ) or 
       bondedto (attr store1 < 13.6761263766  and attr store1 > 12.4761263766 ))) 
6 0.1 0.1 peak 2198 volume 24.01720 ppm1 6.942 ppm2 6.732
 
! ############### hot_mothernoesy_072403.2199 folded +
assi (attr store1 < 6.934 and attr store1 > 6.734 )
     ((attr store1 < 6.884 and attr store1 > 6.784 ) and 
      (bondedto (attr store1 < 109.157873623  and attr store1 > 107.957873623 ) or 
       bondedto (attr store1 < 61.418  and attr store1 > 60.218 ) or 
       bondedto (attr store1 < 13.6781263766  and attr store1 > 12.4781263766 ))) 
6 0.1 0.1 peak 2199 volume 20.39000 ppm1 6.834 ppm2 6.834
 
! ############### hot_mothernoesy_072403.2200 folded +
assi (attr store1 < 7.041 and attr store1 > 6.841 )
     ((attr store1 < 6.992 and attr store1 > 6.892 ) and 
      (bondedto (attr store1 < 109.127873623  and attr store1 > 107.927873623 ) or 
       bondedto (attr store1 < 61.388  and attr store1 > 60.188 ) or 
       bondedto (attr store1 < 13.6481263766  and attr store1 > 12.4481263766 ))) 
6 0.1 0.1 peak 2200 volume 225.98849 ppm1 6.942 ppm2 6.941
 
! ############### hot_mothernoesy_072403.2202 folded +
assi (attr store1 < 6.901 and attr store1 > 6.701 )
     ((attr store1 < 6.842 and attr store1 > 6.742 ) and 
      (bondedto (attr store1 < 108.652873623  and attr store1 > 107.452873623 ) or 
       bondedto (attr store1 < 60.913  and attr store1 > 59.713 ) or 
       bondedto (attr store1 < 13.1731263766  and attr store1 > 11.9731263766 ))) 
6 0.1 0.1 peak 2202 volume 15.11100 ppm1 6.792 ppm2 6.801
 
! ############### hot_mothernoesy_072403.2203 folded +
assi (attr store1 < 6.555 and attr store1 > 6.355 )
     ((attr store1 < 6.846 and attr store1 > 6.746 ) and 
      (bondedto (attr store1 < 108.645873623  and attr store1 > 107.445873623 ) or 
       bondedto (attr store1 < 60.906  and attr store1 > 59.706 ) or 
       bondedto (attr store1 < 13.1661263766  and attr store1 > 11.9661263766 ))) 
6 0.1 0.1 peak 2203 volume 5.03680 ppm1 6.796 ppm2 6.455
 
! ############### hot_mothernoesy_072403.2204 folded -
assi (attr store1 < 7.321 and attr store1 > 7.121 )
     ((attr store1 < 7.357 and attr store1 > 7.257 ) and 
      (bondedto (attr store1 < 128.260810435  and attr store1 > 127.060810435 ) or 
       bondedto (attr store1 < 32.7810631883  and attr store1 > 31.5810631883 ))) 
6 0.1 0.1 peak 2204 volume 5.5107 ppm1 7.307 ppm2 7.221
 
! ############### hot_mothernoesy_072403.2206 folded -
assi (attr store1 < 7.404 and attr store1 > 7.204 )
     ((attr store1 < 7.354 and attr store1 > 7.254 ) and 
      (bondedto (attr store1 < 128.221810435  and attr store1 > 127.021810435 ) or 
       bondedto (attr store1 < 32.7420631883  and attr store1 > 31.5420631883 ))) 
6 0.1 0.1 peak 2206 volume 328.2872 ppm1 7.304 ppm2 7.304
 
! ############### hot_mothernoesy_072403.2207 folded -
assi (attr store1 < 7.247 and attr store1 > 7.047 )
     ((attr store1 < 7.205 and attr store1 > 7.105 ) and 
      (bondedto (attr store1 < 128.192810435  and attr store1 > 126.992810435 ) or 
       bondedto (attr store1 < 32.7130631883  and attr store1 > 31.5130631883 ))) 
6 0.1 0.1 peak 2207 volume 7.4487 ppm1 7.155 ppm2 7.147
 
! ############### hot_mothernoesy_072403.2208 folded +
assi (attr store1 < 7.367 and attr store1 > 7.167 )
     ((attr store1 < 7.332 and attr store1 > 7.232 ) and 
      (bondedto (attr store1 < 104.004873623  and attr store1 > 102.804873623 ) or 
       bondedto (attr store1 < 56.265  and attr store1 > 55.065 ) or 
       bondedto (attr store1 < 8.5251263766  and attr store1 > 7.3251263766 ))) 
6 0.1 0.1 peak 2208 volume 5.64970 ppm1 7.282 ppm2 7.267
 
! ############### hot_mothernoesy_072403.2209 folded -
assi (attr store1 < 7.403 and attr store1 > 7.203 )
     ((attr store1 < 7.353 and attr store1 > 7.253 ) and 
      (bondedto (attr store1 < 127.757810435  and attr store1 > 126.557810435 ) or 
       bondedto (attr store1 < 32.2780631883  and attr store1 > 31.0780631883 ))) 
6 0.1 0.1 peak 2209 volume 140.7776 ppm1 7.303 ppm2 7.303
 
! ############### hot_mothernoesy_072403.2210 folded +
assi (attr store1 < 4.64 and attr store1 > 4.44 )
     ((attr store1 < 7.699 and attr store1 > 7.599 ) and 
      (bondedto (attr store1 < 121.601873623  and attr store1 > 120.401873623 ) or 
       bondedto (attr store1 < 73.862  and attr store1 > 72.662 ) or 
       bondedto (attr store1 < 26.1221263766  and attr store1 > 24.9221263766 ))) 
6 0.1 0.1 peak 2210 volume 3.21150 ppm1 7.649 ppm2 4.540
 
! ############### hot_mothernoesy_072403.2211 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 7.86 and attr store1 > 7.76 ) and 
      (bondedto (attr store1 < 139.433810435  and attr store1 > 138.233810435 ) or 
       bondedto (attr store1 < 43.9540631883  and attr store1 > 42.7540631883 ))) 
6 0.1 0.1 peak 2211 volume 5.9033 ppm1 7.810 ppm2 4.773
 
! ############### hot_mothernoesy_072403.2212 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 7.864 and attr store1 > 7.764 ) and 
      (bondedto (attr store1 < 115.108873623  and attr store1 > 113.908873623 ) or 
       bondedto (attr store1 < 67.369  and attr store1 > 66.169 ) or 
       bondedto (attr store1 < 19.6291263766  and attr store1 > 18.4291263766 ))) 
6 0.1 0.1 peak 2212 volume 3.00600 ppm1 7.814 ppm2 4.773
 
! ############### hot_mothernoesy_072403.2213 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 7.029 and attr store1 > 6.929 ) and 
      (bondedto (attr store1 < 119.116873623  and attr store1 > 117.916873623 ) or 
       bondedto (attr store1 < 71.377  and attr store1 > 70.177 ) or 
       bondedto (attr store1 < 23.6371263766  and attr store1 > 22.4371263766 ))) 
6 0.1 0.1 peak 2213 volume 11.45320 ppm1 6.979 ppm2 4.773
 
! ############### hot_mothernoesy_072403.2214 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 6.892 and attr store1 > 6.792 ) and 
      (bondedto (attr store1 < 119.032873623  and attr store1 > 117.832873623 ) or 
       bondedto (attr store1 < 71.293  and attr store1 > 70.093 ) or 
       bondedto (attr store1 < 23.5531263766  and attr store1 > 22.3531263766 ))) 
6 0.1 0.1 peak 2214 volume 5.24230 ppm1 6.842 ppm2 4.772
 
! ############### hot_mothernoesy_072403.2215 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 6.781 and attr store1 > 6.681 ) and 
      (bondedto (attr store1 < 118.935873623  and attr store1 > 117.735873623 ) or 
       bondedto (attr store1 < 71.196  and attr store1 > 69.996 ) or 
       bondedto (attr store1 < 23.4561263766  and attr store1 > 22.2561263766 ))) 
6 0.1 0.1 peak 2215 volume 4.81240 ppm1 6.731 ppm2 4.772
 
! ############### hot_mothernoesy_072403.2216 folded +
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 6.969 and attr store1 > 6.869 ) and 
      (bondedto (attr store1 < 118.526873623  and attr store1 > 117.326873623 ) or 
       bondedto (attr store1 < 70.787  and attr store1 > 69.587 ) or 
       bondedto (attr store1 < 23.0471263766  and attr store1 > 21.8471263766 ))) 
6 0.1 0.1 peak 2216 volume 10.64480 ppm1 6.919 ppm2 4.773
 
! ############### hot_mothernoesy_072403.2217 folded +
assi (attr store1 < 4.874 and attr store1 > 4.674 )
     ((attr store1 < 6.506 and attr store1 > 6.406 ) and 
      (bondedto (attr store1 < 117.795873623  and attr store1 > 116.595873623 ) or 
       bondedto (attr store1 < 70.056  and attr store1 > 68.856 ) or 
       bondedto (attr store1 < 22.3161263766  and attr store1 > 21.1161263766 ))) 
6 0.1 0.1 peak 2217 volume 7.22800 ppm1 6.456 ppm2 4.774
 
! ############### hot_mothernoesy_072403.2218 folded -
assi (attr store1 < 4.873 and attr store1 > 4.673 )
     ((attr store1 < 6.974 and attr store1 > 6.874 ) and 
      (bondedto (attr store1 < 141.503810435  and attr store1 > 140.303810435 ) or 
       bondedto (attr store1 < 46.0240631883  and attr store1 > 44.8240631883 ))) 
6 0.1 0.1 peak 2218 volume 3.1565 ppm1 6.924 ppm2 4.773
 
! ############### hot_mothernoesy_072403.2221 folded +
assi (attr store1 < 4.651 and attr store1 > 4.451 )
     ((attr store1 < 7.191 and attr store1 > 7.091 ) and 
      (bondedto (attr store1 < 109.268873623  and attr store1 > 108.068873623 ) or 
       bondedto (attr store1 < 61.529  and attr store1 > 60.329 ) or 
       bondedto (attr store1 < 13.7891263766  and attr store1 > 12.5891263766 ))) 
6 0.1 0.1 peak 2221 volume 3.09260 ppm1 7.141 ppm2 4.551
 
! ############### hot_mothernoesy_072403.2222 folded -
assi (attr store1 < 4.628 and attr store1 > 4.428 )
     ((attr store1 < 7.359 and attr store1 > 7.259 ) and 
      (bondedto (attr store1 < 128.256810435  and attr store1 > 127.056810435 ) or 
       bondedto (attr store1 < 32.7770631883  and attr store1 > 31.5770631883 ))) 
6 0.1 0.1 peak 2222 volume 3.4226 ppm1 7.309 ppm2 4.528
 
! ############### hot_mothernoesy_072403.2223 folded -
assi (attr store1 < 0.909 and attr store1 > 0.709 )
     ((attr store1 < 5.125 and attr store1 > 5.025 ) and 
      (bondedto (attr store1 < 150.212810435  and attr store1 > 149.012810435 ) or 
       bondedto (attr store1 < 54.7330631883  and attr store1 > 53.5330631883 ))) 
6 0.1 0.1 peak 2223 volume 14.1445 ppm1 5.075 ppm2 0.809
 
! ############### hot_mothernoesy_072403.2224 folded -
assi (attr store1 < 1.02 and attr store1 > 0.82 )
     ((attr store1 < 5.137 and attr store1 > 5.037 ) and 
      (bondedto (attr store1 < 150.212810435  and attr store1 > 149.012810435 ) or 
       bondedto (attr store1 < 54.7330631883  and attr store1 > 53.5330631883 ))) 
6 0.1 0.1 peak 2224 volume 4.0738 ppm1 5.087 ppm2 0.920
 
! ############### hot_mothernoesy_072403.2225 folded -
assi (attr store1 < 1.745 and attr store1 > 1.545 )
     ((attr store1 < 5.122 and attr store1 > 5.022 ) and 
      (bondedto (attr store1 < 150.212810435  and attr store1 > 149.012810435 ) or 
       bondedto (attr store1 < 54.7330631883  and attr store1 > 53.5330631883 ))) 
6 0.1 0.1 peak 2225 volume 7.5726 ppm1 5.072 ppm2 1.645
 
! ############### hot_mothernoesy_072403.2226 folded -
assi (attr store1 < 2.268 and attr store1 > 2.068 )
     ((attr store1 < 5.12 and attr store1 > 5.02 ) and 
      (bondedto (attr store1 < 150.212810435  and attr store1 > 149.012810435 ) or 
       bondedto (attr store1 < 54.7330631883  and attr store1 > 53.5330631883 ))) 
6 0.1 0.1 peak 2226 volume 4.0303 ppm1 5.070 ppm2 2.168
 
! ############### hot_mothernoesy_072403.2227 folded -
assi (attr store1 < 5.171 and attr store1 > 4.971 )
     ((attr store1 < 5.123 and attr store1 > 5.023 ) and 
      (bondedto (attr store1 < 150.212810435  and attr store1 > 149.012810435 ) or 
       bondedto (attr store1 < 54.7330631883  and attr store1 > 53.5330631883 ))) 
6 0.1 0.1 peak 2227 volume 15.8097 ppm1 5.073 ppm2 5.071
 
! ############### hot_mothernoesy_072403.2229 folded -
assi (attr store1 < 8.388 and attr store1 > 8.188 )
     ((attr store1 < 5.135 and attr store1 > 5.035 ) and 
      (bondedto (attr store1 < 150.212810435  and attr store1 > 149.012810435 ) or 
       bondedto (attr store1 < 54.7330631883  and attr store1 > 53.5330631883 ))) 
6 0.1 0.1 peak 2229 volume 3.4097 ppm1 5.085 ppm2 8.288
 
! ############### hot_mothernoesy_072403.2230 folded -
assi (attr store1 < 2.688 and attr store1 > 2.488 )
     ((attr store1 < 4.955 and attr store1 > 4.855 ) and 
      (bondedto (attr store1 < 148.533810435  and attr store1 > 147.333810435 ) or 
       bondedto (attr store1 < 53.0540631883  and attr store1 > 51.8540631883 ))) 
6 0.1 0.1 peak 2230 volume 15.6531 ppm1 4.905 ppm2 2.588
 
! ############### hot_mothernoesy_072403.2231 folded -
assi (attr store1 < 2.906 and attr store1 > 2.706 )
     ((attr store1 < 4.957 and attr store1 > 4.857 ) and 
      (bondedto (attr store1 < 148.533810435  and attr store1 > 147.333810435 ) or 
       bondedto (attr store1 < 53.0540631883  and attr store1 > 51.8540631883 ))) 
6 0.1 0.1 peak 2231 volume 10.7966 ppm1 4.907 ppm2 2.806
 
! ############### hot_mothernoesy_072403.2232 folded -
assi (attr store1 < 3.931 and attr store1 > 3.731 )
     ((attr store1 < 4.958 and attr store1 > 4.858 ) and 
      (bondedto (attr store1 < 148.533810435  and attr store1 > 147.333810435 ) or 
       bondedto (attr store1 < 53.0540631883  and attr store1 > 51.8540631883 ))) 
6 0.1 0.1 peak 2232 volume 34.8254 ppm1 4.908 ppm2 3.831
 
! ############### hot_mothernoesy_072403.2233 folded -
assi (attr store1 < 4.026 and attr store1 > 3.826 )
     ((attr store1 < 4.956 and attr store1 > 4.856 ) and 
      (bondedto (attr store1 < 148.533810435  and attr store1 > 147.333810435 ) or 
       bondedto (attr store1 < 53.0540631883  and attr store1 > 51.8540631883 ))) 
6 0.1 0.1 peak 2233 volume 38.9337 ppm1 4.906 ppm2 3.926
 
! ############### hot_mothernoesy_072403.2234 folded -
assi (attr store1 < 5.006 and attr store1 > 4.806 )
     ((attr store1 < 4.957 and attr store1 > 4.857 ) and 
      (bondedto (attr store1 < 148.533810435  and attr store1 > 147.333810435 ) or 
       bondedto (attr store1 < 53.0540631883  and attr store1 > 51.8540631883 ))) 
6 0.1 0.1 peak 2234 volume 342.1254 ppm1 4.907 ppm2 4.906
 
! ############### hot_mothernoesy_072403.2235 folded +
assi (attr store1 < 8.737 and attr store1 > 8.537 )
     ((attr store1 < 7.032 and attr store1 > 6.932 ) and 
      (bondedto (attr store1 < 119.123873623  and attr store1 > 117.923873623 ) or 
       bondedto (attr store1 < 71.384  and attr store1 > 70.184 ) or 
       bondedto (attr store1 < 23.6441263766  and attr store1 > 22.4441263766 ))) 
6 0.1 0.1 peak 2235 volume 3.39840 ppm1 6.982 ppm2 8.637
 
! ############### hot_mothernoesy_072403.2236 folded +
assi (attr store1 < 5.682 and attr store1 > 5.482 )
     ((attr store1 < 5.632 and attr store1 > 5.532 ) and 
      (bondedto (attr store1 < 119.988873623  and attr store1 > 118.788873623 ) or 
       bondedto (attr store1 < 72.249  and attr store1 > 71.049 ) or 
       bondedto (attr store1 < 24.5091263766  and attr store1 > 23.3091263766 ))) 
6 0.1 0.1 peak 2236 volume 16.92250 ppm1 5.582 ppm2 5.582
 
! ############### hot_mothernoesy_072403.2237 folded +
assi (attr store1 < 4.872 and attr store1 > 4.672 )
     ((attr store1 < 5.633 and attr store1 > 5.533 ) and 
      (bondedto (attr store1 < 119.958873623  and attr store1 > 118.758873623 ) or 
       bondedto (attr store1 < 72.219  and attr store1 > 71.019 ) or 
       bondedto (attr store1 < 24.4791263766  and attr store1 > 23.2791263766 ))) 
6 0.1 0.1 peak 2237 volume 6.13030 ppm1 5.583 ppm2 4.772
 
! ############### hot_mothernoesy_072403.2238 folded -
assi (attr store1 < 4.681 and attr store1 > 4.481 )
     ((attr store1 < 4.631 and attr store1 > 4.531 ) and 
      (bondedto (attr store1 < 150.585810435  and attr store1 > 149.385810435 ) or 
       bondedto (attr store1 < 55.1060631883  and attr store1 > 53.9060631883 ))) 
6 0.1 0.1 peak 2238 volume 817.42401 ppm1 4.581 ppm2 4.581
 
! ############### hot_mothernoesy_072403.2239 folded -
assi (attr store1 < 4.997 and attr store1 > 4.797 )
     ((attr store1 < 4.678 and attr store1 > 4.578 ) and 
      (bondedto (attr store1 < 150.585810435  and attr store1 > 149.385810435 ) or 
       bondedto (attr store1 < 55.1060631883  and attr store1 > 53.9060631883 ))) 
6 0.1 0.1 peak 2239 volume 7.0139 ppm1 4.628 ppm2 4.897
 
! ############### hot_mothernoesy_072403.2240 folded -
assi (attr store1 < 2.854 and attr store1 > 2.654 )
     ((attr store1 < 4.68 and attr store1 > 4.58 ) and 
      (bondedto (attr store1 < 150.585810435  and attr store1 > 149.385810435 ) or 
       bondedto (attr store1 < 55.1060631883  and attr store1 > 53.9060631883 ))) 
6 0.1 0.1 peak 2240 volume 12.0757 ppm1 4.630 ppm2 2.754
 
! ############### hot_mothernoesy_072403.2241 folded -
assi (attr store1 < 2.738 and attr store1 > 2.538 )
     ((attr store1 < 4.684 and attr store1 > 4.584 ) and 
      (bondedto (attr store1 < 150.585810435  and attr store1 > 149.385810435 ) or 
       bondedto (attr store1 < 55.1060631883  and attr store1 > 53.9060631883 ))) 
6 0.1 0.1 peak 2241 volume 9.1421 ppm1 4.634 ppm2 2.638
 
! ############### hot_mothernoesy_072403.2242 folded -
assi (attr store1 < 4.997 and attr store1 > 4.797 )
     ((attr store1 < 4.678 and attr store1 > 4.578 ) and 
      (bondedto (attr store1 < 150.491810435  and attr store1 > 149.291810435 ) or 
       bondedto (attr store1 < 55.0120631883  and attr store1 > 53.8120631883 ))) 
6 0.1 0.1 peak 2242 volume 7.8609 ppm1 4.628 ppm2 4.897
 
! ############### hot_mothernoesy_072403.2255 folded +
assi (attr store1 < 2.514 and attr store1 > 2.314 )
     ((attr store1 < 0.963 and attr store1 > 0.863 ) and 
      (bondedto (attr store1 < 119.442873623  and attr store1 > 118.242873623 ) or 
       bondedto (attr store1 < 71.703  and attr store1 > 70.503 ) or 
       bondedto (attr store1 < 23.9631263766  and attr store1 > 22.7631263766 ))) 
6 0.1 0.1 peak 2255 volume 3.13200 ppm1 0.913 ppm2 2.414
 
! ############### hot_mothernoesy_072403.2259 folded +
assi (attr store1 < 7.21 and attr store1 > 7.01 )
     ((attr store1 < 1.04 and attr store1 > 0.94 ) and 
      (bondedto (attr store1 < 121.027873623  and attr store1 > 119.827873623 ) or 
       bondedto (attr store1 < 73.288  and attr store1 > 72.088 ) or 
       bondedto (attr store1 < 25.5481263766  and attr store1 > 24.3481263766 ))) 
6 0.1 0.1 peak 2259 volume 3.05760 ppm1 0.990 ppm2 7.110
 
! ############### hot_mothernoesy_072403.2266 folded -
assi (attr store1 < 4.783 and attr store1 > 4.583 )
     ((attr store1 < 2.091 and attr store1 > 1.991 ) and 
      (bondedto (attr store1 < 138.183810435  and attr store1 > 136.983810435 ) or 
       bondedto (attr store1 < 42.7040631883  and attr store1 > 41.5040631883 ))) 
6 0.1 0.1 peak 2266 volume 3.0389 ppm1 2.041 ppm2 4.683
 
! ############### hot_mothernoesy_072403.2271 folded -
assi (attr store1 < 4.762 and attr store1 > 4.562 )
     ((attr store1 < 4.708 and attr store1 > 4.608 ) and 
      (bondedto (attr store1 < 148.813810435  and attr store1 > 147.613810435 ) or 
       bondedto (attr store1 < 53.3340631883  and attr store1 > 52.1340631883 ))) 
6 0.1 0.1 peak 2271 volume 50.5491 ppm1 4.658 ppm2 4.662
 
! ############### hot_mothernoesy_072403.2273 folded -
assi (attr store1 < 2.103 and attr store1 > 1.903 )
     ((attr store1 < 3.962 and attr store1 > 3.862 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 2273 volume 6.0196 ppm1 3.912 ppm2 2.003
 
! ############### hot_mothernoesy_072403.2274 folded -
assi (attr store1 < 4.018 and attr store1 > 3.818 )
     ((attr store1 < 3.966 and attr store1 > 3.866 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 2274 volume 189.1312 ppm1 3.916 ppm2 3.918
 
! ############### hot_mothernoesy_072403.2275 folded -
assi (attr store1 < 4.875 and attr store1 > 4.675 )
     ((attr store1 < 3.965 and attr store1 > 3.865 ) and 
      (bondedto (attr store1 < 151.144810435  and attr store1 > 149.944810435 ) or 
       bondedto (attr store1 < 55.6650631883  and attr store1 > 54.4650631883 ))) 
6 0.1 0.1 peak 2275 volume 4.141 ppm1 3.915 ppm2 4.775
 
! ############### hot_mothernoesy_072403.2277 folded +
assi (attr store1 < 8.734 and attr store1 > 8.534 )
     ((attr store1 < 4.377 and attr store1 > 4.277 ) and 
      (bondedto (attr store1 < 107.134873623  and attr store1 > 105.934873623 ) or 
       bondedto (attr store1 < 59.395  and attr store1 > 58.195 ) or 
       bondedto (attr store1 < 11.6551263766  and attr store1 > 10.4551263766 ))) 
6 0.1 0.1 peak 2277 volume 4.11130 ppm1 4.327 ppm2 8.634
 
! ############### hot_mothernoesy_072403.2346 folded +
assi (attr store1 < 3.096 and attr store1 > 2.896 )
     ((attr store1 < 4.599 and attr store1 > 4.499 ) and 
      (bondedto (attr store1 < 105.828873623  and attr store1 > 104.628873623 ) or 
       bondedto (attr store1 < 58.089  and attr store1 > 56.889 ) or 
       bondedto (attr store1 < 10.3491263766  and attr store1 > 9.1491263766 ))) 
6 0.1 0.1 peak 2346 volume 9.51581 ppm1 4.549 ppm2 2.996
 
! ############### hot_mothernoesy_072403.2347 folded +
assi (attr store1 < 3.206 and attr store1 > 3.006 )
     ((attr store1 < 4.595 and attr store1 > 4.495 ) and 
      (bondedto (attr store1 < 105.828873623  and attr store1 > 104.628873623 ) or 
       bondedto (attr store1 < 58.089  and attr store1 > 56.889 ) or 
       bondedto (attr store1 < 10.3491263766  and attr store1 > 9.1491263766 ))) 
6 0.1 0.1 peak 2347 volume 8.01464 ppm1 4.545 ppm2 3.106
 
! ############### hot_mothernoesy_072403.2348 folded +
assi (attr store1 < 8.022 and attr store1 > 7.822 )
     ((attr store1 < 4.589 and attr store1 > 4.489 ) and 
      (bondedto (attr store1 < 105.828873623  and attr store1 > 104.628873623 ) or 
       bondedto (attr store1 < 58.089  and attr store1 > 56.889 ) or 
       bondedto (attr store1 < 10.3491263766  and attr store1 > 9.1491263766 ))) 
6 0.1 0.1 peak 2348 volume 7.10160 ppm1 4.539 ppm2 7.922
 
! ############### hot_mothernoesy_072403.2425 folded +
assi (attr store1 < 2.191 and attr store1 > 1.991 )
     ((attr store1 < 4.49 and attr store1 > 4.39 ) and 
      (bondedto (attr store1 < 107.134873623  and attr store1 > 105.934873623 ) or 
       bondedto (attr store1 < 59.395  and attr store1 > 58.195 ) or 
       bondedto (attr store1 < 11.6551263766  and attr store1 > 10.4551263766 ))) 
6 0.1 0.1 peak 2425 volume 3.84844 ppm1 4.440 ppm2 2.091
 
! ############### hot_mothernoesy_072403.2466 folded +
assi (attr store1 < 0.712 and attr store1 > 0.512 )
     ((attr store1 < 0.958 and attr store1 > 0.858 ) and 
      (bondedto (attr store1 < 119.162873623  and attr store1 > 117.962873623 ) or 
       bondedto (attr store1 < 71.423  and attr store1 > 70.223 ) or 
       bondedto (attr store1 < 23.6831263766  and attr store1 > 22.4831263766 ))) 
6 0.1 0.1 peak 2466 volume 10.06729 ppm1 0.908 ppm2 0.612
 
! ############### hot_mothernoesy_072403.2467 folded +
assi (attr store1 < 0.259 and attr store1 > 0.059 )
     ((attr store1 < 0.956 and attr store1 > 0.856 ) and 
      (bondedto (attr store1 < 119.162873623  and attr store1 > 117.962873623 ) or 
       bondedto (attr store1 < 71.423  and attr store1 > 70.223 ) or 
       bondedto (attr store1 < 23.6831263766  and attr store1 > 22.4831263766 ))) 
6 0.1 0.1 peak 2467 volume 3.93704 ppm1 0.906 ppm2 0.159
 
! ############### hot_mothernoesy_072403.2536 folded -
assi (attr store1 < 3.474 and attr store1 > 3.274 )
     ((attr store1 < 3.424 and attr store1 > 3.324 ) and 
      (bondedto (attr store1 < 134.174810435  and attr store1 > 132.974810435 ) or 
       bondedto (attr store1 < 38.6950631883  and attr store1 > 37.4950631883 ))) 
6 0.1 0.1 peak 2536 volume 3.05495 ppm1 3.374 ppm2 3.374
 
! ############### hot_mothernoesy_072403.2549 folded -
assi (attr store1 < 1.644 and attr store1 > 1.444 )
     ((attr store1 < 2.227 and attr store1 > 2.127 ) and 
      (bondedto (attr store1 < 140.328810435  and attr store1 > 139.128810435 ) or 
       bondedto (attr store1 < 44.8490631883  and attr store1 > 43.6490631883 ))) 
6 0.1 0.1 peak 2549 volume 3.04598 ppm1 2.177 ppm2 1.544
 
! ############### hot_mothernoesy_072403.2555 folded -
assi (attr store1 < 7.513 and attr store1 > 7.313 )
     ((attr store1 < 2.6 and attr store1 > 2.5 ) and 
      (bondedto (attr store1 < 129.978810435  and attr store1 > 128.778810435 ) or 
       bondedto (attr store1 < 34.4990631883  and attr store1 > 33.2990631883 ))) 
6 0.1 0.1 peak 2555 volume 3.06351 ppm1 2.550 ppm2 7.413
 
! ############### hot_mothernoesy_072403.2573 folded +
assi (attr store1 < 3.159 and attr store1 > 2.959 )
     ((attr store1 < 4.372 and attr store1 > 4.272 ) and 
      (bondedto (attr store1 < 106.947873623  and attr store1 > 105.747873623 ) or 
       bondedto (attr store1 < 59.208  and attr store1 > 58.008 ) or 
       bondedto (attr store1 < 11.4681263766  and attr store1 > 10.2681263766 ))) 
6 0.1 0.1 peak 2573 volume 3.85492 ppm1 4.322 ppm2 3.059
 
! ############### hot_mothernoesy_072403.2581 folded +
assi (attr store1 < 7.272 and attr store1 > 7.072 )
     ((attr store1 < 1.582 and attr store1 > 1.482 ) and 
      (bondedto (attr store1 < 119.628873623  and attr store1 > 118.428873623 ) or 
       bondedto (attr store1 < 71.889  and attr store1 > 70.689 ) or 
       bondedto (attr store1 < 24.1491263766  and attr store1 > 22.9491263766 ))) 
6 0.1 0.1 peak 2581 volume 4.33813 ppm1 1.532 ppm2 7.172
 
! ############### hot_mothernoesy_072403.2583 folded +
assi (attr store1 < 8.74 and attr store1 > 8.54 )
     ((attr store1 < 1.608 and attr store1 > 1.508 ) and 
      (bondedto (attr store1 < 120.094873623  and attr store1 > 118.894873623 ) or 
       bondedto (attr store1 < 72.355  and attr store1 > 71.155 ) or 
       bondedto (attr store1 < 24.6151263766  and attr store1 > 23.4151263766 ))) 
6 0.1 0.1 peak 2583 volume 3.93188 ppm1 1.558 ppm2 8.640
 
! ############### hot_mothernoesy_072403.2647 folded +
assi (attr store1 < 1.898 and attr store1 > 1.698 )
     ((attr store1 < 3.73 and attr store1 > 3.63 ) and 
      (bondedto (attr store1 < 109.092873623  and attr store1 > 107.892873623 ) or 
       bondedto (attr store1 < 61.353  and attr store1 > 60.153 ) or 
       bondedto (attr store1 < 13.6131263766  and attr store1 > 12.4131263766 ))) 
6 0.1 0.1 peak 2647 volume 3.10052 ppm1 3.680 ppm2 1.798
 
! ############### hot_gnoesyNhsqc_051903.0 NOT folded
assi (attr store1 < 4.819 and attr store1 > 4.719 ) 
     ((attr store1 < 9.358 and attr store1 > 9.298 ) and bondedto
      (attr store1 < 132.728  and attr store1 > 131.928 ))
6 0.1 0.1 peak 0 volume 12.99646 ppm1 9.328 ppm2 4.769
 
! ############### hot_gnoesyNhsqc_051903.2 NOT folded
assi (attr store1 < 4.307 and attr store1 > 4.207 ) 
     ((attr store1 < 9.363 and attr store1 > 9.303 ) and bondedto
      (attr store1 < 132.734  and attr store1 > 131.934 ))
6 0.1 0.1 peak 2 volume 6.21690 ppm1 9.333 ppm2 4.257
 
! ############### hot_gnoesyNhsqc_051903.3 NOT folded
assi (attr store1 < 3.926 and attr store1 > 3.826 ) 
     ((attr store1 < 9.359 and attr store1 > 9.299 ) and bondedto
      (attr store1 < 132.73  and attr store1 > 131.93 ))
6 0.1 0.1 peak 3 volume 28.07840 ppm1 9.329 ppm2 3.876
 
! ############### hot_gnoesyNhsqc_051903.4 NOT folded
assi (attr store1 < 2.34 and attr store1 > 2.24 ) 
     ((attr store1 < 9.36 and attr store1 > 9.3 ) and bondedto
      (attr store1 < 132.74  and attr store1 > 131.94 ))
6 0.1 0.1 peak 4 volume 6.36910 ppm1 9.330 ppm2 2.290
 
! ############### hot_gnoesyNhsqc_051903.5 NOT folded
assi (attr store1 < 2.074 and attr store1 > 1.974 ) 
     ((attr store1 < 9.359 and attr store1 > 9.299 ) and bondedto
      (attr store1 < 132.709  and attr store1 > 131.909 ))
6 0.1 0.1 peak 5 volume 11.65478 ppm1 9.329 ppm2 2.024
 
! ############### hot_gnoesyNhsqc_051903.7 NOT folded
assi (attr store1 < 1.539 and attr store1 > 1.439 ) 
     ((attr store1 < 9.359 and attr store1 > 9.299 ) and bondedto
      (attr store1 < 132.723  and attr store1 > 131.923 ))
6 0.1 0.1 peak 7 volume 77.64464 ppm1 9.329 ppm2 1.489
 
! ############### hot_gnoesyNhsqc_051903.9 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.023  and attr store1 > 129.223 ))
6 0.1 0.1 peak 9 volume 126.44801 ppm1 10.168 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.10 NOT folded
assi (attr store1 < 4.553 and attr store1 > 4.453 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.061  and attr store1 > 129.261 ))
6 0.1 0.1 peak 10 volume 8.35691 ppm1 10.168 ppm2 4.503
 
! ############### hot_gnoesyNhsqc_051903.11 NOT folded
assi (attr store1 < 3.326 and attr store1 > 3.226 ) 
     ((attr store1 < 10.199 and attr store1 > 10.139 ) and bondedto
      (attr store1 < 130.043  and attr store1 > 129.243 ))
6 0.1 0.1 peak 11 volume 8.71793 ppm1 10.169 ppm2 3.276
 
! ############### hot_gnoesyNhsqc_051903.12 NOT folded
assi (attr store1 < 2.782 and attr store1 > 2.682 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.022  and attr store1 > 129.222 ))
6 0.1 0.1 peak 12 volume 18.25558 ppm1 10.168 ppm2 2.732
 
! ############### hot_gnoesyNhsqc_051903.13 NOT folded
assi (attr store1 < 2.345 and attr store1 > 2.245 ) 
     ((attr store1 < 10.197 and attr store1 > 10.137 ) and bondedto
      (attr store1 < 130.007  and attr store1 > 129.207 ))
6 0.1 0.1 peak 13 volume 6.05814 ppm1 10.167 ppm2 2.295
 
! ############### hot_gnoesyNhsqc_051903.14 NOT folded
assi (attr store1 < 1.944 and attr store1 > 1.844 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.025  and attr store1 > 129.225 ))
6 0.1 0.1 peak 14 volume 9.25768 ppm1 10.168 ppm2 1.894
 
! ############### hot_gnoesyNhsqc_051903.15 NOT folded
assi (attr store1 < 1.449 and attr store1 > 1.349 ) 
     ((attr store1 < 10.197 and attr store1 > 10.137 ) and bondedto
      (attr store1 < 130.002  and attr store1 > 129.202 ))
6 0.1 0.1 peak 15 volume 8.95277 ppm1 10.167 ppm2 1.399
 
! ############### hot_gnoesyNhsqc_051903.16 NOT folded
assi (attr store1 < 1.047 and attr store1 > 0.947 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.029  and attr store1 > 129.229 ))
6 0.1 0.1 peak 16 volume 12.30103 ppm1 10.168 ppm2 0.997
 
! ############### hot_gnoesyNhsqc_051903.17 NOT folded
assi (attr store1 < 0.916 and attr store1 > 0.816 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.029  and attr store1 > 129.229 ))
6 0.1 0.1 peak 17 volume 13.77764 ppm1 10.168 ppm2 0.866
 
! ############### hot_gnoesyNhsqc_051903.18 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.028 and attr store1 > 7.968 ) and bondedto
      (attr store1 < 129.312  and attr store1 > 128.512 ))
6 0.1 0.1 peak 18 volume 14.47390 ppm1 7.998 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.19 NOT folded
assi (attr store1 < 4.23 and attr store1 > 4.13 ) 
     ((attr store1 < 8.031 and attr store1 > 7.971 ) and bondedto
      (attr store1 < 129.323  and attr store1 > 128.523 ))
6 0.1 0.1 peak 19 volume 22.16683 ppm1 8.001 ppm2 4.180
 
! ############### hot_gnoesyNhsqc_051903.20 NOT folded
assi (attr store1 < 4.384 and attr store1 > 4.284 ) 
     ((attr store1 < 8.024 and attr store1 > 7.964 ) and bondedto
      (attr store1 < 129.308  and attr store1 > 128.508 ))
6 0.1 0.1 peak 20 volume 129.75189 ppm1 7.994 ppm2 4.334
 
! ############### hot_gnoesyNhsqc_051903.21 NOT folded
assi (attr store1 < 1.84 and attr store1 > 1.74 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 129.296  and attr store1 > 128.496 ))
6 0.1 0.1 peak 21 volume 11.04587 ppm1 7.993 ppm2 1.790
 
! ############### hot_gnoesyNhsqc_051903.22 NOT folded
assi (attr store1 < 1.753 and attr store1 > 1.653 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 129.298  and attr store1 > 128.498 ))
6 0.1 0.1 peak 22 volume 17.72863 ppm1 7.993 ppm2 1.703
 
! ############### hot_gnoesyNhsqc_051903.23 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.625 and attr store1 > 8.565 ) and bondedto
      (attr store1 < 128.151  and attr store1 > 127.351 ))
6 0.1 0.1 peak 23 volume 17.47438 ppm1 8.595 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.24 NOT folded
assi (attr store1 < 4.51 and attr store1 > 4.41 ) 
     ((attr store1 < 8.626 and attr store1 > 8.566 ) and bondedto
      (attr store1 < 128.157  and attr store1 > 127.357 ))
6 0.1 0.1 peak 24 volume 18.39128 ppm1 8.596 ppm2 4.460
 
! ############### hot_gnoesyNhsqc_051903.25 NOT folded
assi (attr store1 < 2.354 and attr store1 > 2.254 ) 
     ((attr store1 < 8.626 and attr store1 > 8.566 ) and bondedto
      (attr store1 < 128.143  and attr store1 > 127.343 ))
6 0.1 0.1 peak 25 volume 21.40095 ppm1 8.596 ppm2 2.304
 
! ############### hot_gnoesyNhsqc_051903.26 NOT folded
assi (attr store1 < 4.277 and attr store1 > 4.177 ) 
     ((attr store1 < 8.623 and attr store1 > 8.563 ) and bondedto
      (attr store1 < 128.132  and attr store1 > 127.332 ))
6 0.1 0.1 peak 26 volume 60.92125 ppm1 8.593 ppm2 4.227
 
! ############### hot_gnoesyNhsqc_051903.27 NOT folded
assi (attr store1 < 1.953 and attr store1 > 1.853 ) 
     ((attr store1 < 8.624 and attr store1 > 8.564 ) and bondedto
      (attr store1 < 128.129  and attr store1 > 127.329 ))
6 0.1 0.1 peak 27 volume 30.89470 ppm1 8.594 ppm2 1.903
 
! ############### hot_gnoesyNhsqc_051903.28 NOT folded
assi (attr store1 < 1.507 and attr store1 > 1.407 ) 
     ((attr store1 < 8.623 and attr store1 > 8.563 ) and bondedto
      (attr store1 < 128.124  and attr store1 > 127.324 ))
6 0.1 0.1 peak 28 volume 26.85434 ppm1 8.593 ppm2 1.457
 
! ############### hot_gnoesyNhsqc_051903.29 NOT folded
assi (attr store1 < 1.045 and attr store1 > 0.945 ) 
     ((attr store1 < 8.624 and attr store1 > 8.564 ) and bondedto
      (attr store1 < 128.135  and attr store1 > 127.335 ))
6 0.1 0.1 peak 29 volume 92.14658 ppm1 8.594 ppm2 0.995
 
! ############### hot_gnoesyNhsqc_051903.30 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.343 and attr store1 > 8.283 ) and bondedto
      (attr store1 < 126.724  and attr store1 > 125.924 ))
6 0.1 0.1 peak 30 volume 290.55585 ppm1 8.313 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.31 NOT folded
assi (attr store1 < 4.384 and attr store1 > 4.284 ) 
     ((attr store1 < 8.339 and attr store1 > 8.279 ) and bondedto
      (attr store1 < 126.732  and attr store1 > 125.932 ))
6 0.1 0.1 peak 31 volume 31.64081 ppm1 8.309 ppm2 4.334
 
! ############### hot_gnoesyNhsqc_051903.32 NOT folded
assi (attr store1 < 4.086 and attr store1 > 3.986 ) 
     ((attr store1 < 8.342 and attr store1 > 8.282 ) and bondedto
      (attr store1 < 126.729  and attr store1 > 125.929 ))
6 0.1 0.1 peak 32 volume 121.36324 ppm1 8.312 ppm2 4.036
 
! ############### hot_gnoesyNhsqc_051903.33 NOT folded
assi (attr store1 < 2.113 and attr store1 > 2.013 ) 
     ((attr store1 < 8.341 and attr store1 > 8.281 ) and bondedto
      (attr store1 < 126.735  and attr store1 > 125.935 ))
6 0.1 0.1 peak 33 volume 11.16803 ppm1 8.311 ppm2 2.063
 
! ############### hot_gnoesyNhsqc_051903.34 NOT folded
assi (attr store1 < 1.807 and attr store1 > 1.707 ) 
     ((attr store1 < 8.342 and attr store1 > 8.282 ) and bondedto
      (attr store1 < 126.721  and attr store1 > 125.921 ))
6 0.1 0.1 peak 34 volume 33.98602 ppm1 8.312 ppm2 1.757
 
! ############### hot_gnoesyNhsqc_051903.35 NOT folded
assi (attr store1 < 1.473 and attr store1 > 1.373 ) 
     ((attr store1 < 8.343 and attr store1 > 8.283 ) and bondedto
      (attr store1 < 126.692  and attr store1 > 125.892 ))
6 0.1 0.1 peak 35 volume 9.16002 ppm1 8.313 ppm2 1.423
 
! ############### hot_gnoesyNhsqc_051903.36 NOT folded
assi (attr store1 < 0.978 and attr store1 > 0.878 ) 
     ((attr store1 < 8.342 and attr store1 > 8.282 ) and bondedto
      (attr store1 < 126.72  and attr store1 > 125.92 ))
6 0.1 0.1 peak 36 volume 15.82459 ppm1 8.312 ppm2 0.928
 
! ############### hot_gnoesyNhsqc_051903.37 NOT folded
assi (attr store1 < 1.198 and attr store1 > 1.098 ) 
     ((attr store1 < 8.159 and attr store1 > 8.099 ) and bondedto
      (attr store1 < 126.414  and attr store1 > 125.614 ))
6 0.1 0.1 peak 37 volume 14.29900 ppm1 8.129 ppm2 1.148
 
! ############### hot_gnoesyNhsqc_051903.38 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.16 and attr store1 > 8.1 ) and bondedto
      (attr store1 < 126.398  and attr store1 > 125.598 ))
6 0.1 0.1 peak 38 volume 120.28113 ppm1 8.130 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.39 NOT folded
assi (attr store1 < 4.598 and attr store1 > 4.498 ) 
     ((attr store1 < 8.158 and attr store1 > 8.098 ) and bondedto
      (attr store1 < 126.366  and attr store1 > 125.566 ))
6 0.1 0.1 peak 39 volume 22.59056 ppm1 8.128 ppm2 4.548
 
! ############### hot_gnoesyNhsqc_051903.40 NOT folded
assi (attr store1 < 4.285 and attr store1 > 4.185 ) 
     ((attr store1 < 8.159 and attr store1 > 8.099 ) and bondedto
      (attr store1 < 126.385  and attr store1 > 125.585 ))
6 0.1 0.1 peak 40 volume 113.77760 ppm1 8.129 ppm2 4.235
 
! ############### hot_gnoesyNhsqc_051903.41 NOT folded
assi (attr store1 < 4.042 and attr store1 > 3.942 ) 
     ((attr store1 < 8.159 and attr store1 > 8.099 ) and bondedto
      (attr store1 < 126.381  and attr store1 > 125.581 ))
6 0.1 0.1 peak 41 volume 143.69789 ppm1 8.129 ppm2 3.992
 
! ############### hot_gnoesyNhsqc_051903.42 NOT folded
assi (attr store1 < 2.709 and attr store1 > 2.609 ) 
     ((attr store1 < 8.157 and attr store1 > 8.097 ) and bondedto
      (attr store1 < 126.326  and attr store1 > 125.526 ))
6 0.1 0.1 peak 42 volume 7.19347 ppm1 8.127 ppm2 2.659
 
! ############### hot_gnoesyNhsqc_051903.43 NOT folded
assi (attr store1 < 2.575 and attr store1 > 2.475 ) 
     ((attr store1 < 8.159 and attr store1 > 8.099 ) and bondedto
      (attr store1 < 126.334  and attr store1 > 125.534 ))
6 0.1 0.1 peak 43 volume 6.51499 ppm1 8.129 ppm2 2.525
 
! ############### hot_gnoesyNhsqc_051903.44 NOT folded
assi (attr store1 < 1.901 and attr store1 > 1.801 ) 
     ((attr store1 < 8.16 and attr store1 > 8.1 ) and bondedto
      (attr store1 < 126.38  and attr store1 > 125.58 ))
6 0.1 0.1 peak 44 volume 73.78391 ppm1 8.130 ppm2 1.851
 
! ############### hot_gnoesyNhsqc_051903.45 NOT folded
assi (attr store1 < 1.44 and attr store1 > 1.34 ) 
     ((attr store1 < 8.16 and attr store1 > 8.1 ) and bondedto
      (attr store1 < 126.385  and attr store1 > 125.585 ))
6 0.1 0.1 peak 45 volume 264.95819 ppm1 8.130 ppm2 1.390
 
! ############### hot_gnoesyNhsqc_051903.46 NOT folded
assi (attr store1 < 0.921 and attr store1 > 0.821 ) 
     ((attr store1 < 8.159 and attr store1 > 8.099 ) and bondedto
      (attr store1 < 126.383  and attr store1 > 125.583 ))
6 0.1 0.1 peak 46 volume 59.69775 ppm1 8.129 ppm2 0.871
 
! ############### hot_gnoesyNhsqc_051903.47 NOT folded
assi (attr store1 < 4.778 and attr store1 > 4.678 ) 
     ((attr store1 < 8.332 and attr store1 > 8.272 ) and bondedto
      (attr store1 < 125.615  and attr store1 > 124.815 ))
6 0.1 0.1 peak 47 volume 25.75602 ppm1 8.302 ppm2 4.728
 
! ############### hot_gnoesyNhsqc_051903.48 NOT folded
assi (attr store1 < 5.097 and attr store1 > 4.997 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 125.375  and attr store1 > 124.575 ))
6 0.1 0.1 peak 48 volume 16.69783 ppm1 7.992 ppm2 5.047
 
! ############### hot_gnoesyNhsqc_051903.49 NOT folded
assi (attr store1 < 4.823 and attr store1 > 4.723 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 125.372  and attr store1 > 124.572 ))
6 0.1 0.1 peak 49 volume 28.87876 ppm1 7.992 ppm2 4.773
 
! ############### hot_gnoesyNhsqc_051903.51 NOT folded
assi (attr store1 < 4.141 and attr store1 > 4.041 ) 
     ((attr store1 < 8.02 and attr store1 > 7.96 ) and bondedto
      (attr store1 < 125.364  and attr store1 > 124.564 ))
6 0.1 0.1 peak 51 volume 12.95216 ppm1 7.990 ppm2 4.091
 
! ############### hot_gnoesyNhsqc_051903.52 NOT folded
assi (attr store1 < 3.713 and attr store1 > 3.613 ) 
     ((attr store1 < 8.02 and attr store1 > 7.96 ) and bondedto
      (attr store1 < 125.372  and attr store1 > 124.572 ))
6 0.1 0.1 peak 52 volume 6.07315 ppm1 7.990 ppm2 3.663
 
! ############### hot_gnoesyNhsqc_051903.53 NOT folded
assi (attr store1 < 3.398 and attr store1 > 3.298 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 125.362  and attr store1 > 124.562 ))
6 0.1 0.1 peak 53 volume 38.82393 ppm1 7.992 ppm2 3.348
 
! ############### hot_gnoesyNhsqc_051903.54 NOT folded
assi (attr store1 < 3.075 and attr store1 > 2.975 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 125.362  and attr store1 > 124.562 ))
6 0.1 0.1 peak 54 volume 33.49337 ppm1 7.992 ppm2 3.025
 
! ############### hot_gnoesyNhsqc_051903.55 NOT folded
assi (attr store1 < 2.392 and attr store1 > 2.292 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 125.37  and attr store1 > 124.57 ))
6 0.1 0.1 peak 55 volume 6.22673 ppm1 7.993 ppm2 2.342
 
! ############### hot_gnoesyNhsqc_051903.56 NOT folded
assi (attr store1 < 2.201 and attr store1 > 2.101 ) 
     ((attr store1 < 8.021 and attr store1 > 7.961 ) and bondedto
      (attr store1 < 125.36  and attr store1 > 124.56 ))
6 0.1 0.1 peak 56 volume 13.26483 ppm1 7.991 ppm2 2.151
 
! ############### hot_gnoesyNhsqc_051903.57 NOT folded
assi (attr store1 < 2.001 and attr store1 > 1.901 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 125.374  and attr store1 > 124.574 ))
6 0.1 0.1 peak 57 volume 8.22980 ppm1 7.993 ppm2 1.951
 
! ############### hot_gnoesyNhsqc_051903.58 NOT folded
assi (attr store1 < 1.592 and attr store1 > 1.492 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 125.362  and attr store1 > 124.562 ))
6 0.1 0.1 peak 58 volume 14.27215 ppm1 7.992 ppm2 1.542
 
! ############### hot_gnoesyNhsqc_051903.60 NOT folded
assi (attr store1 < 0.831 and attr store1 > 0.731 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 125.37  and attr store1 > 124.57 ))
6 0.1 0.1 peak 60 volume 18.96061 ppm1 7.992 ppm2 0.781
 
! ############### hot_gnoesyNhsqc_051903.61 NOT folded
assi (attr store1 < 4.779 and attr store1 > 4.679 ) 
     ((attr store1 < 8.332 and attr store1 > 8.272 ) and bondedto
      (attr store1 < 124.851  and attr store1 > 124.051 ))
6 0.1 0.1 peak 61 volume 16.44346 ppm1 8.302 ppm2 4.729
 
! ############### hot_gnoesyNhsqc_051903.62 NOT folded
assi (attr store1 < 4.818 and attr store1 > 4.718 ) 
     ((attr store1 < 8.187 and attr store1 > 8.127 ) and bondedto
      (attr store1 < 124.943  and attr store1 > 124.143 ))
6 0.1 0.1 peak 62 volume 6.96200 ppm1 8.157 ppm2 4.768
 
! ############### hot_gnoesyNhsqc_051903.63 NOT folded
assi (attr store1 < 4.833 and attr store1 > 4.733 ) 
     ((attr store1 < 8.163 and attr store1 > 8.103 ) and bondedto
      (attr store1 < 124.867  and attr store1 > 124.067 ))
6 0.1 0.1 peak 63 volume 5.63259 ppm1 8.133 ppm2 4.783
 
! ############### hot_gnoesyNhsqc_051903.64 NOT folded
assi (attr store1 < 4.82 and attr store1 > 4.72 ) 
     ((attr store1 < 8.933 and attr store1 > 8.873 ) and bondedto
      (attr store1 < 124.602  and attr store1 > 123.802 ))
6 0.1 0.1 peak 64 volume 27.35775 ppm1 8.903 ppm2 4.770
 
! ############### hot_gnoesyNhsqc_051903.65 NOT folded
assi (attr store1 < 4.384 and attr store1 > 4.284 ) 
     ((attr store1 < 8.933 and attr store1 > 8.873 ) and bondedto
      (attr store1 < 124.601  and attr store1 > 123.801 ))
6 0.1 0.1 peak 65 volume 99.86605 ppm1 8.903 ppm2 4.334
 
! ############### hot_gnoesyNhsqc_051903.66 NOT folded
assi (attr store1 < 3.896 and attr store1 > 3.796 ) 
     ((attr store1 < 8.932 and attr store1 > 8.872 ) and bondedto
      (attr store1 < 124.642  and attr store1 > 123.842 ))
6 0.1 0.1 peak 66 volume 6.57746 ppm1 8.902 ppm2 3.846
 
! ############### hot_gnoesyNhsqc_051903.67 NOT folded
assi (attr store1 < 2.5 and attr store1 > 2.4 ) 
     ((attr store1 < 8.933 and attr store1 > 8.873 ) and bondedto
      (attr store1 < 124.603  and attr store1 > 123.803 ))
6 0.1 0.1 peak 67 volume 25.29142 ppm1 8.903 ppm2 2.450
 
! ############### hot_gnoesyNhsqc_051903.68 NOT folded
assi (attr store1 < 2.353 and attr store1 > 2.253 ) 
     ((attr store1 < 8.933 and attr store1 > 8.873 ) and bondedto
      (attr store1 < 124.598  and attr store1 > 123.798 ))
6 0.1 0.1 peak 68 volume 42.68480 ppm1 8.903 ppm2 2.303
 
! ############### hot_gnoesyNhsqc_051903.69 NOT folded
assi (attr store1 < 2.125 and attr store1 > 2.025 ) 
     ((attr store1 < 8.933 and attr store1 > 8.873 ) and bondedto
      (attr store1 < 124.598  and attr store1 > 123.798 ))
6 0.1 0.1 peak 69 volume 83.83173 ppm1 8.903 ppm2 2.075
 
! ############### hot_gnoesyNhsqc_051903.70 NOT folded
assi (attr store1 < 1.843 and attr store1 > 1.743 ) 
     ((attr store1 < 8.932 and attr store1 > 8.872 ) and bondedto
      (attr store1 < 124.608  and attr store1 > 123.808 ))
6 0.1 0.1 peak 70 volume 20.76164 ppm1 8.902 ppm2 1.793
 
! ############### hot_gnoesyNhsqc_051903.71 NOT folded
assi (attr store1 < 4.83 and attr store1 > 4.73 ) 
     ((attr store1 < 8.609 and attr store1 > 8.549 ) and bondedto
      (attr store1 < 124.766  and attr store1 > 123.966 ))
6 0.1 0.1 peak 71 volume 31.65258 ppm1 8.579 ppm2 4.780
 
! ############### hot_gnoesyNhsqc_051903.72 NOT folded
assi (attr store1 < 4.297 and attr store1 > 4.197 ) 
     ((attr store1 < 8.611 and attr store1 > 8.551 ) and bondedto
      (attr store1 < 124.715  and attr store1 > 123.915 ))
6 0.1 0.1 peak 72 volume 5.79133 ppm1 8.581 ppm2 4.247
 
! ############### hot_gnoesyNhsqc_051903.73 NOT folded
assi (attr store1 < 1.415 and attr store1 > 1.315 ) 
     ((attr store1 < 8.609 and attr store1 > 8.549 ) and bondedto
      (attr store1 < 124.755  and attr store1 > 123.955 ))
6 0.1 0.1 peak 73 volume 14.36140 ppm1 8.579 ppm2 1.365
 
! ############### hot_gnoesyNhsqc_051903.74 NOT folded
assi (attr store1 < 3.703 and attr store1 > 3.603 ) 
     ((attr store1 < 8.932 and attr store1 > 8.872 ) and bondedto
      (attr store1 < 124.545  and attr store1 > 123.745 ))
6 0.1 0.1 peak 74 volume 35.51910 ppm1 8.902 ppm2 3.653
 
! ############### hot_gnoesyNhsqc_051903.75 NOT folded
assi (attr store1 < 3.223 and attr store1 > 3.123 ) 
     ((attr store1 < 8.931 and attr store1 > 8.871 ) and bondedto
      (attr store1 < 124.515  and attr store1 > 123.715 ))
6 0.1 0.1 peak 75 volume 6.05804 ppm1 8.901 ppm2 3.173
 
! ############### hot_gnoesyNhsqc_051903.76 NOT folded
assi (attr store1 < 1.561 and attr store1 > 1.461 ) 
     ((attr store1 < 8.93 and attr store1 > 8.87 ) and bondedto
      (attr store1 < 124.516  and attr store1 > 123.716 ))
6 0.1 0.1 peak 76 volume 5.15161 ppm1 8.900 ppm2 1.511
 
! ############### hot_gnoesyNhsqc_051903.78 NOT folded
assi (attr store1 < 4.695 and attr store1 > 4.595 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 124.195  and attr store1 > 123.395 ))
6 0.1 0.1 peak 78 volume 10.44934 ppm1 8.618 ppm2 4.645
 
! ############### hot_gnoesyNhsqc_051903.79 NOT folded
assi (attr store1 < 4.571 and attr store1 > 4.471 ) 
     ((attr store1 < 8.649 and attr store1 > 8.589 ) and bondedto
      (attr store1 < 124.143  and attr store1 > 123.343 ))
6 0.1 0.1 peak 79 volume 7.55131 ppm1 8.619 ppm2 4.521
 
! ############### hot_gnoesyNhsqc_051903.80 NOT folded
assi (attr store1 < 4.335 and attr store1 > 4.235 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 124.113  and attr store1 > 123.313 ))
6 0.1 0.1 peak 80 volume 5.54644 ppm1 8.618 ppm2 4.285
 
! ############### hot_gnoesyNhsqc_051903.82 NOT folded
assi (attr store1 < 3.89 and attr store1 > 3.79 ) 
     ((attr store1 < 8.649 and attr store1 > 8.589 ) and bondedto
      (attr store1 < 124.195  and attr store1 > 123.395 ))
6 0.1 0.1 peak 82 volume 19.65127 ppm1 8.619 ppm2 3.840
 
! ############### hot_gnoesyNhsqc_051903.83 NOT folded
assi (attr store1 < 3.268 and attr store1 > 3.168 ) 
     ((attr store1 < 8.646 and attr store1 > 8.586 ) and bondedto
      (attr store1 < 124.197  and attr store1 > 123.397 ))
6 0.1 0.1 peak 83 volume 8.52639 ppm1 8.616 ppm2 3.218
 
! ############### hot_gnoesyNhsqc_051903.84 NOT folded
assi (attr store1 < 3.092 and attr store1 > 2.992 ) 
     ((attr store1 < 8.647 and attr store1 > 8.587 ) and bondedto
      (attr store1 < 124.209  and attr store1 > 123.409 ))
6 0.1 0.1 peak 84 volume 24.41137 ppm1 8.617 ppm2 3.042
 
! ############### hot_gnoesyNhsqc_051903.85 NOT folded
assi (attr store1 < 2.533 and attr store1 > 2.433 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 124.21  and attr store1 > 123.41 ))
6 0.1 0.1 peak 85 volume 38.73583 ppm1 8.618 ppm2 2.483
 
! ############### hot_gnoesyNhsqc_051903.86 NOT folded
assi (attr store1 < 2.357 and attr store1 > 2.257 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 124.197  and attr store1 > 123.397 ))
6 0.1 0.1 peak 86 volume 8.77439 ppm1 8.618 ppm2 2.307
 
! ############### hot_gnoesyNhsqc_051903.87 NOT folded
assi (attr store1 < 2.159 and attr store1 > 2.059 ) 
     ((attr store1 < 8.641 and attr store1 > 8.581 ) and bondedto
      (attr store1 < 124.2  and attr store1 > 123.4 ))
6 0.1 0.1 peak 87 volume 5.36753 ppm1 8.611 ppm2 2.109
 
! ############### hot_gnoesyNhsqc_051903.88 NOT folded
assi (attr store1 < 2.083 and attr store1 > 1.983 ) 
     ((attr store1 < 8.65 and attr store1 > 8.59 ) and bondedto
      (attr store1 < 124.258  and attr store1 > 123.458 ))
6 0.1 0.1 peak 88 volume 5.39749 ppm1 8.620 ppm2 2.033
 
! ############### hot_gnoesyNhsqc_051903.89 NOT folded
assi (attr store1 < 1.833 and attr store1 > 1.733 ) 
     ((attr store1 < 8.647 and attr store1 > 8.587 ) and bondedto
      (attr store1 < 124.167  and attr store1 > 123.367 ))
6 0.1 0.1 peak 89 volume 9.23804 ppm1 8.617 ppm2 1.783
 
! ############### hot_gnoesyNhsqc_051903.90 NOT folded
assi (attr store1 < 0.985 and attr store1 > 0.885 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 124.179  and attr store1 > 123.379 ))
6 0.1 0.1 peak 90 volume 12.66322 ppm1 8.618 ppm2 0.935
 
! ############### hot_gnoesyNhsqc_051903.91 NOT folded
assi (attr store1 < 4.935 and attr store1 > 4.835 ) 
     ((attr store1 < 8.384 and attr store1 > 8.324 ) and bondedto
      (attr store1 < 124.175  and attr store1 > 123.375 ))
6 0.1 0.1 peak 91 volume 40.59521 ppm1 8.354 ppm2 4.885
 
! ############### hot_gnoesyNhsqc_051903.92 NOT folded
assi (attr store1 < 4.823 and attr store1 > 4.723 ) 
     ((attr store1 < 8.387 and attr store1 > 8.327 ) and bondedto
      (attr store1 < 124.158  and attr store1 > 123.358 ))
6 0.1 0.1 peak 92 volume 251.57527 ppm1 8.357 ppm2 4.773
 
! ############### hot_gnoesyNhsqc_051903.93 NOT folded
assi (attr store1 < 4.672 and attr store1 > 4.572 ) 
     ((attr store1 < 8.384 and attr store1 > 8.324 ) and bondedto
      (attr store1 < 124.125  and attr store1 > 123.325 ))
6 0.1 0.1 peak 93 volume 6.33941 ppm1 8.354 ppm2 4.622
 
! ############### hot_gnoesyNhsqc_051903.94 NOT folded
assi (attr store1 < 4.527 and attr store1 > 4.427 ) 
     ((attr store1 < 8.387 and attr store1 > 8.327 ) and bondedto
      (attr store1 < 124.16  and attr store1 > 123.36 ))
6 0.1 0.1 peak 94 volume 129.76833 ppm1 8.357 ppm2 4.477
 
! ############### hot_gnoesyNhsqc_051903.95 NOT folded
assi (attr store1 < 3.897 and attr store1 > 3.797 ) 
     ((attr store1 < 8.387 and attr store1 > 8.327 ) and bondedto
      (attr store1 < 124.155  and attr store1 > 123.355 ))
6 0.1 0.1 peak 95 volume 61.61858 ppm1 8.357 ppm2 3.847
 
! ############### hot_gnoesyNhsqc_051903.96 NOT folded
assi (attr store1 < 3.012 and attr store1 > 2.912 ) 
     ((attr store1 < 8.385 and attr store1 > 8.325 ) and bondedto
      (attr store1 < 124.166  and attr store1 > 123.366 ))
6 0.1 0.1 peak 96 volume 5.15583 ppm1 8.355 ppm2 2.962
 
! ############### hot_gnoesyNhsqc_051903.97 NOT folded
assi (attr store1 < 2.83 and attr store1 > 2.73 ) 
     ((attr store1 < 8.387 and attr store1 > 8.327 ) and bondedto
      (attr store1 < 124.161  and attr store1 > 123.361 ))
6 0.1 0.1 peak 97 volume 75.48819 ppm1 8.357 ppm2 2.780
 
! ############### hot_gnoesyNhsqc_051903.98 NOT folded
assi (attr store1 < 2.612 and attr store1 > 2.512 ) 
     ((attr store1 < 8.387 and attr store1 > 8.327 ) and bondedto
      (attr store1 < 124.157  and attr store1 > 123.357 ))
6 0.1 0.1 peak 98 volume 95.20405 ppm1 8.357 ppm2 2.562
 
! ############### hot_gnoesyNhsqc_051903.99 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.175 and attr store1 > 8.115 ) and bondedto
      (attr store1 < 123.944  and attr store1 > 123.144 ))
6 0.1 0.1 peak 99 volume 309.83005 ppm1 8.145 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.100 NOT folded
assi (attr store1 < 4.605 and attr store1 > 4.505 ) 
     ((attr store1 < 8.175 and attr store1 > 8.115 ) and bondedto
      (attr store1 < 123.935  and attr store1 > 123.135 ))
6 0.1 0.1 peak 100 volume 102.94584 ppm1 8.145 ppm2 4.555
 
! ############### hot_gnoesyNhsqc_051903.101 NOT folded
assi (attr store1 < 4.331 and attr store1 > 4.231 ) 
     ((attr store1 < 8.174 and attr store1 > 8.114 ) and bondedto
      (attr store1 < 123.942  and attr store1 > 123.142 ))
6 0.1 0.1 peak 101 volume 67.46031 ppm1 8.144 ppm2 4.281
 
! ############### hot_gnoesyNhsqc_051903.102 NOT folded
assi (attr store1 < 2.698 and attr store1 > 2.598 ) 
     ((attr store1 < 8.176 and attr store1 > 8.116 ) and bondedto
      (attr store1 < 123.924  and attr store1 > 123.124 ))
6 0.1 0.1 peak 102 volume 25.53315 ppm1 8.146 ppm2 2.648
 
! ############### hot_gnoesyNhsqc_051903.103 NOT folded
assi (attr store1 < 1.447 and attr store1 > 1.347 ) 
     ((attr store1 < 8.175 and attr store1 > 8.115 ) and bondedto
      (attr store1 < 123.936  and attr store1 > 123.136 ))
6 0.1 0.1 peak 103 volume 114.31741 ppm1 8.145 ppm2 1.397
 
! ############### hot_gnoesyNhsqc_051903.104 NOT folded
assi (attr store1 < 1.37 and attr store1 > 1.27 ) 
     ((attr store1 < 8.059 and attr store1 > 7.999 ) and bondedto
      (attr store1 < 123.979  and attr store1 > 123.179 ))
6 0.1 0.1 peak 104 volume 6.29410 ppm1 8.029 ppm2 1.320
 
! ############### hot_gnoesyNhsqc_051903.105 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.333 and attr store1 > 8.273 ) and bondedto
      (attr store1 < 123.819  and attr store1 > 123.019 ))
6 0.1 0.1 peak 105 volume 28.54496 ppm1 8.303 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.106 NOT folded
assi (attr store1 < 4.333 and attr store1 > 4.233 ) 
     ((attr store1 < 8.333 and attr store1 > 8.273 ) and bondedto
      (attr store1 < 123.681  and attr store1 > 122.881 ))
6 0.1 0.1 peak 106 volume 19.75448 ppm1 8.303 ppm2 4.283
 
! ############### hot_gnoesyNhsqc_051903.107 NOT folded
assi (attr store1 < 1.815 and attr store1 > 1.715 ) 
     ((attr store1 < 8.331 and attr store1 > 8.271 ) and bondedto
      (attr store1 < 123.693  and attr store1 > 122.893 ))
6 0.1 0.1 peak 107 volume 5.85501 ppm1 8.301 ppm2 1.765
 
! ############### hot_gnoesyNhsqc_051903.108 NOT folded
assi (attr store1 < 5.099 and attr store1 > 4.999 ) 
     ((attr store1 < 7.56 and attr store1 > 7.5 ) and bondedto
      (attr store1 < 123.818  and attr store1 > 123.018 ))
6 0.1 0.1 peak 108 volume 15.11095 ppm1 7.530 ppm2 5.049
 
! ############### hot_gnoesyNhsqc_051903.109 NOT folded
assi (attr store1 < 4.814 and attr store1 > 4.714 ) 
     ((attr store1 < 7.561 and attr store1 > 7.501 ) and bondedto
      (attr store1 < 123.821  and attr store1 > 123.021 ))
6 0.1 0.1 peak 109 volume 16.56759 ppm1 7.531 ppm2 4.764
 
! ############### hot_gnoesyNhsqc_051903.110 NOT folded
assi (attr store1 < 4.42 and attr store1 > 4.32 ) 
     ((attr store1 < 7.562 and attr store1 > 7.502 ) and bondedto
      (attr store1 < 123.829  and attr store1 > 123.029 ))
6 0.1 0.1 peak 110 volume 8.49818 ppm1 7.532 ppm2 4.370
 
! ############### hot_gnoesyNhsqc_051903.111 NOT folded
assi (attr store1 < 4.019 and attr store1 > 3.919 ) 
     ((attr store1 < 7.558 and attr store1 > 7.498 ) and bondedto
      (attr store1 < 123.835  and attr store1 > 123.035 ))
6 0.1 0.1 peak 111 volume 27.59788 ppm1 7.528 ppm2 3.969
 
! ############### hot_gnoesyNhsqc_051903.112 NOT folded
assi (attr store1 < 3.213 and attr store1 > 3.113 ) 
     ((attr store1 < 7.558 and attr store1 > 7.498 ) and bondedto
      (attr store1 < 123.83  and attr store1 > 123.03 ))
6 0.1 0.1 peak 112 volume 15.50453 ppm1 7.528 ppm2 3.163
 
! ############### hot_gnoesyNhsqc_051903.113 NOT folded
assi (attr store1 < 2.356 and attr store1 > 2.256 ) 
     ((attr store1 < 7.56 and attr store1 > 7.5 ) and bondedto
      (attr store1 < 123.8  and attr store1 > 123.0 ))
6 0.1 0.1 peak 113 volume 8.18126 ppm1 7.530 ppm2 2.306
 
! ############### hot_gnoesyNhsqc_051903.114 NOT folded
assi (attr store1 < 1.972 and attr store1 > 1.872 ) 
     ((attr store1 < 7.559 and attr store1 > 7.499 ) and bondedto
      (attr store1 < 123.826  and attr store1 > 123.026 ))
6 0.1 0.1 peak 114 volume 86.79139 ppm1 7.529 ppm2 1.922
 
! ############### hot_gnoesyNhsqc_051903.116 NOT folded
assi (attr store1 < 0.833 and attr store1 > 0.733 ) 
     ((attr store1 < 7.56 and attr store1 > 7.5 ) and bondedto
      (attr store1 < 123.827  and attr store1 > 123.027 ))
6 0.1 0.1 peak 116 volume 10.77987 ppm1 7.530 ppm2 0.783
 
! ############### hot_gnoesyNhsqc_051903.118 NOT folded
assi (attr store1 < 4.819 and attr store1 > 4.719 ) 
     ((attr store1 < 8.086 and attr store1 > 8.026 ) and bondedto
      (attr store1 < 123.464  and attr store1 > 122.664 ))
6 0.1 0.1 peak 118 volume 28.63540 ppm1 8.056 ppm2 4.769
 
! ############### hot_gnoesyNhsqc_051903.119 NOT folded
assi (attr store1 < 4.687 and attr store1 > 4.587 ) 
     ((attr store1 < 8.084 and attr store1 > 8.024 ) and bondedto
      (attr store1 < 123.573  and attr store1 > 122.773 ))
6 0.1 0.1 peak 119 volume 45.94072 ppm1 8.054 ppm2 4.637
 
! ############### hot_gnoesyNhsqc_051903.120 NOT folded
assi (attr store1 < 4.345 and attr store1 > 4.245 ) 
     ((attr store1 < 8.084 and attr store1 > 8.024 ) and bondedto
      (attr store1 < 123.554  and attr store1 > 122.754 ))
6 0.1 0.1 peak 120 volume 119.75188 ppm1 8.054 ppm2 4.295
 
! ############### hot_gnoesyNhsqc_051903.123 NOT folded
assi (attr store1 < 2.432 and attr store1 > 2.332 ) 
     ((attr store1 < 8.085 and attr store1 > 8.025 ) and bondedto
      (attr store1 < 123.567  and attr store1 > 122.767 ))
6 0.1 0.1 peak 123 volume 26.24711 ppm1 8.055 ppm2 2.382
 
! ############### hot_gnoesyNhsqc_051903.124 NOT folded
assi (attr store1 < 2.202 and attr store1 > 2.102 ) 
     ((attr store1 < 8.085 and attr store1 > 8.025 ) and bondedto
      (attr store1 < 123.573  and attr store1 > 122.773 ))
6 0.1 0.1 peak 124 volume 25.72441 ppm1 8.055 ppm2 2.152
 
! ############### hot_gnoesyNhsqc_051903.125 NOT folded
assi (attr store1 < 2.067 and attr store1 > 1.967 ) 
     ((attr store1 < 8.082 and attr store1 > 8.022 ) and bondedto
      (attr store1 < 123.56  and attr store1 > 122.76 ))
6 0.1 0.1 peak 125 volume 34.75428 ppm1 8.052 ppm2 2.017
 
! ############### hot_gnoesyNhsqc_051903.126 NOT folded
assi (attr store1 < 1.803 and attr store1 > 1.703 ) 
     ((attr store1 < 8.084 and attr store1 > 8.024 ) and bondedto
      (attr store1 < 123.572  and attr store1 > 122.772 ))
6 0.1 0.1 peak 126 volume 111.46393 ppm1 8.054 ppm2 1.753
 
! ############### hot_gnoesyNhsqc_051903.127 NOT folded
assi (attr store1 < 1.59 and attr store1 > 1.49 ) 
     ((attr store1 < 8.084 and attr store1 > 8.024 ) and bondedto
      (attr store1 < 123.567  and attr store1 > 122.767 ))
6 0.1 0.1 peak 127 volume 58.38450 ppm1 8.054 ppm2 1.540
 
! ############### hot_gnoesyNhsqc_051903.131 NOT folded
assi (attr store1 < 3.928 and attr store1 > 3.828 ) 
     ((attr store1 < 9.19 and attr store1 > 9.13 ) and bondedto
      (attr store1 < 123.206  and attr store1 > 122.406 ))
6 0.1 0.1 peak 131 volume 13.35621 ppm1 9.160 ppm2 3.878
 
! ############### hot_gnoesyNhsqc_051903.132 NOT folded
assi (attr store1 < 2.653 and attr store1 > 2.553 ) 
     ((attr store1 < 9.189 and attr store1 > 9.129 ) and bondedto
      (attr store1 < 123.187  and attr store1 > 122.387 ))
6 0.1 0.1 peak 132 volume 8.25861 ppm1 9.159 ppm2 2.603
 
! ############### hot_gnoesyNhsqc_051903.133 NOT folded
assi (attr store1 < 2.22 and attr store1 > 2.12 ) 
     ((attr store1 < 9.189 and attr store1 > 9.129 ) and bondedto
      (attr store1 < 123.206  and attr store1 > 122.406 ))
6 0.1 0.1 peak 133 volume 10.10518 ppm1 9.159 ppm2 2.170
 
! ############### hot_gnoesyNhsqc_051903.135 NOT folded
assi (attr store1 < 1.369 and attr store1 > 1.269 ) 
     ((attr store1 < 9.189 and attr store1 > 9.129 ) and bondedto
      (attr store1 < 123.177  and attr store1 > 122.377 ))
6 0.1 0.1 peak 135 volume 14.10770 ppm1 9.159 ppm2 1.319
 
! ############### hot_gnoesyNhsqc_051903.137 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.705 and attr store1 > 8.645 ) and bondedto
      (attr store1 < 123.229  and attr store1 > 122.429 ))
6 0.1 0.1 peak 137 volume 48.75075 ppm1 8.675 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.138 NOT folded
assi (attr store1 < 4.471 and attr store1 > 4.371 ) 
     ((attr store1 < 8.706 and attr store1 > 8.646 ) and bondedto
      (attr store1 < 123.224  and attr store1 > 122.424 ))
6 0.1 0.1 peak 138 volume 36.46491 ppm1 8.676 ppm2 4.421
 
! ############### hot_gnoesyNhsqc_051903.139 NOT folded
assi (attr store1 < 4.204 and attr store1 > 4.104 ) 
     ((attr store1 < 8.707 and attr store1 > 8.647 ) and bondedto
      (attr store1 < 123.226  and attr store1 > 122.426 ))
6 0.1 0.1 peak 139 volume 23.63623 ppm1 8.677 ppm2 4.154
 
! ############### hot_gnoesyNhsqc_051903.140 NOT folded
assi (attr store1 < 3.995 and attr store1 > 3.895 ) 
     ((attr store1 < 8.706 and attr store1 > 8.646 ) and bondedto
      (attr store1 < 123.225  and attr store1 > 122.425 ))
6 0.1 0.1 peak 140 volume 32.20965 ppm1 8.676 ppm2 3.945
 
! ############### hot_gnoesyNhsqc_051903.141 NOT folded
assi (attr store1 < 2.461 and attr store1 > 2.361 ) 
     ((attr store1 < 8.705 and attr store1 > 8.645 ) and bondedto
      (attr store1 < 123.215  and attr store1 > 122.415 ))
6 0.1 0.1 peak 141 volume 20.67569 ppm1 8.675 ppm2 2.411
 
! ############### hot_gnoesyNhsqc_051903.142 NOT folded
assi (attr store1 < 2.198 and attr store1 > 2.098 ) 
     ((attr store1 < 8.706 and attr store1 > 8.646 ) and bondedto
      (attr store1 < 123.222  and attr store1 > 122.422 ))
6 0.1 0.1 peak 142 volume 33.16558 ppm1 8.676 ppm2 2.148
 
! ############### hot_gnoesyNhsqc_051903.143 NOT folded
assi (attr store1 < 2.126 and attr store1 > 2.026 ) 
     ((attr store1 < 8.705 and attr store1 > 8.645 ) and bondedto
      (attr store1 < 123.224  and attr store1 > 122.424 ))
6 0.1 0.1 peak 143 volume 35.78231 ppm1 8.675 ppm2 2.076
 
! ############### hot_gnoesyNhsqc_051903.144 NOT folded
assi (attr store1 < 4.555 and attr store1 > 4.455 ) 
     ((attr store1 < 8.409 and attr store1 > 8.349 ) and bondedto
      (attr store1 < 123.252  and attr store1 > 122.452 ))
6 0.1 0.1 peak 144 volume 7.98474 ppm1 8.379 ppm2 4.505
 
! ############### hot_gnoesyNhsqc_051903.145 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.381 and attr store1 > 8.321 ) and bondedto
      (attr store1 < 123.253  and attr store1 > 122.453 ))
6 0.1 0.1 peak 145 volume 7.64391 ppm1 8.351 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.146 NOT folded
assi (attr store1 < 4.58 and attr store1 > 4.48 ) 
     ((attr store1 < 8.276 and attr store1 > 8.216 ) and bondedto
      (attr store1 < 123.284  and attr store1 > 122.484 ))
6 0.1 0.1 peak 146 volume 17.03090 ppm1 8.246 ppm2 4.530
 
! ############### hot_gnoesyNhsqc_051903.147 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.239 and attr store1 > 8.179 ) and bondedto
      (attr store1 < 123.201  and attr store1 > 122.401 ))
6 0.1 0.1 peak 147 volume 321.41083 ppm1 8.209 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.148 NOT folded
assi (attr store1 < 4.326 and attr store1 > 4.226 ) 
     ((attr store1 < 8.24 and attr store1 > 8.18 ) and bondedto
      (attr store1 < 123.205  and attr store1 > 122.405 ))
6 0.1 0.1 peak 148 volume 234.29518 ppm1 8.210 ppm2 4.276
 
! ############### hot_gnoesyNhsqc_051903.149 NOT folded
assi (attr store1 < 2.332 and attr store1 > 2.232 ) 
     ((attr store1 < 8.241 and attr store1 > 8.181 ) and bondedto
      (attr store1 < 123.202  and attr store1 > 122.402 ))
6 0.1 0.1 peak 149 volume 12.98280 ppm1 8.211 ppm2 2.282
 
! ############### hot_gnoesyNhsqc_051903.150 NOT folded
assi (attr store1 < 1.818 and attr store1 > 1.718 ) 
     ((attr store1 < 8.239 and attr store1 > 8.179 ) and bondedto
      (attr store1 < 123.192  and attr store1 > 122.392 ))
6 0.1 0.1 peak 150 volume 78.36198 ppm1 8.209 ppm2 1.768
 
! ############### hot_gnoesyNhsqc_051903.151 NOT folded
assi (attr store1 < 4.823 and attr store1 > 4.723 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 123.183  and attr store1 > 122.383 ))
6 0.1 0.1 peak 151 volume 247.92780 ppm1 8.162 ppm2 4.773
 
! ############### hot_gnoesyNhsqc_051903.152 NOT folded
assi (attr store1 < 4.462 and attr store1 > 4.362 ) 
     ((attr store1 < 8.191 and attr store1 > 8.131 ) and bondedto
      (attr store1 < 123.172  and attr store1 > 122.372 ))
6 0.1 0.1 peak 152 volume 156.35493 ppm1 8.161 ppm2 4.412
 
! ############### hot_gnoesyNhsqc_051903.153 NOT folded
assi (attr store1 < 1.617 and attr store1 > 1.517 ) 
     ((attr store1 < 9.183 and attr store1 > 9.123 ) and bondedto
      (attr store1 < 123.131  and attr store1 > 122.331 ))
6 0.1 0.1 peak 153 volume 6.91533 ppm1 9.153 ppm2 1.567
 
! ############### hot_gnoesyNhsqc_051903.154 NOT folded
assi (attr store1 < 0.962 and attr store1 > 0.862 ) 
     ((attr store1 < 9.184 and attr store1 > 9.124 ) and bondedto
      (attr store1 < 123.15  and attr store1 > 122.35 ))
6 0.1 0.1 peak 154 volume 13.09208 ppm1 9.154 ppm2 0.912
 
! ############### hot_gnoesyNhsqc_051903.155 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.483 and attr store1 > 8.423 ) and bondedto
      (attr store1 < 123.007  and attr store1 > 122.207 ))
6 0.1 0.1 peak 155 volume 157.49913 ppm1 8.453 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.156 NOT folded
assi (attr store1 < 4.427 and attr store1 > 4.327 ) 
     ((attr store1 < 8.483 and attr store1 > 8.423 ) and bondedto
      (attr store1 < 123.009  and attr store1 > 122.209 ))
6 0.1 0.1 peak 156 volume 176.32692 ppm1 8.453 ppm2 4.377
 
! ############### hot_gnoesyNhsqc_051903.157 NOT folded
assi (attr store1 < 4.271 and attr store1 > 4.171 ) 
     ((attr store1 < 8.483 and attr store1 > 8.423 ) and bondedto
      (attr store1 < 123.008  and attr store1 > 122.208 ))
6 0.1 0.1 peak 157 volume 106.70486 ppm1 8.453 ppm2 4.221
 
! ############### hot_gnoesyNhsqc_051903.158 NOT folded
assi (attr store1 < 3.864 and attr store1 > 3.764 ) 
     ((attr store1 < 8.483 and attr store1 > 8.423 ) and bondedto
      (attr store1 < 122.98  and attr store1 > 122.18 ))
6 0.1 0.1 peak 158 volume 49.94125 ppm1 8.453 ppm2 3.814
 
! ############### hot_gnoesyNhsqc_051903.159 NOT folded
assi (attr store1 < 2.609 and attr store1 > 2.509 ) 
     ((attr store1 < 8.485 and attr store1 > 8.425 ) and bondedto
      (attr store1 < 122.995  and attr store1 > 122.195 ))
6 0.1 0.1 peak 159 volume 10.66255 ppm1 8.455 ppm2 2.559
 
! ############### hot_gnoesyNhsqc_051903.160 NOT folded
assi (attr store1 < 1.331 and attr store1 > 1.231 ) 
     ((attr store1 < 8.483 and attr store1 > 8.423 ) and bondedto
      (attr store1 < 122.999  and attr store1 > 122.199 ))
6 0.1 0.1 peak 160 volume 240.96236 ppm1 8.453 ppm2 1.281
 
! ############### hot_gnoesyNhsqc_051903.161 NOT folded
assi (attr store1 < 3.127 and attr store1 > 3.027 ) 
     ((attr store1 < 8.481 and attr store1 > 8.421 ) and bondedto
      (attr store1 < 122.944  and attr store1 > 122.144 ))
6 0.1 0.1 peak 161 volume 8.66754 ppm1 8.451 ppm2 3.077
 
! ############### hot_gnoesyNhsqc_051903.162 NOT folded
assi (attr store1 < 2.322 and attr store1 > 2.222 ) 
     ((attr store1 < 8.481 and attr store1 > 8.421 ) and bondedto
      (attr store1 < 122.961  and attr store1 > 122.161 ))
6 0.1 0.1 peak 162 volume 38.97509 ppm1 8.451 ppm2 2.272
 
! ############### hot_gnoesyNhsqc_051903.163 NOT folded
assi (attr store1 < 2.068 and attr store1 > 1.968 ) 
     ((attr store1 < 8.48 and attr store1 > 8.42 ) and bondedto
      (attr store1 < 122.957  and attr store1 > 122.157 ))
6 0.1 0.1 peak 163 volume 77.22401 ppm1 8.450 ppm2 2.018
 
! ############### hot_gnoesyNhsqc_051903.164 NOT folded
assi (attr store1 < 1.948 and attr store1 > 1.848 ) 
     ((attr store1 < 8.481 and attr store1 > 8.421 ) and bondedto
      (attr store1 < 122.989  and attr store1 > 122.189 ))
6 0.1 0.1 peak 164 volume 60.05974 ppm1 8.451 ppm2 1.898
 
! ############### hot_gnoesyNhsqc_051903.165 NOT folded
assi (attr store1 < 2.092 and attr store1 > 1.992 ) 
     ((attr store1 < 8.235 and attr store1 > 8.175 ) and bondedto
      (attr store1 < 123.144  and attr store1 > 122.344 ))
6 0.1 0.1 peak 165 volume 20.68162 ppm1 8.205 ppm2 2.042
 
! ############### hot_gnoesyNhsqc_051903.166 NOT folded
assi (attr store1 < 1.464 and attr store1 > 1.364 ) 
     ((attr store1 < 8.239 and attr store1 > 8.179 ) and bondedto
      (attr store1 < 123.17  and attr store1 > 122.37 ))
6 0.1 0.1 peak 166 volume 31.28133 ppm1 8.209 ppm2 1.414
 
! ############### hot_gnoesyNhsqc_051903.168 NOT folded
assi (attr store1 < 4.682 and attr store1 > 4.582 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 123.023  and attr store1 > 122.223 ))
6 0.1 0.1 peak 168 volume 11.90084 ppm1 8.162 ppm2 4.632
 
! ############### hot_gnoesyNhsqc_051903.169 NOT folded
assi (attr store1 < 3.304 and attr store1 > 3.204 ) 
     ((attr store1 < 8.191 and attr store1 > 8.131 ) and bondedto
      (attr store1 < 123.008  and attr store1 > 122.208 ))
6 0.1 0.1 peak 169 volume 7.91503 ppm1 8.161 ppm2 3.254
 
! ############### hot_gnoesyNhsqc_051903.170 NOT folded
assi (attr store1 < 3.116 and attr store1 > 3.016 ) 
     ((attr store1 < 8.194 and attr store1 > 8.134 ) and bondedto
      (attr store1 < 122.986  and attr store1 > 122.186 ))
6 0.1 0.1 peak 170 volume 8.53151 ppm1 8.164 ppm2 3.066
 
! ############### hot_gnoesyNhsqc_051903.171 NOT folded
assi (attr store1 < 2.971 and attr store1 > 2.871 ) 
     ((attr store1 < 8.194 and attr store1 > 8.134 ) and bondedto
      (attr store1 < 123.023  and attr store1 > 122.223 ))
6 0.1 0.1 peak 171 volume 7.30296 ppm1 8.164 ppm2 2.921
 
! ############### hot_gnoesyNhsqc_051903.172 NOT folded
assi (attr store1 < 2.773 and attr store1 > 2.673 ) 
     ((attr store1 < 8.19 and attr store1 > 8.13 ) and bondedto
      (attr store1 < 123.153  and attr store1 > 122.353 ))
6 0.1 0.1 peak 172 volume 43.79465 ppm1 8.160 ppm2 2.723
 
! ############### hot_gnoesyNhsqc_051903.173 NOT folded
assi (attr store1 < 2.67 and attr store1 > 2.57 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 123.144  and attr store1 > 122.344 ))
6 0.1 0.1 peak 173 volume 52.78813 ppm1 8.162 ppm2 2.620
 
! ############### hot_gnoesyNhsqc_051903.174 NOT folded
assi (attr store1 < 2.533 and attr store1 > 2.433 ) 
     ((attr store1 < 8.191 and attr store1 > 8.131 ) and bondedto
      (attr store1 < 123.15  and attr store1 > 122.35 ))
6 0.1 0.1 peak 174 volume 58.58999 ppm1 8.161 ppm2 2.483
 
! ############### hot_gnoesyNhsqc_051903.175 NOT folded
assi (attr store1 < 2.341 and attr store1 > 2.241 ) 
     ((attr store1 < 8.19 and attr store1 > 8.13 ) and bondedto
      (attr store1 < 122.992  and attr store1 > 122.192 ))
6 0.1 0.1 peak 175 volume 6.03523 ppm1 8.160 ppm2 2.291
 
! ############### hot_gnoesyNhsqc_051903.177 NOT folded
assi (attr store1 < 1.427 and attr store1 > 1.327 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 122.967  and attr store1 > 122.167 ))
6 0.1 0.1 peak 177 volume 13.13315 ppm1 8.162 ppm2 1.377
 
! ############### hot_gnoesyNhsqc_051903.178 NOT folded
assi (attr store1 < 4.112 and attr store1 > 4.012 ) 
     ((attr store1 < 8.645 and attr store1 > 8.585 ) and bondedto
      (attr store1 < 122.748  and attr store1 > 121.948 ))
6 0.1 0.1 peak 178 volume 12.03136 ppm1 8.615 ppm2 4.062
 
! ############### hot_gnoesyNhsqc_051903.179 NOT folded
assi (attr store1 < 4.057 and attr store1 > 3.957 ) 
     ((attr store1 < 8.479 and attr store1 > 8.419 ) and bondedto
      (attr store1 < 122.895  and attr store1 > 122.095 ))
6 0.1 0.1 peak 179 volume 31.90956 ppm1 8.449 ppm2 4.007
 
! ############### hot_gnoesyNhsqc_051903.180 NOT folded
assi (attr store1 < 3.551 and attr store1 > 3.451 ) 
     ((attr store1 < 8.475 and attr store1 > 8.415 ) and bondedto
      (attr store1 < 122.872  and attr store1 > 122.072 ))
6 0.1 0.1 peak 180 volume 19.39271 ppm1 8.445 ppm2 3.501
 
! ############### hot_gnoesyNhsqc_051903.181 NOT folded
assi (attr store1 < 2.94 and attr store1 > 2.84 ) 
     ((attr store1 < 8.478 and attr store1 > 8.418 ) and bondedto
      (attr store1 < 122.885  and attr store1 > 122.085 ))
6 0.1 0.1 peak 181 volume 32.00396 ppm1 8.448 ppm2 2.890
 
! ############### hot_gnoesyNhsqc_051903.182 NOT folded
assi (attr store1 < 1.714 and attr store1 > 1.614 ) 
     ((attr store1 < 8.476 and attr store1 > 8.416 ) and bondedto
      (attr store1 < 122.843  and attr store1 > 122.043 ))
6 0.1 0.1 peak 182 volume 17.83150 ppm1 8.446 ppm2 1.664
 
! ############### hot_gnoesyNhsqc_051903.185 NOT folded
assi (attr store1 < 0.753 and attr store1 > 0.653 ) 
     ((attr store1 < 8.478 and attr store1 > 8.418 ) and bondedto
      (attr store1 < 122.875  and attr store1 > 122.075 ))
6 0.1 0.1 peak 185 volume 26.00597 ppm1 8.448 ppm2 0.703
 
! ############### hot_gnoesyNhsqc_051903.186 NOT folded
assi (attr store1 < 3.844 and attr store1 > 3.744 ) 
     ((attr store1 < 8.418 and attr store1 > 8.358 ) and bondedto
      (attr store1 < 122.844  and attr store1 > 122.044 ))
6 0.1 0.1 peak 186 volume 19.98666 ppm1 8.388 ppm2 3.794
 
! ############### hot_gnoesyNhsqc_051903.187 NOT folded
assi (attr store1 < 0.76 and attr store1 > 0.66 ) 
     ((attr store1 < 8.422 and attr store1 > 8.362 ) and bondedto
      (attr store1 < 122.828  and attr store1 > 122.028 ))
6 0.1 0.1 peak 187 volume 12.14145 ppm1 8.392 ppm2 0.710
 
! ############### hot_gnoesyNhsqc_051903.188 NOT folded
assi (attr store1 < 4.016 and attr store1 > 3.916 ) 
     ((attr store1 < 8.416 and attr store1 > 8.356 ) and bondedto
      (attr store1 < 122.832  and attr store1 > 122.032 ))
6 0.1 0.1 peak 188 volume 15.54256 ppm1 8.386 ppm2 3.966
 
! ############### hot_gnoesyNhsqc_051903.189 NOT folded
assi (attr store1 < 3.528 and attr store1 > 3.428 ) 
     ((attr store1 < 8.415 and attr store1 > 8.355 ) and bondedto
      (attr store1 < 122.832  and attr store1 > 122.032 ))
6 0.1 0.1 peak 189 volume 34.66494 ppm1 8.385 ppm2 3.478
 
! ############### hot_gnoesyNhsqc_051903.190 NOT folded
assi (attr store1 < 3.18 and attr store1 > 3.08 ) 
     ((attr store1 < 8.414 and attr store1 > 8.354 ) and bondedto
      (attr store1 < 122.843  and attr store1 > 122.043 ))
6 0.1 0.1 peak 190 volume 10.70840 ppm1 8.384 ppm2 3.130
 
! ############### hot_gnoesyNhsqc_051903.191 NOT folded
assi (attr store1 < 2.299 and attr store1 > 2.199 ) 
     ((attr store1 < 8.413 and attr store1 > 8.353 ) and bondedto
      (attr store1 < 122.837  and attr store1 > 122.037 ))
6 0.1 0.1 peak 191 volume 38.59889 ppm1 8.383 ppm2 2.249
 
! ############### hot_gnoesyNhsqc_051903.192 NOT folded
assi (attr store1 < 1.688 and attr store1 > 1.588 ) 
     ((attr store1 < 8.416 and attr store1 > 8.356 ) and bondedto
      (attr store1 < 122.825  and attr store1 > 122.025 ))
6 0.1 0.1 peak 192 volume 9.99069 ppm1 8.386 ppm2 1.638
 
! ############### hot_gnoesyNhsqc_051903.195 NOT folded
assi (attr store1 < 4.073 and attr store1 > 3.973 ) 
     ((attr store1 < 8.193 and attr store1 > 8.133 ) and bondedto
      (attr store1 < 122.938  and attr store1 > 122.138 ))
6 0.1 0.1 peak 195 volume 57.39553 ppm1 8.163 ppm2 4.023
 
! ############### hot_gnoesyNhsqc_051903.196 NOT folded
assi (attr store1 < 3.573 and attr store1 > 3.473 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 122.905  and attr store1 > 122.105 ))
6 0.1 0.1 peak 196 volume 6.25940 ppm1 8.162 ppm2 3.523
 
! ############### hot_gnoesyNhsqc_051903.197 NOT folded
assi (attr store1 < 3.172 and attr store1 > 3.072 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 122.913  and attr store1 > 122.113 ))
6 0.1 0.1 peak 197 volume 8.61824 ppm1 8.162 ppm2 3.122
 
! ############### hot_gnoesyNhsqc_051903.198 NOT folded
assi (attr store1 < 1.268 and attr store1 > 1.168 ) 
     ((attr store1 < 8.194 and attr store1 > 8.134 ) and bondedto
      (attr store1 < 122.912  and attr store1 > 122.112 ))
6 0.1 0.1 peak 198 volume 11.95096 ppm1 8.164 ppm2 1.218
 
! ############### hot_gnoesyNhsqc_051903.200 NOT folded
assi (attr store1 < 4.29 and attr store1 > 4.19 ) 
     ((attr store1 < 8.084 and attr store1 > 8.024 ) and bondedto
      (attr store1 < 122.777  and attr store1 > 121.977 ))
6 0.1 0.1 peak 200 volume 328.77017 ppm1 8.054 ppm2 4.240
 
! ############### hot_gnoesyNhsqc_051903.201 NOT folded
assi (attr store1 < 4.047 and attr store1 > 3.947 ) 
     ((attr store1 < 8.085 and attr store1 > 8.025 ) and bondedto
      (attr store1 < 122.757  and attr store1 > 121.957 ))
6 0.1 0.1 peak 201 volume 15.59525 ppm1 8.055 ppm2 3.997
 
! ############### hot_gnoesyNhsqc_051903.202 NOT folded
assi (attr store1 < 2.72 and attr store1 > 2.62 ) 
     ((attr store1 < 8.085 and attr store1 > 8.025 ) and bondedto
      (attr store1 < 122.78  and attr store1 > 121.98 ))
6 0.1 0.1 peak 202 volume 6.68459 ppm1 8.055 ppm2 2.670
 
! ############### hot_gnoesyNhsqc_051903.203 NOT folded
assi (attr store1 < 1.418 and attr store1 > 1.318 ) 
     ((attr store1 < 8.084 and attr store1 > 8.024 ) and bondedto
      (attr store1 < 122.801  and attr store1 > 122.001 ))
6 0.1 0.1 peak 203 volume 375.46997 ppm1 8.054 ppm2 1.368
 
! ############### hot_gnoesyNhsqc_051903.204 NOT folded
assi (attr store1 < 0.922 and attr store1 > 0.822 ) 
     ((attr store1 < 8.083 and attr store1 > 8.023 ) and bondedto
      (attr store1 < 122.831  and attr store1 > 122.031 ))
6 0.1 0.1 peak 204 volume 14.45877 ppm1 8.053 ppm2 0.872
 
! ############### hot_gnoesyNhsqc_051903.205 NOT folded
assi (attr store1 < 4.346 and attr store1 > 4.246 ) 
     ((attr store1 < 8.644 and attr store1 > 8.584 ) and bondedto
      (attr store1 < 122.672  and attr store1 > 121.872 ))
6 0.1 0.1 peak 205 volume 54.69434 ppm1 8.614 ppm2 4.296
 
! ############### hot_gnoesyNhsqc_051903.207 NOT folded
assi (attr store1 < 3.2 and attr store1 > 3.1 ) 
     ((attr store1 < 8.645 and attr store1 > 8.585 ) and bondedto
      (attr store1 < 122.674  and attr store1 > 121.874 ))
6 0.1 0.1 peak 207 volume 11.40807 ppm1 8.615 ppm2 3.150
 
! ############### hot_gnoesyNhsqc_051903.208 NOT folded
assi (attr store1 < 2.849 and attr store1 > 2.749 ) 
     ((attr store1 < 8.646 and attr store1 > 8.586 ) and bondedto
      (attr store1 < 122.679  and attr store1 > 121.879 ))
6 0.1 0.1 peak 208 volume 11.65957 ppm1 8.616 ppm2 2.799
 
! ############### hot_gnoesyNhsqc_051903.209 NOT folded
assi (attr store1 < 1.923 and attr store1 > 1.823 ) 
     ((attr store1 < 8.644 and attr store1 > 8.584 ) and bondedto
      (attr store1 < 122.687  and attr store1 > 121.887 ))
6 0.1 0.1 peak 209 volume 18.60112 ppm1 8.614 ppm2 1.873
 
! ############### hot_gnoesyNhsqc_051903.210 NOT folded
assi (attr store1 < 1.585 and attr store1 > 1.485 ) 
     ((attr store1 < 8.645 and attr store1 > 8.585 ) and bondedto
      (attr store1 < 122.675  and attr store1 > 121.875 ))
6 0.1 0.1 peak 210 volume 70.30192 ppm1 8.615 ppm2 1.535
 
! ############### hot_gnoesyNhsqc_051903.214 NOT folded
assi (attr store1 < 4.86 and attr store1 > 4.76 ) 
     ((attr store1 < 8.32 and attr store1 > 8.26 ) and bondedto
      (attr store1 < 122.638  and attr store1 > 121.838 ))
6 0.1 0.1 peak 214 volume 11.24376 ppm1 8.290 ppm2 4.810
 
! ############### hot_gnoesyNhsqc_051903.215 NOT folded
assi (attr store1 < 2.7 and attr store1 > 2.6 ) 
     ((attr store1 < 8.319 and attr store1 > 8.259 ) and bondedto
      (attr store1 < 122.651  and attr store1 > 121.851 ))
6 0.1 0.1 peak 215 volume 7.59913 ppm1 8.289 ppm2 2.650
 
! ############### hot_gnoesyNhsqc_051903.216 NOT folded
assi (attr store1 < 1.014 and attr store1 > 0.914 ) 
     ((attr store1 < 8.319 and attr store1 > 8.259 ) and bondedto
      (attr store1 < 122.615  and attr store1 > 121.815 ))
6 0.1 0.1 peak 216 volume 7.86486 ppm1 8.289 ppm2 0.964
 
! ############### hot_gnoesyNhsqc_051903.217 NOT folded
assi (attr store1 < 4.601 and attr store1 > 4.501 ) 
     ((attr store1 < 8.307 and attr store1 > 8.247 ) and bondedto
      (attr store1 < 122.632  and attr store1 > 121.832 ))
6 0.1 0.1 peak 217 volume 12.48901 ppm1 8.277 ppm2 4.551
 
! ############### hot_gnoesyNhsqc_051903.218 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.087 and attr store1 > 8.027 ) and bondedto
      (attr store1 < 122.685  and attr store1 > 121.885 ))
6 0.1 0.1 peak 218 volume 357.72363 ppm1 8.057 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.219 NOT folded
assi (attr store1 < 4.567 and attr store1 > 4.467 ) 
     ((attr store1 < 8.088 and attr store1 > 8.028 ) and bondedto
      (attr store1 < 122.635  and attr store1 > 121.835 ))
6 0.1 0.1 peak 219 volume 200.86572 ppm1 8.058 ppm2 4.517
 
! ############### hot_gnoesyNhsqc_051903.220 NOT folded
assi (attr store1 < 3.134 and attr store1 > 3.034 ) 
     ((attr store1 < 8.088 and attr store1 > 8.028 ) and bondedto
      (attr store1 < 122.619  and attr store1 > 121.819 ))
6 0.1 0.1 peak 220 volume 30.22232 ppm1 8.058 ppm2 3.084
 
! ############### hot_gnoesyNhsqc_051903.221 NOT folded
assi (attr store1 < 3.022 and attr store1 > 2.922 ) 
     ((attr store1 < 8.088 and attr store1 > 8.028 ) and bondedto
      (attr store1 < 122.632  and attr store1 > 121.832 ))
6 0.1 0.1 peak 221 volume 25.86935 ppm1 8.058 ppm2 2.972
 
! ############### hot_gnoesyNhsqc_051903.222 NOT folded
assi (attr store1 < 2.328 and attr store1 > 2.228 ) 
     ((attr store1 < 8.088 and attr store1 > 8.028 ) and bondedto
      (attr store1 < 122.642  and attr store1 > 121.842 ))
6 0.1 0.1 peak 222 volume 50.20181 ppm1 8.058 ppm2 2.278
 
! ############### hot_gnoesyNhsqc_051903.223 NOT folded
assi (attr store1 < 2.106 and attr store1 > 2.006 ) 
     ((attr store1 < 8.088 and attr store1 > 8.028 ) and bondedto
      (attr store1 < 122.639  and attr store1 > 121.839 ))
6 0.1 0.1 peak 223 volume 48.54564 ppm1 8.058 ppm2 2.056
 
! ############### hot_gnoesyNhsqc_051903.224 NOT folded
assi (attr store1 < 1.961 and attr store1 > 1.861 ) 
     ((attr store1 < 8.088 and attr store1 > 8.028 ) and bondedto
      (attr store1 < 122.625  and attr store1 > 121.825 ))
6 0.1 0.1 peak 224 volume 90.79955 ppm1 8.058 ppm2 1.911
 
! ############### hot_gnoesyNhsqc_051903.225 NOT folded
assi (attr store1 < 1.886 and attr store1 > 1.786 ) 
     ((attr store1 < 8.72 and attr store1 > 8.66 ) and bondedto
      (attr store1 < 122.372  and attr store1 > 121.572 ))
6 0.1 0.1 peak 225 volume 9.64223 ppm1 8.690 ppm2 1.836
 
! ############### hot_gnoesyNhsqc_051903.226 NOT folded
assi (attr store1 < 4.601 and attr store1 > 4.501 ) 
     ((attr store1 < 8.715 and attr store1 > 8.655 ) and bondedto
      (attr store1 < 122.463  and attr store1 > 121.663 ))
6 0.1 0.1 peak 226 volume 7.14381 ppm1 8.685 ppm2 4.551
 
! ############### hot_gnoesyNhsqc_051903.227 NOT folded
assi (attr store1 < 4.376 and attr store1 > 4.276 ) 
     ((attr store1 < 8.309 and attr store1 > 8.249 ) and bondedto
      (attr store1 < 122.391  and attr store1 > 121.591 ))
6 0.1 0.1 peak 227 volume 22.01932 ppm1 8.279 ppm2 4.326
 
! ############### hot_gnoesyNhsqc_051903.228 NOT folded
assi (attr store1 < 4.0 and attr store1 > 3.9 ) 
     ((attr store1 < 8.309 and attr store1 > 8.249 ) and bondedto
      (attr store1 < 122.378  and attr store1 > 121.578 ))
6 0.1 0.1 peak 228 volume 45.07779 ppm1 8.279 ppm2 3.950
 
! ############### hot_gnoesyNhsqc_051903.229 NOT folded
assi (attr store1 < 3.714 and attr store1 > 3.614 ) 
     ((attr store1 < 8.31 and attr store1 > 8.25 ) and bondedto
      (attr store1 < 122.373  and attr store1 > 121.573 ))
6 0.1 0.1 peak 229 volume 10.42980 ppm1 8.280 ppm2 3.664
 
! ############### hot_gnoesyNhsqc_051903.230 NOT folded
assi (attr store1 < 3.572 and attr store1 > 3.472 ) 
     ((attr store1 < 8.311 and attr store1 > 8.251 ) and bondedto
      (attr store1 < 122.402  and attr store1 > 121.602 ))
6 0.1 0.1 peak 230 volume 5.78321 ppm1 8.281 ppm2 3.522
 
! ############### hot_gnoesyNhsqc_051903.231 NOT folded
assi (attr store1 < 3.399 and attr store1 > 3.299 ) 
     ((attr store1 < 8.311 and attr store1 > 8.251 ) and bondedto
      (attr store1 < 122.379  and attr store1 > 121.579 ))
6 0.1 0.1 peak 231 volume 5.08367 ppm1 8.281 ppm2 3.349
 
! ############### hot_gnoesyNhsqc_051903.232 NOT folded
assi (attr store1 < 3.253 and attr store1 > 3.153 ) 
     ((attr store1 < 8.308 and attr store1 > 8.248 ) and bondedto
      (attr store1 < 122.389  and attr store1 > 121.589 ))
6 0.1 0.1 peak 232 volume 7.79447 ppm1 8.278 ppm2 3.203
 
! ############### hot_gnoesyNhsqc_051903.233 NOT folded
assi (attr store1 < 2.992 and attr store1 > 2.892 ) 
     ((attr store1 < 8.311 and attr store1 > 8.251 ) and bondedto
      (attr store1 < 122.395  and attr store1 > 121.595 ))
6 0.1 0.1 peak 233 volume 16.98659 ppm1 8.281 ppm2 2.942
 
! ############### hot_gnoesyNhsqc_051903.235 NOT folded
assi (attr store1 < 2.198 and attr store1 > 2.098 ) 
     ((attr store1 < 8.309 and attr store1 > 8.249 ) and bondedto
      (attr store1 < 122.378  and attr store1 > 121.578 ))
6 0.1 0.1 peak 235 volume 104.63773 ppm1 8.279 ppm2 2.148
 
! ############### hot_gnoesyNhsqc_051903.236 NOT folded
assi (attr store1 < 2.047 and attr store1 > 1.947 ) 
     ((attr store1 < 8.309 and attr store1 > 8.249 ) and bondedto
      (attr store1 < 122.381  and attr store1 > 121.581 ))
6 0.1 0.1 peak 236 volume 54.93707 ppm1 8.279 ppm2 1.997
 
! ############### hot_gnoesyNhsqc_051903.237 NOT folded
assi (attr store1 < 1.583 and attr store1 > 1.483 ) 
     ((attr store1 < 8.312 and attr store1 > 8.252 ) and bondedto
      (attr store1 < 122.428  and attr store1 > 121.628 ))
6 0.1 0.1 peak 237 volume 10.36960 ppm1 8.282 ppm2 1.533
 
! ############### hot_gnoesyNhsqc_051903.238 NOT folded
assi (attr store1 < 1.333 and attr store1 > 1.233 ) 
     ((attr store1 < 8.31 and attr store1 > 8.25 ) and bondedto
      (attr store1 < 122.397  and attr store1 > 121.597 ))
6 0.1 0.1 peak 238 volume 10.72415 ppm1 8.280 ppm2 1.283
 
! ############### hot_gnoesyNhsqc_051903.239 NOT folded
assi (attr store1 < 1.109 and attr store1 > 1.009 ) 
     ((attr store1 < 8.312 and attr store1 > 8.252 ) and bondedto
      (attr store1 < 122.376  and attr store1 > 121.576 ))
6 0.1 0.1 peak 239 volume 7.79728 ppm1 8.282 ppm2 1.059
 
! ############### hot_gnoesyNhsqc_051903.240 NOT folded
assi (attr store1 < 4.818 and attr store1 > 4.718 ) 
     ((attr store1 < 8.237 and attr store1 > 8.177 ) and bondedto
      (attr store1 < 122.322  and attr store1 > 121.522 ))
6 0.1 0.1 peak 240 volume 5.62908 ppm1 8.207 ppm2 4.768
 
! ############### hot_gnoesyNhsqc_051903.241 NOT folded
assi (attr store1 < 4.818 and attr store1 > 4.718 ) 
     ((attr store1 < 8.158 and attr store1 > 8.098 ) and bondedto
      (attr store1 < 122.315  and attr store1 > 121.515 ))
6 0.1 0.1 peak 241 volume 20.21845 ppm1 8.128 ppm2 4.768
 
! ############### hot_gnoesyNhsqc_051903.242 NOT folded
assi (attr store1 < 2.516 and attr store1 > 2.416 ) 
     ((attr store1 < 8.161 and attr store1 > 8.101 ) and bondedto
      (attr store1 < 122.268  and attr store1 > 121.468 ))
6 0.1 0.1 peak 242 volume 6.18074 ppm1 8.131 ppm2 2.466
 
! ############### hot_gnoesyNhsqc_051903.243 NOT folded
assi (attr store1 < 4.472 and attr store1 > 4.372 ) 
     ((attr store1 < 8.155 and attr store1 > 8.095 ) and bondedto
      (attr store1 < 122.284  and attr store1 > 121.484 ))
6 0.1 0.1 peak 243 volume 20.24412 ppm1 8.125 ppm2 4.422
 
! ############### hot_gnoesyNhsqc_051903.244 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.456 and attr store1 > 8.396 ) and bondedto
      (attr store1 < 122.132  and attr store1 > 121.332 ))
6 0.1 0.1 peak 244 volume 117.70423 ppm1 8.426 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.246 NOT folded
assi (attr store1 < 4.333 and attr store1 > 4.233 ) 
     ((attr store1 < 8.46 and attr store1 > 8.4 ) and bondedto
      (attr store1 < 122.104  and attr store1 > 121.304 ))
6 0.1 0.1 peak 246 volume 85.45907 ppm1 8.430 ppm2 4.283
 
! ############### hot_gnoesyNhsqc_051903.247 NOT folded
assi (attr store1 < 3.946 and attr store1 > 3.846 ) 
     ((attr store1 < 8.46 and attr store1 > 8.4 ) and bondedto
      (attr store1 < 122.197  and attr store1 > 121.397 ))
6 0.1 0.1 peak 247 volume 9.06673 ppm1 8.430 ppm2 3.896
 
! ############### hot_gnoesyNhsqc_051903.248 NOT folded
assi (attr store1 < 3.631 and attr store1 > 3.531 ) 
     ((attr store1 < 8.464 and attr store1 > 8.404 ) and bondedto
      (attr store1 < 122.073  and attr store1 > 121.273 ))
6 0.1 0.1 peak 248 volume 6.31888 ppm1 8.434 ppm2 3.581
 
! ############### hot_gnoesyNhsqc_051903.249 NOT folded
assi (attr store1 < 2.344 and attr store1 > 2.244 ) 
     ((attr store1 < 8.462 and attr store1 > 8.402 ) and bondedto
      (attr store1 < 122.106  and attr store1 > 121.306 ))
6 0.1 0.1 peak 249 volume 51.66356 ppm1 8.432 ppm2 2.294
 
! ############### hot_gnoesyNhsqc_051903.250 NOT folded
assi (attr store1 < 2.069 and attr store1 > 1.969 ) 
     ((attr store1 < 8.462 and attr store1 > 8.402 ) and bondedto
      (attr store1 < 122.156  and attr store1 > 121.356 ))
6 0.1 0.1 peak 250 volume 26.52810 ppm1 8.432 ppm2 2.019
 
! ############### hot_gnoesyNhsqc_051903.251 NOT folded
assi (attr store1 < 1.878 and attr store1 > 1.778 ) 
     ((attr store1 < 8.462 and attr store1 > 8.402 ) and bondedto
      (attr store1 < 122.104  and attr store1 > 121.304 ))
6 0.1 0.1 peak 251 volume 110.31699 ppm1 8.432 ppm2 1.828
 
! ############### hot_gnoesyNhsqc_051903.252 NOT folded
assi (attr store1 < 1.817 and attr store1 > 1.717 ) 
     ((attr store1 < 8.461 and attr store1 > 8.401 ) and bondedto
      (attr store1 < 122.102  and attr store1 > 121.302 ))
6 0.1 0.1 peak 252 volume 116.61962 ppm1 8.431 ppm2 1.767
 
! ############### hot_gnoesyNhsqc_051903.253 NOT folded
assi (attr store1 < 1.544 and attr store1 > 1.444 ) 
     ((attr store1 < 8.461 and attr store1 > 8.401 ) and bondedto
      (attr store1 < 122.11  and attr store1 > 121.31 ))
6 0.1 0.1 peak 253 volume 52.96112 ppm1 8.431 ppm2 1.494
 
! ############### hot_gnoesyNhsqc_051903.254 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.412 and attr store1 > 8.352 ) and bondedto
      (attr store1 < 122.193  and attr store1 > 121.393 ))
6 0.1 0.1 peak 254 volume 379.82101 ppm1 8.382 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.255 NOT folded
assi (attr store1 < 4.649 and attr store1 > 4.549 ) 
     ((attr store1 < 8.41 and attr store1 > 8.35 ) and bondedto
      (attr store1 < 122.192  and attr store1 > 121.392 ))
6 0.1 0.1 peak 255 volume 54.30494 ppm1 8.380 ppm2 4.599
 
! ############### hot_gnoesyNhsqc_051903.256 NOT folded
assi (attr store1 < 4.301 and attr store1 > 4.201 ) 
     ((attr store1 < 8.412 and attr store1 > 8.352 ) and bondedto
      (attr store1 < 122.191  and attr store1 > 121.391 ))
6 0.1 0.1 peak 256 volume 162.33565 ppm1 8.382 ppm2 4.251
 
! ############### hot_gnoesyNhsqc_051903.257 NOT folded
assi (attr store1 < 2.764 and attr store1 > 2.664 ) 
     ((attr store1 < 8.412 and attr store1 > 8.352 ) and bondedto
      (attr store1 < 122.195  and attr store1 > 121.395 ))
6 0.1 0.1 peak 257 volume 35.03869 ppm1 8.382 ppm2 2.714
 
! ############### hot_gnoesyNhsqc_051903.258 NOT folded
assi (attr store1 < 2.663 and attr store1 > 2.563 ) 
     ((attr store1 < 8.412 and attr store1 > 8.352 ) and bondedto
      (attr store1 < 122.19  and attr store1 > 121.39 ))
6 0.1 0.1 peak 258 volume 51.13977 ppm1 8.382 ppm2 2.613
 
! ############### hot_gnoesyNhsqc_051903.259 NOT folded
assi (attr store1 < 3.88 and attr store1 > 3.78 ) 
     ((attr store1 < 8.156 and attr store1 > 8.096 ) and bondedto
      (attr store1 < 122.222  and attr store1 > 121.422 ))
6 0.1 0.1 peak 259 volume 5.95558 ppm1 8.126 ppm2 3.830
 
! ############### hot_gnoesyNhsqc_051903.260 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.929 and attr store1 > 7.869 ) and bondedto
      (attr store1 < 122.133  and attr store1 > 121.333 ))
6 0.1 0.1 peak 260 volume 163.87260 ppm1 7.899 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.261 NOT folded
assi (attr store1 < 4.557 and attr store1 > 4.457 ) 
     ((attr store1 < 7.928 and attr store1 > 7.868 ) and bondedto
      (attr store1 < 122.133  and attr store1 > 121.333 ))
6 0.1 0.1 peak 261 volume 414.25464 ppm1 7.898 ppm2 4.507
 
! ############### hot_gnoesyNhsqc_051903.262 NOT folded
assi (attr store1 < 3.338 and attr store1 > 3.238 ) 
     ((attr store1 < 7.928 and attr store1 > 7.868 ) and bondedto
      (attr store1 < 122.132  and attr store1 > 121.332 ))
6 0.1 0.1 peak 262 volume 167.89929 ppm1 7.898 ppm2 3.288
 
! ############### hot_gnoesyNhsqc_051903.263 NOT folded
assi (attr store1 < 2.684 and attr store1 > 2.584 ) 
     ((attr store1 < 7.928 and attr store1 > 7.868 ) and bondedto
      (attr store1 < 122.122  and attr store1 > 121.322 ))
6 0.1 0.1 peak 263 volume 29.74013 ppm1 7.898 ppm2 2.634
 
! ############### hot_gnoesyNhsqc_051903.264 NOT folded
assi (attr store1 < 2.536 and attr store1 > 2.436 ) 
     ((attr store1 < 7.929 and attr store1 > 7.869 ) and bondedto
      (attr store1 < 122.127  and attr store1 > 121.327 ))
6 0.1 0.1 peak 264 volume 34.76608 ppm1 7.899 ppm2 2.486
 
! ############### hot_gnoesyNhsqc_051903.265 NOT folded
assi (attr store1 < 1.905 and attr store1 > 1.805 ) 
     ((attr store1 < 7.926 and attr store1 > 7.866 ) and bondedto
      (attr store1 < 122.088  and attr store1 > 121.288 ))
6 0.1 0.1 peak 265 volume 5.16074 ppm1 7.896 ppm2 1.855
 
! ############### hot_gnoesyNhsqc_051903.266 NOT folded
assi (attr store1 < 1.44 and attr store1 > 1.34 ) 
     ((attr store1 < 7.928 and attr store1 > 7.868 ) and bondedto
      (attr store1 < 122.111  and attr store1 > 121.311 ))
6 0.1 0.1 peak 266 volume 5.35905 ppm1 7.898 ppm2 1.390
 
! ############### hot_gnoesyNhsqc_051903.267 NOT folded
assi (attr store1 < 0.908 and attr store1 > 0.808 ) 
     ((attr store1 < 7.928 and attr store1 > 7.868 ) and bondedto
      (attr store1 < 122.065  and attr store1 > 121.265 ))
6 0.1 0.1 peak 267 volume 5.33856 ppm1 7.898 ppm2 0.858
 
! ############### hot_gnoesyNhsqc_051903.269 NOT folded
assi (attr store1 < 3.629 and attr store1 > 3.529 ) 
     ((attr store1 < 7.77 and attr store1 > 7.71 ) and bondedto
      (attr store1 < 122.132  and attr store1 > 121.332 ))
6 0.1 0.1 peak 269 volume 8.14640 ppm1 7.740 ppm2 3.579
 
! ############### hot_gnoesyNhsqc_051903.270 NOT folded
assi (attr store1 < 2.225 and attr store1 > 2.125 ) 
     ((attr store1 < 7.769 and attr store1 > 7.709 ) and bondedto
      (attr store1 < 122.14  and attr store1 > 121.34 ))
6 0.1 0.1 peak 270 volume 48.75808 ppm1 7.739 ppm2 2.175
 
! ############### hot_gnoesyNhsqc_051903.271 NOT folded
assi (attr store1 < 1.926 and attr store1 > 1.826 ) 
     ((attr store1 < 7.767 and attr store1 > 7.707 ) and bondedto
      (attr store1 < 122.114  and attr store1 > 121.314 ))
6 0.1 0.1 peak 271 volume 43.96388 ppm1 7.737 ppm2 1.876
 
! ############### hot_gnoesyNhsqc_051903.272 NOT folded
assi (attr store1 < 1.516 and attr store1 > 1.416 ) 
     ((attr store1 < 7.768 and attr store1 > 7.708 ) and bondedto
      (attr store1 < 122.129  and attr store1 > 121.329 ))
6 0.1 0.1 peak 272 volume 13.30931 ppm1 7.738 ppm2 1.466
 
! ############### hot_gnoesyNhsqc_051903.273 NOT folded
assi (attr store1 < 1.048 and attr store1 > 0.948 ) 
     ((attr store1 < 7.768 and attr store1 > 7.708 ) and bondedto
      (attr store1 < 122.139  and attr store1 > 121.339 ))
6 0.1 0.1 peak 273 volume 103.21597 ppm1 7.738 ppm2 0.998
 
! ############### hot_gnoesyNhsqc_051903.274 NOT folded
assi (attr store1 < 4.257 and attr store1 > 4.157 ) 
     ((attr store1 < 8.782 and attr store1 > 8.722 ) and bondedto
      (attr store1 < 121.953  and attr store1 > 121.153 ))
6 0.1 0.1 peak 274 volume 18.30057 ppm1 8.752 ppm2 4.207
 
! ############### hot_gnoesyNhsqc_051903.275 NOT folded
assi (attr store1 < 3.93 and attr store1 > 3.83 ) 
     ((attr store1 < 8.782 and attr store1 > 8.722 ) and bondedto
      (attr store1 < 121.933  and attr store1 > 121.133 ))
6 0.1 0.1 peak 275 volume 24.72952 ppm1 8.752 ppm2 3.880
 
! ############### hot_gnoesyNhsqc_051903.277 NOT folded
assi (attr store1 < 2.996 and attr store1 > 2.896 ) 
     ((attr store1 < 8.785 and attr store1 > 8.725 ) and bondedto
      (attr store1 < 121.953  and attr store1 > 121.153 ))
6 0.1 0.1 peak 277 volume 6.76419 ppm1 8.755 ppm2 2.946
 
! ############### hot_gnoesyNhsqc_051903.278 NOT folded
assi (attr store1 < 1.871 and attr store1 > 1.771 ) 
     ((attr store1 < 8.782 and attr store1 > 8.722 ) and bondedto
      (attr store1 < 121.945  and attr store1 > 121.145 ))
6 0.1 0.1 peak 278 volume 37.88787 ppm1 8.752 ppm2 1.821
 
! ############### hot_gnoesyNhsqc_051903.279 NOT folded
assi (attr store1 < 1.588 and attr store1 > 1.488 ) 
     ((attr store1 < 8.783 and attr store1 > 8.723 ) and bondedto
      (attr store1 < 121.976  and attr store1 > 121.176 ))
6 0.1 0.1 peak 279 volume 16.67994 ppm1 8.753 ppm2 1.538
 
! ############### hot_gnoesyNhsqc_051903.280 NOT folded
assi (attr store1 < 2.387 and attr store1 > 2.287 ) 
     ((attr store1 < 8.777 and attr store1 > 8.717 ) and bondedto
      (attr store1 < 121.924  and attr store1 > 121.124 ))
6 0.1 0.1 peak 280 volume 5.53299 ppm1 8.747 ppm2 2.337
 
! ############### hot_gnoesyNhsqc_051903.281 NOT folded
assi (attr store1 < 2.17 and attr store1 > 2.07 ) 
     ((attr store1 < 8.781 and attr store1 > 8.721 ) and bondedto
      (attr store1 < 121.932  and attr store1 > 121.132 ))
6 0.1 0.1 peak 281 volume 10.39045 ppm1 8.751 ppm2 2.120
 
! ############### hot_gnoesyNhsqc_051903.282 NOT folded
assi (attr store1 < 1.264 and attr store1 > 1.164 ) 
     ((attr store1 < 8.78 and attr store1 > 8.72 ) and bondedto
      (attr store1 < 121.941  and attr store1 > 121.141 ))
6 0.1 0.1 peak 282 volume 33.19908 ppm1 8.750 ppm2 1.214
 
! ############### hot_gnoesyNhsqc_051903.284 NOT folded
assi (attr store1 < 0.795 and attr store1 > 0.695 ) 
     ((attr store1 < 8.781 and attr store1 > 8.721 ) and bondedto
      (attr store1 < 121.946  and attr store1 > 121.146 ))
6 0.1 0.1 peak 284 volume 25.94641 ppm1 8.751 ppm2 0.745
 
! ############### hot_gnoesyNhsqc_051903.285 NOT folded
assi (attr store1 < 4.594 and attr store1 > 4.494 ) 
     ((attr store1 < 8.191 and attr store1 > 8.131 ) and bondedto
      (attr store1 < 121.92  and attr store1 > 121.12 ))
6 0.1 0.1 peak 285 volume 5.16030 ppm1 8.161 ppm2 4.544
 
! ############### hot_gnoesyNhsqc_051903.286 NOT folded
assi (attr store1 < 4.819 and attr store1 > 4.719 ) 
     ((attr store1 < 8.087 and attr store1 > 8.027 ) and bondedto
      (attr store1 < 121.952  and attr store1 > 121.152 ))
6 0.1 0.1 peak 286 volume 7.10123 ppm1 8.057 ppm2 4.769
 
! ############### hot_gnoesyNhsqc_051903.287 NOT folded
assi (attr store1 < 4.308 and attr store1 > 4.208 ) 
     ((attr store1 < 8.087 and attr store1 > 8.027 ) and bondedto
      (attr store1 < 121.974  and attr store1 > 121.174 ))
6 0.1 0.1 peak 287 volume 7.58272 ppm1 8.057 ppm2 4.258
 
! ############### hot_gnoesyNhsqc_051903.288 NOT folded
assi (attr store1 < 1.897 and attr store1 > 1.797 ) 
     ((attr store1 < 7.836 and attr store1 > 7.776 ) and bondedto
      (attr store1 < 121.977  and attr store1 > 121.177 ))
6 0.1 0.1 peak 288 volume 6.68919 ppm1 7.806 ppm2 1.847
 
! ############### hot_gnoesyNhsqc_051903.289 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.505 and attr store1 > 7.445 ) and bondedto
      (attr store1 < 121.902  and attr store1 > 121.102 ))
6 0.1 0.1 peak 289 volume 20.04763 ppm1 7.475 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.290 NOT folded
assi (attr store1 < 4.171 and attr store1 > 4.071 ) 
     ((attr store1 < 7.506 and attr store1 > 7.446 ) and bondedto
      (attr store1 < 121.91  and attr store1 > 121.11 ))
6 0.1 0.1 peak 290 volume 35.27595 ppm1 7.476 ppm2 4.121
 
! ############### hot_gnoesyNhsqc_051903.291 NOT folded
assi (attr store1 < 2.206 and attr store1 > 2.106 ) 
     ((attr store1 < 7.508 and attr store1 > 7.448 ) and bondedto
      (attr store1 < 121.909  and attr store1 > 121.109 ))
6 0.1 0.1 peak 291 volume 9.57732 ppm1 7.478 ppm2 2.156
 
! ############### hot_gnoesyNhsqc_051903.292 NOT folded
assi (attr store1 < 1.675 and attr store1 > 1.575 ) 
     ((attr store1 < 7.506 and attr store1 > 7.446 ) and bondedto
      (attr store1 < 121.91  and attr store1 > 121.11 ))
6 0.1 0.1 peak 292 volume 55.80442 ppm1 7.476 ppm2 1.625
 
! ############### hot_gnoesyNhsqc_051903.293 NOT folded
assi (attr store1 < 0.973 and attr store1 > 0.873 ) 
     ((attr store1 < 7.506 and attr store1 > 7.446 ) and bondedto
      (attr store1 < 121.902  and attr store1 > 121.102 ))
6 0.1 0.1 peak 293 volume 44.11058 ppm1 7.476 ppm2 0.923
 
! ############### hot_gnoesyNhsqc_051903.294 NOT folded
assi (attr store1 < 4.306 and attr store1 > 4.206 ) 
     ((attr store1 < 7.504 and attr store1 > 7.444 ) and bondedto
      (attr store1 < 121.912  and attr store1 > 121.112 ))
6 0.1 0.1 peak 294 volume 76.17306 ppm1 7.474 ppm2 4.256
 
! ############### hot_gnoesyNhsqc_051903.295 NOT folded
assi (attr store1 < 2.435 and attr store1 > 2.335 ) 
     ((attr store1 < 7.503 and attr store1 > 7.443 ) and bondedto
      (attr store1 < 121.897  and attr store1 > 121.097 ))
6 0.1 0.1 peak 295 volume 12.02150 ppm1 7.473 ppm2 2.385
 
! ############### hot_gnoesyNhsqc_051903.296 NOT folded
assi (attr store1 < 1.836 and attr store1 > 1.736 ) 
     ((attr store1 < 7.505 and attr store1 > 7.445 ) and bondedto
      (attr store1 < 121.91  and attr store1 > 121.11 ))
6 0.1 0.1 peak 296 volume 123.72269 ppm1 7.475 ppm2 1.786
 
! ############### hot_gnoesyNhsqc_051903.297 NOT folded
assi (attr store1 < 1.016 and attr store1 > 0.916 ) 
     ((attr store1 < 8.645 and attr store1 > 8.585 ) and bondedto
      (attr store1 < 121.698  and attr store1 > 120.898 ))
6 0.1 0.1 peak 297 volume 5.16933 ppm1 8.615 ppm2 0.966
 
! ############### hot_gnoesyNhsqc_051903.298 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.306 and attr store1 > 8.246 ) and bondedto
      (attr store1 < 121.554  and attr store1 > 120.754 ))
6 0.1 0.1 peak 298 volume 285.41550 ppm1 8.276 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.299 NOT folded
assi (attr store1 < 4.642 and attr store1 > 4.542 ) 
     ((attr store1 < 8.306 and attr store1 > 8.246 ) and bondedto
      (attr store1 < 121.561  and attr store1 > 120.761 ))
6 0.1 0.1 peak 299 volume 179.32083 ppm1 8.276 ppm2 4.592
 
! ############### hot_gnoesyNhsqc_051903.300 NOT folded
assi (attr store1 < 4.306 and attr store1 > 4.206 ) 
     ((attr store1 < 8.307 and attr store1 > 8.247 ) and bondedto
      (attr store1 < 121.593  and attr store1 > 120.793 ))
6 0.1 0.1 peak 300 volume 10.91371 ppm1 8.277 ppm2 4.256
 
! ############### hot_gnoesyNhsqc_051903.301 NOT folded
assi (attr store1 < 2.696 and attr store1 > 2.596 ) 
     ((attr store1 < 8.306 and attr store1 > 8.246 ) and bondedto
      (attr store1 < 121.553  and attr store1 > 120.753 ))
6 0.1 0.1 peak 301 volume 112.86595 ppm1 8.276 ppm2 2.646
 
! ############### hot_gnoesyNhsqc_051903.302 NOT folded
assi (attr store1 < 1.861 and attr store1 > 1.761 ) 
     ((attr store1 < 8.307 and attr store1 > 8.247 ) and bondedto
      (attr store1 < 121.625  and attr store1 > 120.825 ))
6 0.1 0.1 peak 302 volume 9.85724 ppm1 8.277 ppm2 1.811
 
! ############### hot_gnoesyNhsqc_051903.303 NOT folded
assi (attr store1 < 4.817 and attr store1 > 4.717 ) 
     ((attr store1 < 8.412 and attr store1 > 8.352 ) and bondedto
      (attr store1 < 121.411  and attr store1 > 120.611 ))
6 0.1 0.1 peak 303 volume 5.09195 ppm1 8.382 ppm2 4.767
 
! ############### hot_gnoesyNhsqc_051903.304 NOT folded
assi (attr store1 < 1.456 and attr store1 > 1.356 ) 
     ((attr store1 < 8.305 and attr store1 > 8.245 ) and bondedto
      (attr store1 < 121.526  and attr store1 > 120.726 ))
6 0.1 0.1 peak 304 volume 8.51209 ppm1 8.275 ppm2 1.406
 
! ############### hot_gnoesyNhsqc_051903.305 NOT folded
assi (attr store1 < 4.334 and attr store1 > 4.234 ) 
     ((attr store1 < 8.123 and attr store1 > 8.063 ) and bondedto
      (attr store1 < 121.482  and attr store1 > 120.682 ))
6 0.1 0.1 peak 305 volume 5.08866 ppm1 8.093 ppm2 4.284
 
! ############### hot_gnoesyNhsqc_051903.306 NOT folded
assi (attr store1 < 4.324 and attr store1 > 4.224 ) 
     ((attr store1 < 8.083 and attr store1 > 8.023 ) and bondedto
      (attr store1 < 121.534  and attr store1 > 120.734 ))
6 0.1 0.1 peak 306 volume 6.19410 ppm1 8.053 ppm2 4.274
 
! ############### hot_gnoesyNhsqc_051903.307 NOT folded
assi (attr store1 < 4.362 and attr store1 > 4.262 ) 
     ((attr store1 < 7.824 and attr store1 > 7.764 ) and bondedto
      (attr store1 < 121.408  and attr store1 > 120.608 ))
6 0.1 0.1 peak 307 volume 8.46771 ppm1 7.794 ppm2 4.312
 
! ############### hot_gnoesyNhsqc_051903.308 NOT folded
assi (attr store1 < 1.699 and attr store1 > 1.599 ) 
     ((attr store1 < 7.824 and attr store1 > 7.764 ) and bondedto
      (attr store1 < 121.421  and attr store1 > 120.621 ))
6 0.1 0.1 peak 308 volume 9.77820 ppm1 7.794 ppm2 1.649
 
! ############### hot_gnoesyNhsqc_051903.309 NOT folded
assi (attr store1 < 2.028 and attr store1 > 1.928 ) 
     ((attr store1 < 8.775 and attr store1 > 8.715 ) and bondedto
      (attr store1 < 121.103  and attr store1 > 120.303 ))
6 0.1 0.1 peak 309 volume 5.43700 ppm1 8.745 ppm2 1.978
 
! ############### hot_gnoesyNhsqc_051903.310 NOT folded
assi (attr store1 < 1.764 and attr store1 > 1.664 ) 
     ((attr store1 < 8.188 and attr store1 > 8.128 ) and bondedto
      (attr store1 < 121.278  and attr store1 > 120.478 ))
6 0.1 0.1 peak 310 volume 6.64053 ppm1 8.158 ppm2 1.714
 
! ############### hot_gnoesyNhsqc_051903.311 NOT folded
assi (attr store1 < 4.82 and attr store1 > 4.72 ) 
     ((attr store1 < 7.954 and attr store1 > 7.894 ) and bondedto
      (attr store1 < 121.243  and attr store1 > 120.443 ))
6 0.1 0.1 peak 311 volume 6.31741 ppm1 7.924 ppm2 4.770
 
! ############### hot_gnoesyNhsqc_051903.312 NOT folded
assi (attr store1 < 2.257 and attr store1 > 2.157 ) 
     ((attr store1 < 7.748 and attr store1 > 7.688 ) and bondedto
      (attr store1 < 121.165  and attr store1 > 120.365 ))
6 0.1 0.1 peak 312 volume 5.22247 ppm1 7.718 ppm2 2.207
 
! ############### hot_gnoesyNhsqc_051903.313 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.063 and attr store1 > 8.003 ) and bondedto
      (attr store1 < 120.997  and attr store1 > 120.197 ))
6 0.1 0.1 peak 313 volume 10.67060 ppm1 8.033 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.314 NOT folded
assi (attr store1 < 4.563 and attr store1 > 4.463 ) 
     ((attr store1 < 8.062 and attr store1 > 8.002 ) and bondedto
      (attr store1 < 120.957  and attr store1 > 120.157 ))
6 0.1 0.1 peak 314 volume 7.28328 ppm1 8.032 ppm2 4.513
 
! ############### hot_gnoesyNhsqc_051903.315 NOT folded
assi (attr store1 < 3.996 and attr store1 > 3.896 ) 
     ((attr store1 < 8.062 and attr store1 > 8.002 ) and bondedto
      (attr store1 < 121.018  and attr store1 > 120.218 ))
6 0.1 0.1 peak 315 volume 96.00459 ppm1 8.032 ppm2 3.946
 
! ############### hot_gnoesyNhsqc_051903.316 NOT folded
assi (attr store1 < 3.231 and attr store1 > 3.131 ) 
     ((attr store1 < 8.06 and attr store1 > 8.0 ) and bondedto
      (attr store1 < 121.02  and attr store1 > 120.22 ))
6 0.1 0.1 peak 316 volume 18.45538 ppm1 8.030 ppm2 3.181
 
! ############### hot_gnoesyNhsqc_051903.317 NOT folded
assi (attr store1 < 2.848 and attr store1 > 2.748 ) 
     ((attr store1 < 8.061 and attr store1 > 8.001 ) and bondedto
      (attr store1 < 121.013  and attr store1 > 120.213 ))
6 0.1 0.1 peak 317 volume 7.33410 ppm1 8.031 ppm2 2.798
 
! ############### hot_gnoesyNhsqc_051903.318 NOT folded
assi (attr store1 < 2.293 and attr store1 > 2.193 ) 
     ((attr store1 < 8.059 and attr store1 > 7.999 ) and bondedto
      (attr store1 < 121.019  and attr store1 > 120.219 ))
6 0.1 0.1 peak 318 volume 28.91897 ppm1 8.029 ppm2 2.243
 
! ############### hot_gnoesyNhsqc_051903.319 NOT folded
assi (attr store1 < 2.103 and attr store1 > 2.003 ) 
     ((attr store1 < 8.062 and attr store1 > 8.002 ) and bondedto
      (attr store1 < 121.017  and attr store1 > 120.217 ))
6 0.1 0.1 peak 319 volume 69.30996 ppm1 8.032 ppm2 2.053
 
! ############### hot_gnoesyNhsqc_051903.320 NOT folded
assi (attr store1 < 1.959 and attr store1 > 1.859 ) 
     ((attr store1 < 8.062 and attr store1 > 8.002 ) and bondedto
      (attr store1 < 121.019  and attr store1 > 120.219 ))
6 0.1 0.1 peak 320 volume 122.00751 ppm1 8.032 ppm2 1.909
 
! ############### hot_gnoesyNhsqc_051903.321 NOT folded
assi (attr store1 < 1.818 and attr store1 > 1.718 ) 
     ((attr store1 < 8.062 and attr store1 > 8.002 ) and bondedto
      (attr store1 < 121.005  and attr store1 > 120.205 ))
6 0.1 0.1 peak 321 volume 60.56999 ppm1 8.032 ppm2 1.768
 
! ############### hot_gnoesyNhsqc_051903.322 NOT folded
assi (attr store1 < 1.632 and attr store1 > 1.532 ) 
     ((attr store1 < 8.063 and attr store1 > 8.003 ) and bondedto
      (attr store1 < 121.03  and attr store1 > 120.23 ))
6 0.1 0.1 peak 322 volume 33.38972 ppm1 8.033 ppm2 1.582
 
! ############### hot_gnoesyNhsqc_051903.323 NOT folded
assi (attr store1 < 1.422 and attr store1 > 1.322 ) 
     ((attr store1 < 8.063 and attr store1 > 8.003 ) and bondedto
      (attr store1 < 121.069  and attr store1 > 120.269 ))
6 0.1 0.1 peak 323 volume 12.53328 ppm1 8.033 ppm2 1.372
 
! ############### hot_gnoesyNhsqc_051903.324 NOT folded
assi (attr store1 < 1.16 and attr store1 > 1.06 ) 
     ((attr store1 < 8.06 and attr store1 > 8.0 ) and bondedto
      (attr store1 < 121.025  and attr store1 > 120.225 ))
6 0.1 0.1 peak 324 volume 8.85287 ppm1 8.030 ppm2 1.110
 
! ############### hot_gnoesyNhsqc_051903.325 NOT folded
assi (attr store1 < 1.011 and attr store1 > 0.911 ) 
     ((attr store1 < 8.063 and attr store1 > 8.003 ) and bondedto
      (attr store1 < 120.967  and attr store1 > 120.167 ))
6 0.1 0.1 peak 325 volume 6.25461 ppm1 8.033 ppm2 0.961
 
! ############### hot_gnoesyNhsqc_051903.326 NOT folded
assi (attr store1 < 4.019 and attr store1 > 3.919 ) 
     ((attr store1 < 7.891 and attr store1 > 7.831 ) and bondedto
      (attr store1 < 120.871  and attr store1 > 120.071 ))
6 0.1 0.1 peak 326 volume 42.31661 ppm1 7.861 ppm2 3.969
 
! ############### hot_gnoesyNhsqc_051903.328 NOT folded
assi (attr store1 < 3.164 and attr store1 > 3.064 ) 
     ((attr store1 < 7.892 and attr store1 > 7.832 ) and bondedto
      (attr store1 < 120.878  and attr store1 > 120.078 ))
6 0.1 0.1 peak 328 volume 20.69526 ppm1 7.862 ppm2 3.114
 
! ############### hot_gnoesyNhsqc_051903.329 NOT folded
assi (attr store1 < 1.384 and attr store1 > 1.284 ) 
     ((attr store1 < 7.894 and attr store1 > 7.834 ) and bondedto
      (attr store1 < 120.868  and attr store1 > 120.068 ))
6 0.1 0.1 peak 329 volume 78.77848 ppm1 7.864 ppm2 1.334
 
! ############### hot_gnoesyNhsqc_051903.330 NOT folded
assi (attr store1 < 0.978 and attr store1 > 0.878 ) 
     ((attr store1 < 7.894 and attr store1 > 7.834 ) and bondedto
      (attr store1 < 120.872  and attr store1 > 120.072 ))
6 0.1 0.1 peak 330 volume 71.40662 ppm1 7.864 ppm2 0.928
 
! ############### hot_gnoesyNhsqc_051903.332 NOT folded
assi (attr store1 < 4.824 and attr store1 > 4.724 ) 
     ((attr store1 < 8.302 and attr store1 > 8.242 ) and bondedto
      (attr store1 < 120.708  and attr store1 > 119.908 ))
6 0.1 0.1 peak 332 volume 6.61674 ppm1 8.272 ppm2 4.774
 
! ############### hot_gnoesyNhsqc_051903.333 NOT folded
assi (attr store1 < 4.171 and attr store1 > 4.071 ) 
     ((attr store1 < 7.89 and attr store1 > 7.83 ) and bondedto
      (attr store1 < 120.841  and attr store1 > 120.041 ))
6 0.1 0.1 peak 333 volume 41.79898 ppm1 7.860 ppm2 4.121
 
! ############### hot_gnoesyNhsqc_051903.334 NOT folded
assi (attr store1 < 3.511 and attr store1 > 3.411 ) 
     ((attr store1 < 7.89 and attr store1 > 7.83 ) and bondedto
      (attr store1 < 120.84  and attr store1 > 120.04 ))
6 0.1 0.1 peak 334 volume 20.85675 ppm1 7.860 ppm2 3.461
 
! ############### hot_gnoesyNhsqc_051903.335 NOT folded
assi (attr store1 < 2.651 and attr store1 > 2.551 ) 
     ((attr store1 < 7.889 and attr store1 > 7.829 ) and bondedto
      (attr store1 < 120.857  and attr store1 > 120.057 ))
6 0.1 0.1 peak 335 volume 19.84394 ppm1 7.859 ppm2 2.601
 
! ############### hot_gnoesyNhsqc_051903.336 NOT folded
assi (attr store1 < 2.265 and attr store1 > 2.165 ) 
     ((attr store1 < 7.891 and attr store1 > 7.831 ) and bondedto
      (attr store1 < 120.856  and attr store1 > 120.056 ))
6 0.1 0.1 peak 336 volume 45.81261 ppm1 7.861 ppm2 2.215
 
! ############### hot_gnoesyNhsqc_051903.337 NOT folded
assi (attr store1 < 2.069 and attr store1 > 1.969 ) 
     ((attr store1 < 7.888 and attr store1 > 7.828 ) and bondedto
      (attr store1 < 120.832  and attr store1 > 120.032 ))
6 0.1 0.1 peak 337 volume 60.31084 ppm1 7.858 ppm2 2.019
 
! ############### hot_gnoesyNhsqc_051903.338 NOT folded
assi (attr store1 < 1.885 and attr store1 > 1.785 ) 
     ((attr store1 < 7.887 and attr store1 > 7.827 ) and bondedto
      (attr store1 < 120.848  and attr store1 > 120.048 ))
6 0.1 0.1 peak 338 volume 59.86214 ppm1 7.857 ppm2 1.835
 
! ############### hot_gnoesyNhsqc_051903.339 NOT folded
assi (attr store1 < 0.174 and attr store1 > 0.074 ) 
     ((attr store1 < 7.89 and attr store1 > 7.83 ) and bondedto
      (attr store1 < 120.844  and attr store1 > 120.044 ))
6 0.1 0.1 peak 339 volume 6.17536 ppm1 7.860 ppm2 0.124
 
! ############### hot_gnoesyNhsqc_051903.340 NOT folded
assi (attr store1 < 4.821 and attr store1 > 4.721 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.789  and attr store1 > 119.989 ))
6 0.1 0.1 peak 340 volume 111.00013 ppm1 7.775 ppm2 4.771
 
! ############### hot_gnoesyNhsqc_051903.341 NOT folded
assi (attr store1 < 4.613 and attr store1 > 4.513 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.792  and attr store1 > 119.992 ))
6 0.1 0.1 peak 341 volume 188.12889 ppm1 7.775 ppm2 4.563
 
! ############### hot_gnoesyNhsqc_051903.342 NOT folded
assi (attr store1 < 4.285 and attr store1 > 4.185 ) 
     ((attr store1 < 7.808 and attr store1 > 7.748 ) and bondedto
      (attr store1 < 120.76  and attr store1 > 119.96 ))
6 0.1 0.1 peak 342 volume 12.28290 ppm1 7.778 ppm2 4.235
 
! ############### hot_gnoesyNhsqc_051903.343 NOT folded
assi (attr store1 < 4.042 and attr store1 > 3.942 ) 
     ((attr store1 < 7.806 and attr store1 > 7.746 ) and bondedto
      (attr store1 < 120.792  and attr store1 > 119.992 ))
6 0.1 0.1 peak 343 volume 101.19873 ppm1 7.776 ppm2 3.992
 
! ############### hot_gnoesyNhsqc_051903.344 NOT folded
assi (attr store1 < 2.589 and attr store1 > 2.489 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.792  and attr store1 > 119.992 ))
6 0.1 0.1 peak 344 volume 41.50603 ppm1 7.775 ppm2 2.539
 
! ############### hot_gnoesyNhsqc_051903.345 NOT folded
assi (attr store1 < 1.9 and attr store1 > 1.8 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.794  and attr store1 > 119.994 ))
6 0.1 0.1 peak 345 volume 182.71884 ppm1 7.775 ppm2 1.850
 
! ############### hot_gnoesyNhsqc_051903.346 NOT folded
assi (attr store1 < 1.466 and attr store1 > 1.366 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.797  and attr store1 > 119.997 ))
6 0.1 0.1 peak 346 volume 99.75642 ppm1 7.775 ppm2 1.416
 
! ############### hot_gnoesyNhsqc_051903.347 NOT folded
assi (attr store1 < 1.202 and attr store1 > 1.102 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.809  and attr store1 > 120.009 ))
6 0.1 0.1 peak 347 volume 79.44950 ppm1 7.775 ppm2 1.152
 
! ############### hot_gnoesyNhsqc_051903.348 NOT folded
assi (attr store1 < 0.918 and attr store1 > 0.818 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.793  and attr store1 > 119.993 ))
6 0.1 0.1 peak 348 volume 91.59370 ppm1 7.775 ppm2 0.868
 
! ############### hot_gnoesyNhsqc_051903.349 NOT folded
assi (attr store1 < 3.329 and attr store1 > 3.229 ) 
     ((attr store1 < 7.804 and attr store1 > 7.744 ) and bondedto
      (attr store1 < 120.803  and attr store1 > 120.003 ))
6 0.1 0.1 peak 349 volume 7.85071 ppm1 7.774 ppm2 3.279
 
! ############### hot_gnoesyNhsqc_051903.350 NOT folded
assi (attr store1 < 2.714 and attr store1 > 2.614 ) 
     ((attr store1 < 7.804 and attr store1 > 7.744 ) and bondedto
      (attr store1 < 120.8  and attr store1 > 120.0 ))
6 0.1 0.1 peak 350 volume 34.73980 ppm1 7.774 ppm2 2.664
 
! ############### hot_gnoesyNhsqc_051903.351 NOT folded
assi (attr store1 < 1.007 and attr store1 > 0.907 ) 
     ((attr store1 < 7.675 and attr store1 > 7.615 ) and bondedto
      (attr store1 < 120.684  and attr store1 > 119.884 ))
6 0.1 0.1 peak 351 volume 5.51050 ppm1 7.645 ppm2 0.957
 
! ############### hot_gnoesyNhsqc_051903.352 NOT folded
assi (attr store1 < 1.576 and attr store1 > 1.476 ) 
     ((attr store1 < 7.651 and attr store1 > 7.591 ) and bondedto
      (attr store1 < 120.654  and attr store1 > 119.854 ))
6 0.1 0.1 peak 352 volume 5.27284 ppm1 7.621 ppm2 1.526
 
! ############### hot_gnoesyNhsqc_051903.353 NOT folded
assi (attr store1 < 4.048 and attr store1 > 3.948 ) 
     ((attr store1 < 7.563 and attr store1 > 7.503 ) and bondedto
      (attr store1 < 120.742  and attr store1 > 119.942 ))
6 0.1 0.1 peak 353 volume 21.13801 ppm1 7.533 ppm2 3.998
 
! ############### hot_gnoesyNhsqc_051903.354 NOT folded
assi (attr store1 < 3.934 and attr store1 > 3.834 ) 
     ((attr store1 < 7.562 and attr store1 > 7.502 ) and bondedto
      (attr store1 < 120.754  and attr store1 > 119.954 ))
6 0.1 0.1 peak 354 volume 19.70397 ppm1 7.532 ppm2 3.884
 
! ############### hot_gnoesyNhsqc_051903.355 NOT folded
assi (attr store1 < 3.55 and attr store1 > 3.45 ) 
     ((attr store1 < 7.561 and attr store1 > 7.501 ) and bondedto
      (attr store1 < 120.76  and attr store1 > 119.96 ))
6 0.1 0.1 peak 355 volume 25.45673 ppm1 7.531 ppm2 3.500
 
! ############### hot_gnoesyNhsqc_051903.356 NOT folded
assi (attr store1 < 2.316 and attr store1 > 2.216 ) 
     ((attr store1 < 7.562 and attr store1 > 7.502 ) and bondedto
      (attr store1 < 120.757  and attr store1 > 119.957 ))
6 0.1 0.1 peak 356 volume 32.45315 ppm1 7.532 ppm2 2.266
 
! ############### hot_gnoesyNhsqc_051903.357 NOT folded
assi (attr store1 < 2.082 and attr store1 > 1.982 ) 
     ((attr store1 < 7.561 and attr store1 > 7.501 ) and bondedto
      (attr store1 < 120.756  and attr store1 > 119.956 ))
6 0.1 0.1 peak 357 volume 64.22299 ppm1 7.531 ppm2 2.032
 
! ############### hot_gnoesyNhsqc_051903.358 NOT folded
assi (attr store1 < 1.661 and attr store1 > 1.561 ) 
     ((attr store1 < 7.559 and attr store1 > 7.499 ) and bondedto
      (attr store1 < 120.841  and attr store1 > 120.041 ))
6 0.1 0.1 peak 358 volume 5.48240 ppm1 7.529 ppm2 1.611
 
! ############### hot_gnoesyNhsqc_051903.362 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.652 and attr store1 > 8.592 ) and bondedto
      (attr store1 < 120.476  and attr store1 > 119.676 ))
6 0.1 0.1 peak 362 volume 6.92269 ppm1 8.622 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.363 NOT folded
assi (attr store1 < 4.062 and attr store1 > 3.962 ) 
     ((attr store1 < 8.655 and attr store1 > 8.595 ) and bondedto
      (attr store1 < 120.535  and attr store1 > 119.735 ))
6 0.1 0.1 peak 363 volume 12.94430 ppm1 8.625 ppm2 4.012
 
! ############### hot_gnoesyNhsqc_051903.364 NOT folded
assi (attr store1 < 2.534 and attr store1 > 2.434 ) 
     ((attr store1 < 8.652 and attr store1 > 8.592 ) and bondedto
      (attr store1 < 120.527  and attr store1 > 119.727 ))
6 0.1 0.1 peak 364 volume 18.17933 ppm1 8.622 ppm2 2.484
 
! ############### hot_gnoesyNhsqc_051903.365 NOT folded
assi (attr store1 < 2.314 and attr store1 > 2.214 ) 
     ((attr store1 < 8.654 and attr store1 > 8.594 ) and bondedto
      (attr store1 < 120.503  and attr store1 > 119.703 ))
6 0.1 0.1 peak 365 volume 5.37074 ppm1 8.624 ppm2 2.264
 
! ############### hot_gnoesyNhsqc_051903.366 NOT folded
assi (attr store1 < 2.059 and attr store1 > 1.959 ) 
     ((attr store1 < 8.657 and attr store1 > 8.597 ) and bondedto
      (attr store1 < 120.567  and attr store1 > 119.767 ))
6 0.1 0.1 peak 366 volume 6.44793 ppm1 8.627 ppm2 2.009
 
! ############### hot_gnoesyNhsqc_051903.367 NOT folded
assi (attr store1 < 1.563 and attr store1 > 1.463 ) 
     ((attr store1 < 8.654 and attr store1 > 8.594 ) and bondedto
      (attr store1 < 120.549  and attr store1 > 119.749 ))
6 0.1 0.1 peak 367 volume 24.76943 ppm1 8.624 ppm2 1.513
 
! ############### hot_gnoesyNhsqc_051903.368 NOT folded
assi (attr store1 < 1.023 and attr store1 > 0.923 ) 
     ((attr store1 < 8.651 and attr store1 > 8.591 ) and bondedto
      (attr store1 < 120.552  and attr store1 > 119.752 ))
6 0.1 0.1 peak 368 volume 10.96813 ppm1 8.621 ppm2 0.973
 
! ############### hot_gnoesyNhsqc_051903.371 NOT folded
assi (attr store1 < 3.29 and attr store1 > 3.19 ) 
     ((attr store1 < 8.651 and attr store1 > 8.591 ) and bondedto
      (attr store1 < 120.54  and attr store1 > 119.74 ))
6 0.1 0.1 peak 371 volume 32.36946 ppm1 8.621 ppm2 3.240
 
! ############### hot_gnoesyNhsqc_051903.372 NOT folded
assi (attr store1 < 3.084 and attr store1 > 2.984 ) 
     ((attr store1 < 8.647 and attr store1 > 8.587 ) and bondedto
      (attr store1 < 120.547  and attr store1 > 119.747 ))
6 0.1 0.1 peak 372 volume 36.85225 ppm1 8.617 ppm2 3.034
 
! ############### hot_gnoesyNhsqc_051903.373 NOT folded
assi (attr store1 < 1.853 and attr store1 > 1.753 ) 
     ((attr store1 < 8.649 and attr store1 > 8.589 ) and bondedto
      (attr store1 < 120.54  and attr store1 > 119.74 ))
6 0.1 0.1 peak 373 volume 10.36772 ppm1 8.619 ppm2 1.803
 
! ############### hot_gnoesyNhsqc_051903.374 NOT folded
assi (attr store1 < 1.261 and attr store1 > 1.161 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 120.554  and attr store1 > 119.754 ))
6 0.1 0.1 peak 374 volume 7.38304 ppm1 8.618 ppm2 1.211
 
! ############### hot_gnoesyNhsqc_051903.375 NOT folded
assi (attr store1 < 4.334 and attr store1 > 4.234 ) 
     ((attr store1 < 8.357 and attr store1 > 8.297 ) and bondedto
      (attr store1 < 120.513  and attr store1 > 119.713 ))
6 0.1 0.1 peak 375 volume 11.62084 ppm1 8.327 ppm2 4.284
 
! ############### hot_gnoesyNhsqc_051903.376 NOT folded
assi (attr store1 < 4.07 and attr store1 > 3.97 ) 
     ((attr store1 < 8.358 and attr store1 > 8.298 ) and bondedto
      (attr store1 < 120.529  and attr store1 > 119.729 ))
6 0.1 0.1 peak 376 volume 24.87607 ppm1 8.328 ppm2 4.020
 
! ############### hot_gnoesyNhsqc_051903.377 NOT folded
assi (attr store1 < 3.796 and attr store1 > 3.696 ) 
     ((attr store1 < 8.358 and attr store1 > 8.298 ) and bondedto
      (attr store1 < 120.527  and attr store1 > 119.727 ))
6 0.1 0.1 peak 377 volume 31.10629 ppm1 8.328 ppm2 3.746
 
! ############### hot_gnoesyNhsqc_051903.378 NOT folded
assi (attr store1 < 3.578 and attr store1 > 3.478 ) 
     ((attr store1 < 8.359 and attr store1 > 8.299 ) and bondedto
      (attr store1 < 120.565  and attr store1 > 119.765 ))
6 0.1 0.1 peak 378 volume 9.15016 ppm1 8.329 ppm2 3.528
 
! ############### hot_gnoesyNhsqc_051903.379 NOT folded
assi (attr store1 < 3.188 and attr store1 > 3.088 ) 
     ((attr store1 < 8.36 and attr store1 > 8.3 ) and bondedto
      (attr store1 < 120.525  and attr store1 > 119.725 ))
6 0.1 0.1 peak 379 volume 15.10335 ppm1 8.330 ppm2 3.138
 
! ############### hot_gnoesyNhsqc_051903.380 NOT folded
assi (attr store1 < 2.265 and attr store1 > 2.165 ) 
     ((attr store1 < 8.357 and attr store1 > 8.297 ) and bondedto
      (attr store1 < 120.556  and attr store1 > 119.756 ))
6 0.1 0.1 peak 380 volume 5.20940 ppm1 8.327 ppm2 2.215
 
! ############### hot_gnoesyNhsqc_051903.384 NOT folded
assi (attr store1 < 0.995 and attr store1 > 0.895 ) 
     ((attr store1 < 8.359 and attr store1 > 8.299 ) and bondedto
      (attr store1 < 120.536  and attr store1 > 119.736 ))
6 0.1 0.1 peak 384 volume 19.04146 ppm1 8.329 ppm2 0.945
 
! ############### hot_gnoesyNhsqc_051903.385 NOT folded
assi (attr store1 < 0.754 and attr store1 > 0.654 ) 
     ((attr store1 < 8.358 and attr store1 > 8.298 ) and bondedto
      (attr store1 < 120.588  and attr store1 > 119.788 ))
6 0.1 0.1 peak 385 volume 7.07244 ppm1 8.328 ppm2 0.704
 
! ############### hot_gnoesyNhsqc_051903.386 NOT folded
assi (attr store1 < 4.6 and attr store1 > 4.5 ) 
     ((attr store1 < 8.307 and attr store1 > 8.247 ) and bondedto
      (attr store1 < 120.424  and attr store1 > 119.624 ))
6 0.1 0.1 peak 386 volume 11.02619 ppm1 8.277 ppm2 4.550
 
! ############### hot_gnoesyNhsqc_051903.387 NOT folded
assi (attr store1 < 0.968 and attr store1 > 0.868 ) 
     ((attr store1 < 8.085 and attr store1 > 8.025 ) and bondedto
      (attr store1 < 120.547  and attr store1 > 119.747 ))
6 0.1 0.1 peak 387 volume 7.14666 ppm1 8.055 ppm2 0.918
 
! ############### hot_gnoesyNhsqc_051903.388 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.954 and attr store1 > 7.894 ) and bondedto
      (attr store1 < 120.438  and attr store1 > 119.638 ))
6 0.1 0.1 peak 388 volume 6.15362 ppm1 7.924 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.389 NOT folded
assi (attr store1 < 0.798 and attr store1 > 0.698 ) 
     ((attr store1 < 7.655 and attr store1 > 7.595 ) and bondedto
      (attr store1 < 120.515  and attr store1 > 119.715 ))
6 0.1 0.1 peak 389 volume 5.46942 ppm1 7.625 ppm2 0.748
 
! ############### hot_gnoesyNhsqc_051903.391 NOT folded
assi (attr store1 < 4.166 and attr store1 > 4.066 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 120.244  and attr store1 > 119.444 ))
6 0.1 0.1 peak 391 volume 29.27908 ppm1 8.740 ppm2 4.116
 
! ############### hot_gnoesyNhsqc_051903.392 NOT folded
assi (attr store1 < 3.984 and attr store1 > 3.884 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 120.24  and attr store1 > 119.44 ))
6 0.1 0.1 peak 392 volume 44.79546 ppm1 8.740 ppm2 3.934
 
! ############### hot_gnoesyNhsqc_051903.393 NOT folded
assi (attr store1 < 2.859 and attr store1 > 2.759 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 120.253  and attr store1 > 119.453 ))
6 0.1 0.1 peak 393 volume 61.74519 ppm1 8.740 ppm2 2.809
 
! ############### hot_gnoesyNhsqc_051903.394 NOT folded
assi (attr store1 < 2.532 and attr store1 > 2.432 ) 
     ((attr store1 < 8.771 and attr store1 > 8.711 ) and bondedto
      (attr store1 < 120.257  and attr store1 > 119.457 ))
6 0.1 0.1 peak 394 volume 54.60807 ppm1 8.741 ppm2 2.482
 
! ############### hot_gnoesyNhsqc_051903.395 NOT folded
assi (attr store1 < 1.957 and attr store1 > 1.857 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 120.26  and attr store1 > 119.46 ))
6 0.1 0.1 peak 395 volume 79.41546 ppm1 8.740 ppm2 1.907
 
! ############### hot_gnoesyNhsqc_051903.396 NOT folded
assi (attr store1 < 1.628 and attr store1 > 1.528 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 120.256  and attr store1 > 119.456 ))
6 0.1 0.1 peak 396 volume 18.39977 ppm1 8.740 ppm2 1.578
 
! ############### hot_gnoesyNhsqc_051903.397 NOT folded
assi (attr store1 < 1.452 and attr store1 > 1.352 ) 
     ((attr store1 < 8.773 and attr store1 > 8.713 ) and bondedto
      (attr store1 < 120.275  and attr store1 > 119.475 ))
6 0.1 0.1 peak 397 volume 10.94110 ppm1 8.743 ppm2 1.402
 
! ############### hot_gnoesyNhsqc_051903.399 NOT folded
assi (attr store1 < 0.958 and attr store1 > 0.858 ) 
     ((attr store1 < 8.772 and attr store1 > 8.712 ) and bondedto
      (attr store1 < 120.259  and attr store1 > 119.459 ))
6 0.1 0.1 peak 399 volume 20.90896 ppm1 8.742 ppm2 0.908
 
! ############### hot_gnoesyNhsqc_051903.400 NOT folded
assi (attr store1 < 4.818 and attr store1 > 4.718 ) 
     ((attr store1 < 8.765 and attr store1 > 8.705 ) and bondedto
      (attr store1 < 120.206  and attr store1 > 119.406 ))
6 0.1 0.1 peak 400 volume 6.76211 ppm1 8.735 ppm2 4.768
 
! ############### hot_gnoesyNhsqc_051903.401 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.174 and attr store1 > 8.114 ) and bondedto
      (attr store1 < 120.318  and attr store1 > 119.518 ))
6 0.1 0.1 peak 401 volume 110.68307 ppm1 8.144 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.402 NOT folded
assi (attr store1 < 4.294 and attr store1 > 4.194 ) 
     ((attr store1 < 8.174 and attr store1 > 8.114 ) and bondedto
      (attr store1 < 120.339  and attr store1 > 119.539 ))
6 0.1 0.1 peak 402 volume 187.36827 ppm1 8.144 ppm2 4.244
 
! ############### hot_gnoesyNhsqc_051903.403 NOT folded
assi (attr store1 < 4.036 and attr store1 > 3.936 ) 
     ((attr store1 < 8.173 and attr store1 > 8.113 ) and bondedto
      (attr store1 < 120.348  and attr store1 > 119.548 ))
6 0.1 0.1 peak 403 volume 18.22781 ppm1 8.143 ppm2 3.986
 
! ############### hot_gnoesyNhsqc_051903.404 NOT folded
assi (attr store1 < 2.978 and attr store1 > 2.878 ) 
     ((attr store1 < 8.176 and attr store1 > 8.116 ) and bondedto
      (attr store1 < 120.286  and attr store1 > 119.486 ))
6 0.1 0.1 peak 404 volume 6.60393 ppm1 8.146 ppm2 2.928
 
! ############### hot_gnoesyNhsqc_051903.405 NOT folded
assi (attr store1 < 2.387 and attr store1 > 2.287 ) 
     ((attr store1 < 8.174 and attr store1 > 8.114 ) and bondedto
      (attr store1 < 120.342  and attr store1 > 119.542 ))
6 0.1 0.1 peak 405 volume 6.82099 ppm1 8.144 ppm2 2.337
 
! ############### hot_gnoesyNhsqc_051903.406 NOT folded
assi (attr store1 < 2.11 and attr store1 > 2.01 ) 
     ((attr store1 < 8.173 and attr store1 > 8.113 ) and bondedto
      (attr store1 < 120.326  and attr store1 > 119.526 ))
6 0.1 0.1 peak 406 volume 17.40470 ppm1 8.143 ppm2 2.060
 
! ############### hot_gnoesyNhsqc_051903.407 NOT folded
assi (attr store1 < 1.849 and attr store1 > 1.749 ) 
     ((attr store1 < 8.174 and attr store1 > 8.114 ) and bondedto
      (attr store1 < 120.341  and attr store1 > 119.541 ))
6 0.1 0.1 peak 407 volume 128.06291 ppm1 8.144 ppm2 1.799
 
! ############### hot_gnoesyNhsqc_051903.408 NOT folded
assi (attr store1 < 1.666 and attr store1 > 1.566 ) 
     ((attr store1 < 8.173 and attr store1 > 8.113 ) and bondedto
      (attr store1 < 120.349  and attr store1 > 119.549 ))
6 0.1 0.1 peak 408 volume 29.84075 ppm1 8.143 ppm2 1.616
 
! ############### hot_gnoesyNhsqc_051903.409 NOT folded
assi (attr store1 < 1.428 and attr store1 > 1.328 ) 
     ((attr store1 < 8.174 and attr store1 > 8.114 ) and bondedto
      (attr store1 < 120.339  and attr store1 > 119.539 ))
6 0.1 0.1 peak 409 volume 111.49478 ppm1 8.144 ppm2 1.378
 
! ############### hot_gnoesyNhsqc_051903.410 NOT folded
assi (attr store1 < 0.919 and attr store1 > 0.819 ) 
     ((attr store1 < 8.176 and attr store1 > 8.116 ) and bondedto
      (attr store1 < 120.334  and attr store1 > 119.534 ))
6 0.1 0.1 peak 410 volume 7.13288 ppm1 8.146 ppm2 0.869
 
! ############### hot_gnoesyNhsqc_051903.411 NOT folded
assi (attr store1 < 3.223 and attr store1 > 3.123 ) 
     ((attr store1 < 8.767 and attr store1 > 8.707 ) and bondedto
      (attr store1 < 120.161  and attr store1 > 119.361 ))
6 0.1 0.1 peak 411 volume 12.58644 ppm1 8.737 ppm2 3.173
 
! ############### hot_gnoesyNhsqc_051903.412 NOT folded
assi (attr store1 < 2.075 and attr store1 > 1.975 ) 
     ((attr store1 < 7.9 and attr store1 > 7.84 ) and bondedto
      (attr store1 < 120.134  and attr store1 > 119.334 ))
6 0.1 0.1 peak 412 volume 7.20368 ppm1 7.870 ppm2 2.025
 
! ############### hot_gnoesyNhsqc_051903.413 NOT folded
assi (attr store1 < 3.138 and attr store1 > 3.038 ) 
     ((attr store1 < 7.881 and attr store1 > 7.821 ) and bondedto
      (attr store1 < 119.959  and attr store1 > 119.159 ))
6 0.1 0.1 peak 413 volume 7.46841 ppm1 7.851 ppm2 3.088
 
! ############### hot_gnoesyNhsqc_051903.414 NOT folded
assi (attr store1 < 4.604 and attr store1 > 4.504 ) 
     ((attr store1 < 7.798 and attr store1 > 7.738 ) and bondedto
      (attr store1 < 120.086  and attr store1 > 119.286 ))
6 0.1 0.1 peak 414 volume 5.42187 ppm1 7.768 ppm2 4.554
 
! ############### hot_gnoesyNhsqc_051903.415 NOT folded
assi (attr store1 < 4.696 and attr store1 > 4.596 ) 
     ((attr store1 < 7.755 and attr store1 > 7.695 ) and bondedto
      (attr store1 < 120.148  and attr store1 > 119.348 ))
6 0.1 0.1 peak 415 volume 5.07048 ppm1 7.725 ppm2 4.646
 
! ############### hot_gnoesyNhsqc_051903.417 NOT folded
assi (attr store1 < 3.089 and attr store1 > 2.989 ) 
     ((attr store1 < 7.761 and attr store1 > 7.701 ) and bondedto
      (attr store1 < 120.095  and attr store1 > 119.295 ))
6 0.1 0.1 peak 417 volume 11.37400 ppm1 7.731 ppm2 3.039
 
! ############### hot_gnoesyNhsqc_051903.418 NOT folded
assi (attr store1 < 2.334 and attr store1 > 2.234 ) 
     ((attr store1 < 7.761 and attr store1 > 7.701 ) and bondedto
      (attr store1 < 120.109  and attr store1 > 119.309 ))
6 0.1 0.1 peak 418 volume 82.35079 ppm1 7.731 ppm2 2.284
 
! ############### hot_gnoesyNhsqc_051903.419 NOT folded
assi (attr store1 < 1.857 and attr store1 > 1.757 ) 
     ((attr store1 < 7.761 and attr store1 > 7.701 ) and bondedto
      (attr store1 < 120.163  and attr store1 > 119.363 ))
6 0.1 0.1 peak 419 volume 37.70642 ppm1 7.731 ppm2 1.807
 
! ############### hot_gnoesyNhsqc_051903.420 NOT folded
assi (attr store1 < 1.162 and attr store1 > 1.062 ) 
     ((attr store1 < 7.76 and attr store1 > 7.7 ) and bondedto
      (attr store1 < 120.112  and attr store1 > 119.312 ))
6 0.1 0.1 peak 420 volume 115.81681 ppm1 7.730 ppm2 1.112
 
! ############### hot_gnoesyNhsqc_051903.421 NOT folded
assi (attr store1 < 1.03 and attr store1 > 0.93 ) 
     ((attr store1 < 7.761 and attr store1 > 7.701 ) and bondedto
      (attr store1 < 120.107  and attr store1 > 119.307 ))
6 0.1 0.1 peak 421 volume 54.03539 ppm1 7.731 ppm2 0.980
 
! ############### hot_gnoesyNhsqc_051903.422 NOT folded
assi (attr store1 < 0.798 and attr store1 > 0.698 ) 
     ((attr store1 < 7.761 and attr store1 > 7.701 ) and bondedto
      (attr store1 < 120.136  and attr store1 > 119.336 ))
6 0.1 0.1 peak 422 volume 7.24089 ppm1 7.731 ppm2 0.748
 
! ############### hot_gnoesyNhsqc_051903.423 NOT folded
assi (attr store1 < 4.816 and attr store1 > 4.716 ) 
     ((attr store1 < 8.3 and attr store1 > 8.24 ) and bondedto
      (attr store1 < 119.75  and attr store1 > 118.95 ))
6 0.1 0.1 peak 423 volume 24.20736 ppm1 8.270 ppm2 4.766
 
! ############### hot_gnoesyNhsqc_051903.424 NOT folded
assi (attr store1 < 4.556 and attr store1 > 4.456 ) 
     ((attr store1 < 8.3 and attr store1 > 8.24 ) and bondedto
      (attr store1 < 119.878  and attr store1 > 119.078 ))
6 0.1 0.1 peak 424 volume 5.86075 ppm1 8.270 ppm2 4.506
 
! ############### hot_gnoesyNhsqc_051903.425 NOT folded
assi (attr store1 < 2.715 and attr store1 > 2.615 ) 
     ((attr store1 < 8.3 and attr store1 > 8.24 ) and bondedto
      (attr store1 < 119.757  and attr store1 > 118.957 ))
6 0.1 0.1 peak 425 volume 5.89338 ppm1 8.270 ppm2 2.665
 
! ############### hot_gnoesyNhsqc_051903.426 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.222 and attr store1 > 8.162 ) and bondedto
      (attr store1 < 119.853  and attr store1 > 119.053 ))
6 0.1 0.1 peak 426 volume 223.37338 ppm1 8.192 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.427 NOT folded
assi (attr store1 < 4.578 and attr store1 > 4.478 ) 
     ((attr store1 < 8.221 and attr store1 > 8.161 ) and bondedto
      (attr store1 < 119.85  and attr store1 > 119.05 ))
6 0.1 0.1 peak 427 volume 106.70696 ppm1 8.191 ppm2 4.528
 
! ############### hot_gnoesyNhsqc_051903.428 NOT folded
assi (attr store1 < 4.031 and attr store1 > 3.931 ) 
     ((attr store1 < 8.225 and attr store1 > 8.165 ) and bondedto
      (attr store1 < 119.862  and attr store1 > 119.062 ))
6 0.1 0.1 peak 428 volume 6.27694 ppm1 8.195 ppm2 3.981
 
! ############### hot_gnoesyNhsqc_051903.429 NOT folded
assi (attr store1 < 2.723 and attr store1 > 2.623 ) 
     ((attr store1 < 8.222 and attr store1 > 8.162 ) and bondedto
      (attr store1 < 119.845  and attr store1 > 119.045 ))
6 0.1 0.1 peak 429 volume 54.14299 ppm1 8.192 ppm2 2.673
 
! ############### hot_gnoesyNhsqc_051903.430 NOT folded
assi (attr store1 < 0.909 and attr store1 > 0.809 ) 
     ((attr store1 < 8.223 and attr store1 > 8.163 ) and bondedto
      (attr store1 < 119.842  and attr store1 > 119.042 ))
6 0.1 0.1 peak 430 volume 7.72550 ppm1 8.193 ppm2 0.859
 
! ############### hot_gnoesyNhsqc_051903.431 NOT folded
assi (attr store1 < 3.345 and attr store1 > 3.245 ) 
     ((attr store1 < 8.221 and attr store1 > 8.161 ) and bondedto
      (attr store1 < 119.856  and attr store1 > 119.056 ))
6 0.1 0.1 peak 431 volume 31.72439 ppm1 8.191 ppm2 3.295
 
! ############### hot_gnoesyNhsqc_051903.432 NOT folded
assi (attr store1 < 2.585 and attr store1 > 2.485 ) 
     ((attr store1 < 8.221 and attr store1 > 8.161 ) and bondedto
      (attr store1 < 119.851  and attr store1 > 119.051 ))
6 0.1 0.1 peak 432 volume 67.76898 ppm1 8.191 ppm2 2.535
 
! ############### hot_gnoesyNhsqc_051903.434 NOT folded
assi (attr store1 < 4.568 and attr store1 > 4.468 ) 
     ((attr store1 < 7.996 and attr store1 > 7.936 ) and bondedto
      (attr store1 < 119.745  and attr store1 > 118.945 ))
6 0.1 0.1 peak 434 volume 21.25186 ppm1 7.966 ppm2 4.518
 
! ############### hot_gnoesyNhsqc_051903.436 NOT folded
assi (attr store1 < 2.864 and attr store1 > 2.764 ) 
     ((attr store1 < 7.998 and attr store1 > 7.938 ) and bondedto
      (attr store1 < 119.718  and attr store1 > 118.918 ))
6 0.1 0.1 peak 436 volume 28.22454 ppm1 7.968 ppm2 2.814
 
! ############### hot_gnoesyNhsqc_051903.437 NOT folded
assi (attr store1 < 2.543 and attr store1 > 2.443 ) 
     ((attr store1 < 7.997 and attr store1 > 7.937 ) and bondedto
      (attr store1 < 119.74  and attr store1 > 118.94 ))
6 0.1 0.1 peak 437 volume 28.28708 ppm1 7.967 ppm2 2.493
 
! ############### hot_gnoesyNhsqc_051903.439 NOT folded
assi (attr store1 < 1.269 and attr store1 > 1.169 ) 
     ((attr store1 < 7.998 and attr store1 > 7.938 ) and bondedto
      (attr store1 < 119.728  and attr store1 > 118.928 ))
6 0.1 0.1 peak 439 volume 17.29032 ppm1 7.968 ppm2 1.219
 
! ############### hot_gnoesyNhsqc_051903.440 NOT folded
assi (attr store1 < 1.173 and attr store1 > 1.073 ) 
     ((attr store1 < 7.993 and attr store1 > 7.933 ) and bondedto
      (attr store1 < 119.764  and attr store1 > 118.964 ))
6 0.1 0.1 peak 440 volume 20.73801 ppm1 7.963 ppm2 1.123
 
! ############### hot_gnoesyNhsqc_051903.441 NOT folded
assi (attr store1 < 2.532 and attr store1 > 2.432 ) 
     ((attr store1 < 7.957 and attr store1 > 7.897 ) and bondedto
      (attr store1 < 119.824  and attr store1 > 119.024 ))
6 0.1 0.1 peak 441 volume 15.84515 ppm1 7.927 ppm2 2.482
 
! ############### hot_gnoesyNhsqc_051903.442 NOT folded
assi (attr store1 < 4.703 and attr store1 > 4.603 ) 
     ((attr store1 < 7.945 and attr store1 > 7.885 ) and bondedto
      (attr store1 < 119.834  and attr store1 > 119.034 ))
6 0.1 0.1 peak 442 volume 34.15771 ppm1 7.915 ppm2 4.653
 
! ############### hot_gnoesyNhsqc_051903.443 NOT folded
assi (attr store1 < 4.575 and attr store1 > 4.475 ) 
     ((attr store1 < 7.945 and attr store1 > 7.885 ) and bondedto
      (attr store1 < 119.833  and attr store1 > 119.033 ))
6 0.1 0.1 peak 443 volume 23.60915 ppm1 7.915 ppm2 4.525
 
! ############### hot_gnoesyNhsqc_051903.444 NOT folded
assi (attr store1 < 3.933 and attr store1 > 3.833 ) 
     ((attr store1 < 7.947 and attr store1 > 7.887 ) and bondedto
      (attr store1 < 119.821  and attr store1 > 119.021 ))
6 0.1 0.1 peak 444 volume 27.43941 ppm1 7.917 ppm2 3.883
 
! ############### hot_gnoesyNhsqc_051903.445 NOT folded
assi (attr store1 < 3.106 and attr store1 > 3.006 ) 
     ((attr store1 < 7.945 and attr store1 > 7.885 ) and bondedto
      (attr store1 < 119.844  and attr store1 > 119.044 ))
6 0.1 0.1 peak 445 volume 53.94618 ppm1 7.915 ppm2 3.056
 
! ############### hot_gnoesyNhsqc_051903.446 NOT folded
assi (attr store1 < 3.011 and attr store1 > 2.911 ) 
     ((attr store1 < 7.944 and attr store1 > 7.884 ) and bondedto
      (attr store1 < 119.839  and attr store1 > 119.039 ))
6 0.1 0.1 peak 446 volume 52.71102 ppm1 7.914 ppm2 2.961
 
! ############### hot_gnoesyNhsqc_051903.447 NOT folded
assi (attr store1 < 2.334 and attr store1 > 2.234 ) 
     ((attr store1 < 7.943 and attr store1 > 7.883 ) and bondedto
      (attr store1 < 119.847  and attr store1 > 119.047 ))
6 0.1 0.1 peak 447 volume 51.42142 ppm1 7.913 ppm2 2.284
 
! ############### hot_gnoesyNhsqc_051903.448 NOT folded
assi (attr store1 < 1.157 and attr store1 > 1.057 ) 
     ((attr store1 < 7.945 and attr store1 > 7.885 ) and bondedto
      (attr store1 < 119.838  and attr store1 > 119.038 ))
6 0.1 0.1 peak 448 volume 36.19016 ppm1 7.915 ppm2 1.107
 
! ############### hot_gnoesyNhsqc_051903.449 NOT folded
assi (attr store1 < 2.156 and attr store1 > 2.056 ) 
     ((attr store1 < 7.894 and attr store1 > 7.834 ) and bondedto
      (attr store1 < 119.838  and attr store1 > 119.038 ))
6 0.1 0.1 peak 449 volume 6.24278 ppm1 7.864 ppm2 2.106
 
! ############### hot_gnoesyNhsqc_051903.451 NOT folded
assi (attr store1 < 4.402 and attr store1 > 4.302 ) 
     ((attr store1 < 8.303 and attr store1 > 8.243 ) and bondedto
      (attr store1 < 119.608  and attr store1 > 118.808 ))
6 0.1 0.1 peak 451 volume 8.05021 ppm1 8.273 ppm2 4.352
 
! ############### hot_gnoesyNhsqc_051903.452 NOT folded
assi (attr store1 < 4.005 and attr store1 > 3.905 ) 
     ((attr store1 < 8.303 and attr store1 > 8.243 ) and bondedto
      (attr store1 < 119.608  and attr store1 > 118.808 ))
6 0.1 0.1 peak 452 volume 9.51575 ppm1 8.273 ppm2 3.955
 
! ############### hot_gnoesyNhsqc_051903.453 NOT folded
assi (attr store1 < 3.688 and attr store1 > 3.588 ) 
     ((attr store1 < 8.301 and attr store1 > 8.241 ) and bondedto
      (attr store1 < 119.625  and attr store1 > 118.825 ))
6 0.1 0.1 peak 453 volume 9.56999 ppm1 8.271 ppm2 3.638
 
! ############### hot_gnoesyNhsqc_051903.454 NOT folded
assi (attr store1 < 3.381 and attr store1 > 3.281 ) 
     ((attr store1 < 8.3 and attr store1 > 8.24 ) and bondedto
      (attr store1 < 119.611  and attr store1 > 118.811 ))
6 0.1 0.1 peak 454 volume 8.80868 ppm1 8.270 ppm2 3.331
 
! ############### hot_gnoesyNhsqc_051903.455 NOT folded
assi (attr store1 < 2.991 and attr store1 > 2.891 ) 
     ((attr store1 < 8.302 and attr store1 > 8.242 ) and bondedto
      (attr store1 < 119.622  and attr store1 > 118.822 ))
6 0.1 0.1 peak 455 volume 15.21421 ppm1 8.272 ppm2 2.941
 
! ############### hot_gnoesyNhsqc_051903.456 NOT folded
assi (attr store1 < 2.49 and attr store1 > 2.39 ) 
     ((attr store1 < 8.302 and attr store1 > 8.242 ) and bondedto
      (attr store1 < 119.635  and attr store1 > 118.835 ))
6 0.1 0.1 peak 456 volume 13.36502 ppm1 8.272 ppm2 2.440
 
! ############### hot_gnoesyNhsqc_051903.457 NOT folded
assi (attr store1 < 2.33 and attr store1 > 2.23 ) 
     ((attr store1 < 8.3 and attr store1 > 8.24 ) and bondedto
      (attr store1 < 119.658  and attr store1 > 118.858 ))
6 0.1 0.1 peak 457 volume 12.73936 ppm1 8.270 ppm2 2.280
 
! ############### hot_gnoesyNhsqc_051903.458 NOT folded
assi (attr store1 < 2.164 and attr store1 > 2.064 ) 
     ((attr store1 < 8.3 and attr store1 > 8.24 ) and bondedto
      (attr store1 < 119.625  and attr store1 > 118.825 ))
6 0.1 0.1 peak 458 volume 29.74415 ppm1 8.270 ppm2 2.114
 
! ############### hot_gnoesyNhsqc_051903.459 NOT folded
assi (attr store1 < 1.978 and attr store1 > 1.878 ) 
     ((attr store1 < 8.301 and attr store1 > 8.241 ) and bondedto
      (attr store1 < 119.623  and attr store1 > 118.823 ))
6 0.1 0.1 peak 459 volume 31.36127 ppm1 8.271 ppm2 1.928
 
! ############### hot_gnoesyNhsqc_051903.460 NOT folded
assi (attr store1 < 1.665 and attr store1 > 1.565 ) 
     ((attr store1 < 8.301 and attr store1 > 8.241 ) and bondedto
      (attr store1 < 119.632  and attr store1 > 118.832 ))
6 0.1 0.1 peak 460 volume 51.63619 ppm1 8.271 ppm2 1.615
 
! ############### hot_gnoesyNhsqc_051903.462 NOT folded
assi (attr store1 < 5.098 and attr store1 > 4.998 ) 
     ((attr store1 < 8.299 and attr store1 > 8.239 ) and bondedto
      (attr store1 < 119.637  and attr store1 > 118.837 ))
6 0.1 0.1 peak 462 volume 23.25462 ppm1 8.269 ppm2 5.048
 
! ############### hot_gnoesyNhsqc_051903.463 NOT folded
assi (attr store1 < 1.832 and attr store1 > 1.732 ) 
     ((attr store1 < 8.298 and attr store1 > 8.238 ) and bondedto
      (attr store1 < 119.622  and attr store1 > 118.822 ))
6 0.1 0.1 peak 463 volume 26.91239 ppm1 8.268 ppm2 1.782
 
! ############### hot_gnoesyNhsqc_051903.465 NOT folded
assi (attr store1 < 4.57 and attr store1 > 4.47 ) 
     ((attr store1 < 8.113 and attr store1 > 8.053 ) and bondedto
      (attr store1 < 119.511  and attr store1 > 118.711 ))
6 0.1 0.1 peak 465 volume 7.85243 ppm1 8.083 ppm2 4.520
 
! ############### hot_gnoesyNhsqc_051903.466 NOT folded
assi (attr store1 < 1.856 and attr store1 > 1.756 ) 
     ((attr store1 < 8.0 and attr store1 > 7.94 ) and bondedto
      (attr store1 < 119.695  and attr store1 > 118.895 ))
6 0.1 0.1 peak 466 volume 87.58374 ppm1 7.970 ppm2 1.806
 
! ############### hot_gnoesyNhsqc_051903.467 NOT folded
assi (attr store1 < 4.079 and attr store1 > 3.979 ) 
     ((attr store1 < 7.983 and attr store1 > 7.923 ) and bondedto
      (attr store1 < 119.547  and attr store1 > 118.747 ))
6 0.1 0.1 peak 467 volume 49.94552 ppm1 7.953 ppm2 4.029
 
! ############### hot_gnoesyNhsqc_051903.468 NOT folded
assi (attr store1 < 2.112 and attr store1 > 2.012 ) 
     ((attr store1 < 7.98 and attr store1 > 7.92 ) and bondedto
      (attr store1 < 119.483  and attr store1 > 118.683 ))
6 0.1 0.1 peak 468 volume 73.62876 ppm1 7.950 ppm2 2.062
 
! ############### hot_gnoesyNhsqc_051903.469 NOT folded
assi (attr store1 < 1.451 and attr store1 > 1.351 ) 
     ((attr store1 < 7.986 and attr store1 > 7.926 ) and bondedto
      (attr store1 < 119.565  and attr store1 > 118.765 ))
6 0.1 0.1 peak 469 volume 54.14353 ppm1 7.956 ppm2 1.401
 
! ############### hot_gnoesyNhsqc_051903.470 NOT folded
assi (attr store1 < 0.995 and attr store1 > 0.895 ) 
     ((attr store1 < 7.979 and attr store1 > 7.919 ) and bondedto
      (attr store1 < 119.557  and attr store1 > 118.757 ))
6 0.1 0.1 peak 470 volume 57.75735 ppm1 7.949 ppm2 0.945
 
! ############### hot_gnoesyNhsqc_051903.472 NOT folded
assi (attr store1 < 1.269 and attr store1 > 1.169 ) 
     ((attr store1 < 7.43 and attr store1 > 7.37 ) and bondedto
      (attr store1 < 119.486  and attr store1 > 118.686 ))
6 0.1 0.1 peak 472 volume 5.20804 ppm1 7.400 ppm2 1.219
 
! ############### hot_gnoesyNhsqc_051903.473 NOT folded
assi (attr store1 < 5.608 and attr store1 > 5.508 ) 
     ((attr store1 < 7.422 and attr store1 > 7.362 ) and bondedto
      (attr store1 < 119.517  and attr store1 > 118.717 ))
6 0.1 0.1 peak 473 volume 5.41673 ppm1 7.392 ppm2 5.558
 
! ############### hot_gnoesyNhsqc_051903.474 NOT folded
assi (attr store1 < 0.838 and attr store1 > 0.738 ) 
     ((attr store1 < 7.425 and attr store1 > 7.365 ) and bondedto
      (attr store1 < 119.504  and attr store1 > 118.704 ))
6 0.1 0.1 peak 474 volume 5.65450 ppm1 7.395 ppm2 0.788
 
! ############### hot_gnoesyNhsqc_051903.475 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.459 and attr store1 > 8.399 ) and bondedto
      (attr store1 < 119.401  and attr store1 > 118.601 ))
6 0.1 0.1 peak 475 volume 34.11337 ppm1 8.429 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.476 NOT folded
assi (attr store1 < 4.463 and attr store1 > 4.363 ) 
     ((attr store1 < 8.458 and attr store1 > 8.398 ) and bondedto
      (attr store1 < 119.406  and attr store1 > 118.606 ))
6 0.1 0.1 peak 476 volume 14.95605 ppm1 8.428 ppm2 4.413
 
! ############### hot_gnoesyNhsqc_051903.477 NOT folded
assi (attr store1 < 4.183 and attr store1 > 4.083 ) 
     ((attr store1 < 8.459 and attr store1 > 8.399 ) and bondedto
      (attr store1 < 119.4  and attr store1 > 118.6 ))
6 0.1 0.1 peak 477 volume 81.83301 ppm1 8.429 ppm2 4.133
 
! ############### hot_gnoesyNhsqc_051903.478 NOT folded
assi (attr store1 < 3.998 and attr store1 > 3.898 ) 
     ((attr store1 < 8.459 and attr store1 > 8.399 ) and bondedto
      (attr store1 < 119.396  and attr store1 > 118.596 ))
6 0.1 0.1 peak 478 volume 44.87653 ppm1 8.429 ppm2 3.948
 
! ############### hot_gnoesyNhsqc_051903.479 NOT folded
assi (attr store1 < 2.448 and attr store1 > 2.348 ) 
     ((attr store1 < 8.459 and attr store1 > 8.399 ) and bondedto
      (attr store1 < 119.369  and attr store1 > 118.569 ))
6 0.1 0.1 peak 479 volume 36.51099 ppm1 8.429 ppm2 2.398
 
! ############### hot_gnoesyNhsqc_051903.480 NOT folded
assi (attr store1 < 2.115 and attr store1 > 2.015 ) 
     ((attr store1 < 8.459 and attr store1 > 8.399 ) and bondedto
      (attr store1 < 119.4  and attr store1 > 118.6 ))
6 0.1 0.1 peak 480 volume 171.49475 ppm1 8.429 ppm2 2.065
 
! ############### hot_gnoesyNhsqc_051903.481 NOT folded
assi (attr store1 < 4.824 and attr store1 > 4.724 ) 
     ((attr store1 < 8.114 and attr store1 > 8.054 ) and bondedto
      (attr store1 < 119.453  and attr store1 > 118.653 ))
6 0.1 0.1 peak 481 volume 13.35315 ppm1 8.084 ppm2 4.774
 
! ############### hot_gnoesyNhsqc_051903.482 NOT folded
assi (attr store1 < 4.294 and attr store1 > 4.194 ) 
     ((attr store1 < 8.115 and attr store1 > 8.055 ) and bondedto
      (attr store1 < 119.425  and attr store1 > 118.625 ))
6 0.1 0.1 peak 482 volume 22.91600 ppm1 8.085 ppm2 4.244
 
! ############### hot_gnoesyNhsqc_051903.484 NOT folded
assi (attr store1 < 3.559 and attr store1 > 3.459 ) 
     ((attr store1 < 8.079 and attr store1 > 8.019 ) and bondedto
      (attr store1 < 119.339  and attr store1 > 118.539 ))
6 0.1 0.1 peak 484 volume 15.38031 ppm1 8.049 ppm2 3.509
 
! ############### hot_gnoesyNhsqc_051903.485 NOT folded
assi (attr store1 < 3.171 and attr store1 > 3.071 ) 
     ((attr store1 < 8.079 and attr store1 > 8.019 ) and bondedto
      (attr store1 < 119.308  and attr store1 > 118.508 ))
6 0.1 0.1 peak 485 volume 14.71890 ppm1 8.049 ppm2 3.121
 
! ############### hot_gnoesyNhsqc_051903.486 NOT folded
assi (attr store1 < 2.98 and attr store1 > 2.88 ) 
     ((attr store1 < 8.081 and attr store1 > 8.021 ) and bondedto
      (attr store1 < 119.328  and attr store1 > 118.528 ))
6 0.1 0.1 peak 486 volume 31.52687 ppm1 8.051 ppm2 2.930
 
! ############### hot_gnoesyNhsqc_051903.487 NOT folded
assi (attr store1 < 2.664 and attr store1 > 2.564 ) 
     ((attr store1 < 8.081 and attr store1 > 8.021 ) and bondedto
      (attr store1 < 119.336  and attr store1 > 118.536 ))
6 0.1 0.1 peak 487 volume 31.96211 ppm1 8.051 ppm2 2.614
 
! ############### hot_gnoesyNhsqc_051903.488 NOT folded
assi (attr store1 < 2.292 and attr store1 > 2.192 ) 
     ((attr store1 < 8.083 and attr store1 > 8.023 ) and bondedto
      (attr store1 < 119.365  and attr store1 > 118.565 ))
6 0.1 0.1 peak 488 volume 7.87955 ppm1 8.053 ppm2 2.242
 
! ############### hot_gnoesyNhsqc_051903.489 NOT folded
assi (attr store1 < 1.377 and attr store1 > 1.277 ) 
     ((attr store1 < 8.082 and attr store1 > 8.022 ) and bondedto
      (attr store1 < 119.355  and attr store1 > 118.555 ))
6 0.1 0.1 peak 489 volume 32.31217 ppm1 8.052 ppm2 1.327
 
! ############### hot_gnoesyNhsqc_051903.490 NOT folded
assi (attr store1 < 1.008 and attr store1 > 0.908 ) 
     ((attr store1 < 8.079 and attr store1 > 8.019 ) and bondedto
      (attr store1 < 119.358  and attr store1 > 118.558 ))
6 0.1 0.1 peak 490 volume 17.19004 ppm1 8.049 ppm2 0.958
 
! ############### hot_gnoesyNhsqc_051903.491 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.979 and attr store1 > 7.919 ) and bondedto
      (attr store1 < 119.459  and attr store1 > 118.659 ))
6 0.1 0.1 peak 491 volume 113.95205 ppm1 7.949 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.492 NOT folded
assi (attr store1 < 4.332 and attr store1 > 4.232 ) 
     ((attr store1 < 7.979 and attr store1 > 7.919 ) and bondedto
      (attr store1 < 119.461  and attr store1 > 118.661 ))
6 0.1 0.1 peak 492 volume 132.84592 ppm1 7.949 ppm2 4.282
 
! ############### hot_gnoesyNhsqc_051903.493 NOT folded
assi (attr store1 < 4.823 and attr store1 > 4.723 ) 
     ((attr store1 < 7.644 and attr store1 > 7.584 ) and bondedto
      (attr store1 < 119.371  and attr store1 > 118.571 ))
6 0.1 0.1 peak 493 volume 8.82734 ppm1 7.614 ppm2 4.773
 
! ############### hot_gnoesyNhsqc_051903.494 NOT folded
assi (attr store1 < 4.154 and attr store1 > 4.054 ) 
     ((attr store1 < 7.641 and attr store1 > 7.581 ) and bondedto
      (attr store1 < 119.313  and attr store1 > 118.513 ))
6 0.1 0.1 peak 494 volume 76.99674 ppm1 7.611 ppm2 4.104
 
! ############### hot_gnoesyNhsqc_051903.495 NOT folded
assi (attr store1 < 1.807 and attr store1 > 1.707 ) 
     ((attr store1 < 7.643 and attr store1 > 7.583 ) and bondedto
      (attr store1 < 119.381  and attr store1 > 118.581 ))
6 0.1 0.1 peak 495 volume 45.51278 ppm1 7.613 ppm2 1.757
 
! ############### hot_gnoesyNhsqc_051903.496 NOT folded
assi (attr store1 < 1.595 and attr store1 > 1.495 ) 
     ((attr store1 < 7.646 and attr store1 > 7.586 ) and bondedto
      (attr store1 < 119.461  and attr store1 > 118.661 ))
6 0.1 0.1 peak 496 volume 71.60243 ppm1 7.616 ppm2 1.545
 
! ############### hot_gnoesyNhsqc_051903.497 NOT folded
assi (attr store1 < 0.974 and attr store1 > 0.874 ) 
     ((attr store1 < 7.64 and attr store1 > 7.58 ) and bondedto
      (attr store1 < 119.302  and attr store1 > 118.502 ))
6 0.1 0.1 peak 497 volume 12.20326 ppm1 7.610 ppm2 0.924
 
! ############### hot_gnoesyNhsqc_051903.498 NOT folded
assi (attr store1 < 3.713 and attr store1 > 3.613 ) 
     ((attr store1 < 7.427 and attr store1 > 7.367 ) and bondedto
      (attr store1 < 119.423  and attr store1 > 118.623 ))
6 0.1 0.1 peak 498 volume 16.04141 ppm1 7.397 ppm2 3.663
 
! ############### hot_gnoesyNhsqc_051903.499 NOT folded
assi (attr store1 < 2.216 and attr store1 > 2.116 ) 
     ((attr store1 < 7.427 and attr store1 > 7.367 ) and bondedto
      (attr store1 < 119.428  and attr store1 > 118.628 ))
6 0.1 0.1 peak 499 volume 9.40226 ppm1 7.397 ppm2 2.166
 
! ############### hot_gnoesyNhsqc_051903.500 NOT folded
assi (attr store1 < 1.596 and attr store1 > 1.496 ) 
     ((attr store1 < 7.43 and attr store1 > 7.37 ) and bondedto
      (attr store1 < 119.403  and attr store1 > 118.603 ))
6 0.1 0.1 peak 500 volume 12.50364 ppm1 7.400 ppm2 1.546
 
! ############### hot_gnoesyNhsqc_051903.501 NOT folded
assi (attr store1 < 4.824 and attr store1 > 4.724 ) 
     ((attr store1 < 7.426 and attr store1 > 7.366 ) and bondedto
      (attr store1 < 119.402  and attr store1 > 118.602 ))
6 0.1 0.1 peak 501 volume 7.30701 ppm1 7.396 ppm2 4.774
 
! ############### hot_gnoesyNhsqc_051903.502 NOT folded
assi (attr store1 < 4.289 and attr store1 > 4.189 ) 
     ((attr store1 < 7.426 and attr store1 > 7.366 ) and bondedto
      (attr store1 < 119.425  and attr store1 > 118.625 ))
6 0.1 0.1 peak 502 volume 42.70816 ppm1 7.396 ppm2 4.239
 
! ############### hot_gnoesyNhsqc_051903.504 NOT folded
assi (attr store1 < 3.094 and attr store1 > 2.994 ) 
     ((attr store1 < 7.425 and attr store1 > 7.365 ) and bondedto
      (attr store1 < 119.429  and attr store1 > 118.629 ))
6 0.1 0.1 peak 504 volume 42.84981 ppm1 7.395 ppm2 3.044
 
! ############### hot_gnoesyNhsqc_051903.505 NOT folded
assi (attr store1 < 2.923 and attr store1 > 2.823 ) 
     ((attr store1 < 7.425 and attr store1 > 7.365 ) and bondedto
      (attr store1 < 119.422  and attr store1 > 118.622 ))
6 0.1 0.1 peak 505 volume 51.19909 ppm1 7.395 ppm2 2.873
 
! ############### hot_gnoesyNhsqc_051903.506 NOT folded
assi (attr store1 < 2.425 and attr store1 > 2.325 ) 
     ((attr store1 < 7.422 and attr store1 > 7.362 ) and bondedto
      (attr store1 < 119.324  and attr store1 > 118.524 ))
6 0.1 0.1 peak 506 volume 6.28396 ppm1 7.392 ppm2 2.375
 
! ############### hot_gnoesyNhsqc_051903.507 NOT folded
assi (attr store1 < 1.938 and attr store1 > 1.838 ) 
     ((attr store1 < 7.425 and attr store1 > 7.365 ) and bondedto
      (attr store1 < 119.429  and attr store1 > 118.629 ))
6 0.1 0.1 peak 507 volume 45.92783 ppm1 7.395 ppm2 1.888
 
! ############### hot_gnoesyNhsqc_051903.508 NOT folded
assi (attr store1 < 0.972 and attr store1 > 0.872 ) 
     ((attr store1 < 7.426 and attr store1 > 7.366 ) and bondedto
      (attr store1 < 119.425  and attr store1 > 118.625 ))
6 0.1 0.1 peak 508 volume 6.48576 ppm1 7.396 ppm2 0.922
 
! ############### hot_gnoesyNhsqc_051903.509 NOT folded
assi (attr store1 < 5.096 and attr store1 > 4.996 ) 
     ((attr store1 < 8.771 and attr store1 > 8.711 ) and bondedto
      (attr store1 < 119.104  and attr store1 > 118.304 ))
6 0.1 0.1 peak 509 volume 6.50740 ppm1 8.741 ppm2 5.046
 
! ############### hot_gnoesyNhsqc_051903.510 NOT folded
assi (attr store1 < 4.817 and attr store1 > 4.717 ) 
     ((attr store1 < 8.775 and attr store1 > 8.715 ) and bondedto
      (attr store1 < 119.124  and attr store1 > 118.324 ))
6 0.1 0.1 peak 510 volume 6.05441 ppm1 8.745 ppm2 4.767
 
! ############### hot_gnoesyNhsqc_051903.511 NOT folded
assi (attr store1 < 4.392 and attr store1 > 4.292 ) 
     ((attr store1 < 8.771 and attr store1 > 8.711 ) and bondedto
      (attr store1 < 119.123  and attr store1 > 118.323 ))
6 0.1 0.1 peak 511 volume 15.85719 ppm1 8.741 ppm2 4.342
 
! ############### hot_gnoesyNhsqc_051903.512 NOT folded
assi (attr store1 < 4.021 and attr store1 > 3.921 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 119.16  and attr store1 > 118.36 ))
6 0.1 0.1 peak 512 volume 21.44113 ppm1 8.740 ppm2 3.971
 
! ############### hot_gnoesyNhsqc_051903.514 NOT folded
assi (attr store1 < 3.584 and attr store1 > 3.484 ) 
     ((attr store1 < 8.771 and attr store1 > 8.711 ) and bondedto
      (attr store1 < 119.108  and attr store1 > 118.308 ))
6 0.1 0.1 peak 514 volume 30.55031 ppm1 8.741 ppm2 3.534
 
! ############### hot_gnoesyNhsqc_051903.515 NOT folded
assi (attr store1 < 3.255 and attr store1 > 3.155 ) 
     ((attr store1 < 8.772 and attr store1 > 8.712 ) and bondedto
      (attr store1 < 119.109  and attr store1 > 118.309 ))
6 0.1 0.1 peak 515 volume 28.17748 ppm1 8.742 ppm2 3.205
 
! ############### hot_gnoesyNhsqc_051903.516 NOT folded
assi (attr store1 < 3.06 and attr store1 > 2.96 ) 
     ((attr store1 < 8.773 and attr store1 > 8.713 ) and bondedto
      (attr store1 < 119.127  and attr store1 > 118.327 ))
6 0.1 0.1 peak 516 volume 23.90021 ppm1 8.743 ppm2 3.010
 
! ############### hot_gnoesyNhsqc_051903.517 NOT folded
assi (attr store1 < 2.432 and attr store1 > 2.332 ) 
     ((attr store1 < 8.776 and attr store1 > 8.716 ) and bondedto
      (attr store1 < 119.126  and attr store1 > 118.326 ))
6 0.1 0.1 peak 517 volume 8.44083 ppm1 8.746 ppm2 2.382
 
! ############### hot_gnoesyNhsqc_051903.518 NOT folded
assi (attr store1 < 1.984 and attr store1 > 1.884 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 119.183  and attr store1 > 118.383 ))
6 0.1 0.1 peak 518 volume 10.58727 ppm1 8.740 ppm2 1.934
 
! ############### hot_gnoesyNhsqc_051903.519 NOT folded
assi (attr store1 < 1.579 and attr store1 > 1.479 ) 
     ((attr store1 < 8.772 and attr store1 > 8.712 ) and bondedto
      (attr store1 < 119.112  and attr store1 > 118.312 ))
6 0.1 0.1 peak 519 volume 40.33630 ppm1 8.742 ppm2 1.529
 
! ############### hot_gnoesyNhsqc_051903.520 NOT folded
assi (attr store1 < 0.955 and attr store1 > 0.855 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 119.191  and attr store1 > 118.391 ))
6 0.1 0.1 peak 520 volume 5.10872 ppm1 8.740 ppm2 0.905
 
! ############### hot_gnoesyNhsqc_051903.521 NOT folded
assi (attr store1 < 0.83 and attr store1 > 0.73 ) 
     ((attr store1 < 8.771 and attr store1 > 8.711 ) and bondedto
      (attr store1 < 119.111  and attr store1 > 118.311 ))
6 0.1 0.1 peak 521 volume 10.31814 ppm1 8.741 ppm2 0.780
 
! ############### hot_gnoesyNhsqc_051903.522 NOT folded
assi (attr store1 < 2.177 and attr store1 > 2.077 ) 
     ((attr store1 < 8.768 and attr store1 > 8.708 ) and bondedto
      (attr store1 < 119.149  and attr store1 > 118.349 ))
6 0.1 0.1 peak 522 volume 12.36187 ppm1 8.738 ppm2 2.127
 
! ############### hot_gnoesyNhsqc_051903.523 NOT folded
assi (attr store1 < 1.359 and attr store1 > 1.259 ) 
     ((attr store1 < 8.767 and attr store1 > 8.707 ) and bondedto
      (attr store1 < 119.118  and attr store1 > 118.318 ))
6 0.1 0.1 peak 523 volume 7.10580 ppm1 8.737 ppm2 1.309
 
! ############### hot_gnoesyNhsqc_051903.524 NOT folded
assi (attr store1 < 1.944 and attr store1 > 1.844 ) 
     ((attr store1 < 7.927 and attr store1 > 7.867 ) and bondedto
      (attr store1 < 119.084  and attr store1 > 118.284 ))
6 0.1 0.1 peak 524 volume 9.09870 ppm1 7.897 ppm2 1.894
 
! ############### hot_gnoesyNhsqc_051903.525 NOT folded
assi (attr store1 < 3.931 and attr store1 > 3.831 ) 
     ((attr store1 < 7.63 and attr store1 > 7.57 ) and bondedto
      (attr store1 < 119.221  and attr store1 > 118.421 ))
6 0.1 0.1 peak 525 volume 10.59021 ppm1 7.600 ppm2 3.881
 
! ############### hot_gnoesyNhsqc_051903.526 NOT folded
assi (attr store1 < 2.968 and attr store1 > 2.868 ) 
     ((attr store1 < 7.633 and attr store1 > 7.573 ) and bondedto
      (attr store1 < 119.166  and attr store1 > 118.366 ))
6 0.1 0.1 peak 526 volume 11.64365 ppm1 7.603 ppm2 2.918
 
! ############### hot_gnoesyNhsqc_051903.527 NOT folded
assi (attr store1 < 2.57 and attr store1 > 2.47 ) 
     ((attr store1 < 7.634 and attr store1 > 7.574 ) and bondedto
      (attr store1 < 119.158  and attr store1 > 118.358 ))
6 0.1 0.1 peak 527 volume 30.04678 ppm1 7.604 ppm2 2.520
 
! ############### hot_gnoesyNhsqc_051903.528 NOT folded
assi (attr store1 < 2.437 and attr store1 > 2.337 ) 
     ((attr store1 < 7.634 and attr store1 > 7.574 ) and bondedto
      (attr store1 < 119.175  and attr store1 > 118.375 ))
6 0.1 0.1 peak 528 volume 31.14027 ppm1 7.604 ppm2 2.387
 
! ############### hot_gnoesyNhsqc_051903.529 NOT folded
assi (attr store1 < 2.236 and attr store1 > 2.136 ) 
     ((attr store1 < 7.634 and attr store1 > 7.574 ) and bondedto
      (attr store1 < 119.168  and attr store1 > 118.368 ))
6 0.1 0.1 peak 529 volume 84.58315 ppm1 7.604 ppm2 2.186
 
! ############### hot_gnoesyNhsqc_051903.530 NOT folded
assi (attr store1 < 1.915 and attr store1 > 1.815 ) 
     ((attr store1 < 7.634 and attr store1 > 7.574 ) and bondedto
      (attr store1 < 119.163  and attr store1 > 118.363 ))
6 0.1 0.1 peak 530 volume 41.61031 ppm1 7.604 ppm2 1.865
 
! ############### hot_gnoesyNhsqc_051903.531 NOT folded
assi (attr store1 < 1.891 and attr store1 > 1.791 ) 
     ((attr store1 < 8.457 and attr store1 > 8.397 ) and bondedto
      (attr store1 < 118.851  and attr store1 > 118.051 ))
6 0.1 0.1 peak 531 volume 22.58829 ppm1 8.427 ppm2 1.841
 
! ############### hot_gnoesyNhsqc_051903.532 NOT folded
assi (attr store1 < 0.807 and attr store1 > 0.707 ) 
     ((attr store1 < 8.456 and attr store1 > 8.396 ) and bondedto
      (attr store1 < 118.783  and attr store1 > 117.983 ))
6 0.1 0.1 peak 532 volume 6.57702 ppm1 8.426 ppm2 0.757
 
! ############### hot_gnoesyNhsqc_051903.534 NOT folded
assi (attr store1 < 3.208 and attr store1 > 3.108 ) 
     ((attr store1 < 8.451 and attr store1 > 8.391 ) and bondedto
      (attr store1 < 118.842  and attr store1 > 118.042 ))
6 0.1 0.1 peak 534 volume 5.41434 ppm1 8.421 ppm2 3.158
 
! ############### hot_gnoesyNhsqc_051903.535 NOT folded
assi (attr store1 < 2.864 and attr store1 > 2.764 ) 
     ((attr store1 < 8.455 and attr store1 > 8.395 ) and bondedto
      (attr store1 < 118.824  and attr store1 > 118.024 ))
6 0.1 0.1 peak 535 volume 13.14286 ppm1 8.425 ppm2 2.814
 
! ############### hot_gnoesyNhsqc_051903.536 NOT folded
assi (attr store1 < 1.589 and attr store1 > 1.489 ) 
     ((attr store1 < 8.454 and attr store1 > 8.394 ) and bondedto
      (attr store1 < 118.801  and attr store1 > 118.001 ))
6 0.1 0.1 peak 536 volume 23.41823 ppm1 8.424 ppm2 1.539
 
! ############### hot_gnoesyNhsqc_051903.537 NOT folded
assi (attr store1 < 1.108 and attr store1 > 1.008 ) 
     ((attr store1 < 8.455 and attr store1 > 8.395 ) and bondedto
      (attr store1 < 118.78  and attr store1 > 117.98 ))
6 0.1 0.1 peak 537 volume 29.09867 ppm1 8.425 ppm2 1.058
 
! ############### hot_gnoesyNhsqc_051903.538 NOT folded
assi (attr store1 < 4.818 and attr store1 > 4.718 ) 
     ((attr store1 < 8.071 and attr store1 > 8.011 ) and bondedto
      (attr store1 < 118.831  and attr store1 > 118.031 ))
6 0.1 0.1 peak 538 volume 5.49502 ppm1 8.041 ppm2 4.768
 
! ############### hot_gnoesyNhsqc_051903.539 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.886 and attr store1 > 7.826 ) and bondedto
      (attr store1 < 118.823  and attr store1 > 118.023 ))
6 0.1 0.1 peak 539 volume 132.78172 ppm1 7.856 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.540 NOT folded
assi (attr store1 < 4.565 and attr store1 > 4.465 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 118.818  and attr store1 > 118.018 ))
6 0.1 0.1 peak 540 volume 98.51072 ppm1 7.855 ppm2 4.515
 
! ############### hot_gnoesyNhsqc_051903.541 NOT folded
assi (attr store1 < 4.424 and attr store1 > 4.324 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 118.823  and attr store1 > 118.023 ))
6 0.1 0.1 peak 541 volume 27.76893 ppm1 7.855 ppm2 4.374
 
! ############### hot_gnoesyNhsqc_051903.542 NOT folded
assi (attr store1 < 4.266 and attr store1 > 4.166 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 118.823  and attr store1 > 118.023 ))
6 0.1 0.1 peak 542 volume 149.08374 ppm1 7.855 ppm2 4.216
 
! ############### hot_gnoesyNhsqc_051903.543 NOT folded
assi (attr store1 < 3.128 and attr store1 > 3.028 ) 
     ((attr store1 < 7.886 and attr store1 > 7.826 ) and bondedto
      (attr store1 < 118.825  and attr store1 > 118.025 ))
6 0.1 0.1 peak 543 volume 115.55792 ppm1 7.856 ppm2 3.078
 
! ############### hot_gnoesyNhsqc_051903.544 NOT folded
assi (attr store1 < 3.022 and attr store1 > 2.922 ) 
     ((attr store1 < 7.886 and attr store1 > 7.826 ) and bondedto
      (attr store1 < 118.825  and attr store1 > 118.025 ))
6 0.1 0.1 peak 544 volume 148.30325 ppm1 7.856 ppm2 2.972
 
! ############### hot_gnoesyNhsqc_051903.546 NOT folded
assi (attr store1 < 2.624 and attr store1 > 2.524 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 118.851  and attr store1 > 118.051 ))
6 0.1 0.1 peak 546 volume 8.87735 ppm1 7.855 ppm2 2.574
 
! ############### hot_gnoesyNhsqc_051903.547 NOT folded
assi (attr store1 < 1.33 and attr store1 > 1.23 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 118.824  and attr store1 > 118.024 ))
6 0.1 0.1 peak 547 volume 74.41719 ppm1 7.855 ppm2 1.280
 
! ############### hot_gnoesyNhsqc_051903.548 NOT folded
assi (attr store1 < 4.021 and attr store1 > 3.921 ) 
     ((attr store1 < 7.844 and attr store1 > 7.784 ) and bondedto
      (attr store1 < 118.868  and attr store1 > 118.068 ))
6 0.1 0.1 peak 548 volume 71.98714 ppm1 7.814 ppm2 3.971
 
! ############### hot_gnoesyNhsqc_051903.549 NOT folded
assi (attr store1 < 2.297 and attr store1 > 2.197 ) 
     ((attr store1 < 7.843 and attr store1 > 7.783 ) and bondedto
      (attr store1 < 118.874  and attr store1 > 118.074 ))
6 0.1 0.1 peak 549 volume 69.36010 ppm1 7.813 ppm2 2.247
 
! ############### hot_gnoesyNhsqc_051903.550 NOT folded
assi (attr store1 < 2.117 and attr store1 > 2.017 ) 
     ((attr store1 < 7.843 and attr store1 > 7.783 ) and bondedto
      (attr store1 < 118.87  and attr store1 > 118.07 ))
6 0.1 0.1 peak 550 volume 140.44257 ppm1 7.813 ppm2 2.067
 
! ############### hot_gnoesyNhsqc_051903.551 NOT folded
assi (attr store1 < 1.636 and attr store1 > 1.536 ) 
     ((attr store1 < 7.843 and attr store1 > 7.783 ) and bondedto
      (attr store1 < 118.825  and attr store1 > 118.025 ))
6 0.1 0.1 peak 551 volume 8.03954 ppm1 7.813 ppm2 1.586
 
! ############### hot_gnoesyNhsqc_051903.552 NOT folded
assi (attr store1 < 3.929 and attr store1 > 3.829 ) 
     ((attr store1 < 8.075 and attr store1 > 8.015 ) and bondedto
      (attr store1 < 118.6  and attr store1 > 117.8 ))
6 0.1 0.1 peak 552 volume 39.70584 ppm1 8.045 ppm2 3.879
 
! ############### hot_gnoesyNhsqc_051903.553 NOT folded
assi (attr store1 < 3.243 and attr store1 > 3.143 ) 
     ((attr store1 < 8.073 and attr store1 > 8.013 ) and bondedto
      (attr store1 < 118.666  and attr store1 > 117.866 ))
6 0.1 0.1 peak 553 volume 14.12106 ppm1 8.043 ppm2 3.193
 
! ############### hot_gnoesyNhsqc_051903.554 NOT folded
assi (attr store1 < 2.41 and attr store1 > 2.31 ) 
     ((attr store1 < 8.074 and attr store1 > 8.014 ) and bondedto
      (attr store1 < 118.65  and attr store1 > 117.85 ))
6 0.1 0.1 peak 554 volume 5.91703 ppm1 8.044 ppm2 2.360
 
! ############### hot_gnoesyNhsqc_051903.555 NOT folded
assi (attr store1 < 1.932 and attr store1 > 1.832 ) 
     ((attr store1 < 8.076 and attr store1 > 8.016 ) and bondedto
      (attr store1 < 118.598  and attr store1 > 117.798 ))
6 0.1 0.1 peak 555 volume 101.75475 ppm1 8.046 ppm2 1.882
 
! ############### hot_gnoesyNhsqc_051903.556 NOT folded
assi (attr store1 < 1.602 and attr store1 > 1.502 ) 
     ((attr store1 < 8.076 and attr store1 > 8.016 ) and bondedto
      (attr store1 < 118.608  and attr store1 > 117.808 ))
6 0.1 0.1 peak 556 volume 23.10368 ppm1 8.046 ppm2 1.552
 
! ############### hot_gnoesyNhsqc_051903.557 NOT folded
assi (attr store1 < 1.257 and attr store1 > 1.157 ) 
     ((attr store1 < 8.074 and attr store1 > 8.014 ) and bondedto
      (attr store1 < 118.619  and attr store1 > 117.819 ))
6 0.1 0.1 peak 557 volume 14.78199 ppm1 8.044 ppm2 1.207
 
! ############### hot_gnoesyNhsqc_051903.558 NOT folded
assi (attr store1 < 0.962 and attr store1 > 0.862 ) 
     ((attr store1 < 8.071 and attr store1 > 8.011 ) and bondedto
      (attr store1 < 118.634  and attr store1 > 117.834 ))
6 0.1 0.1 peak 558 volume 25.32799 ppm1 8.041 ppm2 0.912
 
! ############### hot_gnoesyNhsqc_051903.559 NOT folded
assi (attr store1 < 0.796 and attr store1 > 0.696 ) 
     ((attr store1 < 8.077 and attr store1 > 8.017 ) and bondedto
      (attr store1 < 118.587  and attr store1 > 117.787 ))
6 0.1 0.1 peak 559 volume 16.38349 ppm1 8.047 ppm2 0.746
 
! ############### hot_gnoesyNhsqc_051903.560 NOT folded
assi (attr store1 < 1.266 and attr store1 > 1.166 ) 
     ((attr store1 < 8.031 and attr store1 > 7.971 ) and bondedto
      (attr store1 < 118.678  and attr store1 > 117.878 ))
6 0.1 0.1 peak 560 volume 9.38370 ppm1 8.001 ppm2 1.216
 
! ############### hot_gnoesyNhsqc_051903.561 NOT folded
assi (attr store1 < 4.708 and attr store1 > 4.608 ) 
     ((attr store1 < 8.015 and attr store1 > 7.955 ) and bondedto
      (attr store1 < 118.676  and attr store1 > 117.876 ))
6 0.1 0.1 peak 561 volume 15.03364 ppm1 7.985 ppm2 4.658
 
! ############### hot_gnoesyNhsqc_051903.562 NOT folded
assi (attr store1 < 4.021 and attr store1 > 3.921 ) 
     ((attr store1 < 8.017 and attr store1 > 7.957 ) and bondedto
      (attr store1 < 118.692  and attr store1 > 117.892 ))
6 0.1 0.1 peak 562 volume 40.85963 ppm1 7.987 ppm2 3.971
 
! ############### hot_gnoesyNhsqc_051903.563 NOT folded
assi (attr store1 < 3.278 and attr store1 > 3.178 ) 
     ((attr store1 < 8.015 and attr store1 > 7.955 ) and bondedto
      (attr store1 < 118.683  and attr store1 > 117.883 ))
6 0.1 0.1 peak 563 volume 21.91110 ppm1 7.985 ppm2 3.228
 
! ############### hot_gnoesyNhsqc_051903.564 NOT folded
assi (attr store1 < 3.086 and attr store1 > 2.986 ) 
     ((attr store1 < 8.017 and attr store1 > 7.957 ) and bondedto
      (attr store1 < 118.699  and attr store1 > 117.899 ))
6 0.1 0.1 peak 564 volume 30.00662 ppm1 7.987 ppm2 3.036
 
! ############### hot_gnoesyNhsqc_051903.566 NOT folded
assi (attr store1 < 1.926 and attr store1 > 1.826 ) 
     ((attr store1 < 8.02 and attr store1 > 7.96 ) and bondedto
      (attr store1 < 118.674  and attr store1 > 117.874 ))
6 0.1 0.1 peak 566 volume 54.26120 ppm1 7.990 ppm2 1.876
 
! ############### hot_gnoesyNhsqc_051903.568 NOT folded
assi (attr store1 < 0.786 and attr store1 > 0.686 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 118.713  and attr store1 > 117.913 ))
6 0.1 0.1 peak 568 volume 6.55243 ppm1 7.993 ppm2 0.736
 
! ############### hot_gnoesyNhsqc_051903.569 NOT folded
assi (attr store1 < 3.574 and attr store1 > 3.474 ) 
     ((attr store1 < 8.011 and attr store1 > 7.951 ) and bondedto
      (attr store1 < 118.704  and attr store1 > 117.904 ))
6 0.1 0.1 peak 569 volume 7.41713 ppm1 7.981 ppm2 3.524
 
! ############### hot_gnoesyNhsqc_051903.570 NOT folded
assi (attr store1 < 4.274 and attr store1 > 4.174 ) 
     ((attr store1 < 8.075 and attr store1 > 8.015 ) and bondedto
      (attr store1 < 118.538  and attr store1 > 117.738 ))
6 0.1 0.1 peak 570 volume 15.42600 ppm1 8.045 ppm2 4.224
 
! ############### hot_gnoesyNhsqc_051903.571 NOT folded
assi (attr store1 < 1.595 and attr store1 > 1.495 ) 
     ((attr store1 < 7.654 and attr store1 > 7.594 ) and bondedto
      (attr store1 < 118.432  and attr store1 > 117.632 ))
6 0.1 0.1 peak 571 volume 6.84906 ppm1 7.624 ppm2 1.545
 
! ############### hot_gnoesyNhsqc_051903.572 NOT folded
assi (attr store1 < 1.983 and attr store1 > 1.883 ) 
     ((attr store1 < 7.388 and attr store1 > 7.328 ) and bondedto
      (attr store1 < 118.45  and attr store1 > 117.65 ))
6 0.1 0.1 peak 572 volume 36.15141 ppm1 7.358 ppm2 1.933
 
! ############### hot_gnoesyNhsqc_051903.573 NOT folded
assi (attr store1 < 4.821 and attr store1 > 4.721 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.451  and attr store1 > 117.651 ))
6 0.1 0.1 peak 573 volume 5.99592 ppm1 7.356 ppm2 4.771
 
! ############### hot_gnoesyNhsqc_051903.574 NOT folded
assi (attr store1 < 4.481 and attr store1 > 4.381 ) 
     ((attr store1 < 7.387 and attr store1 > 7.327 ) and bondedto
      (attr store1 < 118.475  and attr store1 > 117.675 ))
6 0.1 0.1 peak 574 volume 24.69585 ppm1 7.357 ppm2 4.431
 
! ############### hot_gnoesyNhsqc_051903.575 NOT folded
assi (attr store1 < 4.34 and attr store1 > 4.24 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.469  and attr store1 > 117.669 ))
6 0.1 0.1 peak 575 volume 21.65014 ppm1 7.356 ppm2 4.290
 
! ############### hot_gnoesyNhsqc_051903.576 NOT folded
assi (attr store1 < 3.905 and attr store1 > 3.805 ) 
     ((attr store1 < 7.383 and attr store1 > 7.323 ) and bondedto
      (attr store1 < 118.467  and attr store1 > 117.667 ))
6 0.1 0.1 peak 576 volume 22.04785 ppm1 7.353 ppm2 3.855
 
! ############### hot_gnoesyNhsqc_051903.577 NOT folded
assi (attr store1 < 3.702 and attr store1 > 3.602 ) 
     ((attr store1 < 7.385 and attr store1 > 7.325 ) and bondedto
      (attr store1 < 118.446  and attr store1 > 117.646 ))
6 0.1 0.1 peak 577 volume 6.00719 ppm1 7.355 ppm2 3.652
 
! ############### hot_gnoesyNhsqc_051903.578 NOT folded
assi (attr store1 < 3.575 and attr store1 > 3.475 ) 
     ((attr store1 < 7.383 and attr store1 > 7.323 ) and bondedto
      (attr store1 < 118.469  and attr store1 > 117.669 ))
6 0.1 0.1 peak 578 volume 7.88908 ppm1 7.353 ppm2 3.525
 
! ############### hot_gnoesyNhsqc_051903.579 NOT folded
assi (attr store1 < 3.395 and attr store1 > 3.295 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.46  and attr store1 > 117.66 ))
6 0.1 0.1 peak 579 volume 10.74162 ppm1 7.356 ppm2 3.345
 
! ############### hot_gnoesyNhsqc_051903.580 NOT folded
assi (attr store1 < 3.234 and attr store1 > 3.134 ) 
     ((attr store1 < 7.385 and attr store1 > 7.325 ) and bondedto
      (attr store1 < 118.446  and attr store1 > 117.646 ))
6 0.1 0.1 peak 580 volume 10.80825 ppm1 7.355 ppm2 3.184
 
! ############### hot_gnoesyNhsqc_051903.581 NOT folded
assi (attr store1 < 2.947 and attr store1 > 2.847 ) 
     ((attr store1 < 7.385 and attr store1 > 7.325 ) and bondedto
      (attr store1 < 118.483  and attr store1 > 117.683 ))
6 0.1 0.1 peak 581 volume 19.24875 ppm1 7.355 ppm2 2.897
 
! ############### hot_gnoesyNhsqc_051903.582 NOT folded
assi (attr store1 < 2.47 and attr store1 > 2.37 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.458  and attr store1 > 117.658 ))
6 0.1 0.1 peak 582 volume 40.32099 ppm1 7.356 ppm2 2.420
 
! ############### hot_gnoesyNhsqc_051903.583 NOT folded
assi (attr store1 < 2.317 and attr store1 > 2.217 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.456  and attr store1 > 117.656 ))
6 0.1 0.1 peak 583 volume 27.00933 ppm1 7.356 ppm2 2.267
 
! ############### hot_gnoesyNhsqc_051903.584 NOT folded
assi (attr store1 < 2.144 and attr store1 > 2.044 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.457  and attr store1 > 117.657 ))
6 0.1 0.1 peak 584 volume 31.42091 ppm1 7.356 ppm2 2.094
 
! ############### hot_gnoesyNhsqc_051903.585 NOT folded
assi (attr store1 < 1.679 and attr store1 > 1.579 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.463  and attr store1 > 117.663 ))
6 0.1 0.1 peak 585 volume 58.23775 ppm1 7.356 ppm2 1.629
 
! ############### hot_gnoesyNhsqc_051903.586 NOT folded
assi (attr store1 < 0.984 and attr store1 > 0.884 ) 
     ((attr store1 < 7.385 and attr store1 > 7.325 ) and bondedto
      (attr store1 < 118.442  and attr store1 > 117.642 ))
6 0.1 0.1 peak 586 volume 7.08083 ppm1 7.355 ppm2 0.934
 
! ############### hot_gnoesyNhsqc_051903.587 NOT folded
assi (attr store1 < 0.753 and attr store1 > 0.653 ) 
     ((attr store1 < 7.388 and attr store1 > 7.328 ) and bondedto
      (attr store1 < 118.432  and attr store1 > 117.632 ))
6 0.1 0.1 peak 587 volume 8.99449 ppm1 7.358 ppm2 0.703
 
! ############### hot_gnoesyNhsqc_051903.588 NOT folded
assi (attr store1 < 4.511 and attr store1 > 4.411 ) 
     ((attr store1 < 7.214 and attr store1 > 7.154 ) and bondedto
      (attr store1 < 118.35  and attr store1 > 117.55 ))
6 0.1 0.1 peak 588 volume 5.75872 ppm1 7.184 ppm2 4.461
 
! ############### hot_gnoesyNhsqc_051903.589 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.948 and attr store1 > 7.888 ) and bondedto
      (attr store1 < 118.218  and attr store1 > 117.418 ))
6 0.1 0.1 peak 589 volume 23.66399 ppm1 7.918 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.590 NOT folded
assi (attr store1 < 4.333 and attr store1 > 4.233 ) 
     ((attr store1 < 7.948 and attr store1 > 7.888 ) and bondedto
      (attr store1 < 118.213  and attr store1 > 117.413 ))
6 0.1 0.1 peak 590 volume 114.48939 ppm1 7.918 ppm2 4.283
 
! ############### hot_gnoesyNhsqc_051903.591 NOT folded
assi (attr store1 < 2.437 and attr store1 > 2.337 ) 
     ((attr store1 < 7.948 and attr store1 > 7.888 ) and bondedto
      (attr store1 < 118.206  and attr store1 > 117.406 ))
6 0.1 0.1 peak 591 volume 79.94717 ppm1 7.918 ppm2 2.387
 
! ############### hot_gnoesyNhsqc_051903.592 NOT folded
assi (attr store1 < 2.207 and attr store1 > 2.107 ) 
     ((attr store1 < 7.948 and attr store1 > 7.888 ) and bondedto
      (attr store1 < 118.204  and attr store1 > 117.404 ))
6 0.1 0.1 peak 592 volume 56.91551 ppm1 7.918 ppm2 2.157
 
! ############### hot_gnoesyNhsqc_051903.593 NOT folded
assi (attr store1 < 2.066 and attr store1 > 1.966 ) 
     ((attr store1 < 7.948 and attr store1 > 7.888 ) and bondedto
      (attr store1 < 118.215  and attr store1 > 117.415 ))
6 0.1 0.1 peak 593 volume 73.30605 ppm1 7.918 ppm2 2.016
 
! ############### hot_gnoesyNhsqc_051903.594 NOT folded
assi (attr store1 < 0.634 and attr store1 > 0.534 ) 
     ((attr store1 < 7.95 and attr store1 > 7.89 ) and bondedto
      (attr store1 < 118.18  and attr store1 > 117.38 ))
6 0.1 0.1 peak 594 volume 7.20144 ppm1 7.920 ppm2 0.584
 
! ############### hot_gnoesyNhsqc_051903.595 NOT folded
assi (attr store1 < 4.693 and attr store1 > 4.593 ) 
     ((attr store1 < 7.945 and attr store1 > 7.885 ) and bondedto
      (attr store1 < 118.221  and attr store1 > 117.421 ))
6 0.1 0.1 peak 595 volume 6.45274 ppm1 7.915 ppm2 4.643
 
! ############### hot_gnoesyNhsqc_051903.596 NOT folded
assi (attr store1 < 1.83 and attr store1 > 1.73 ) 
     ((attr store1 < 7.947 and attr store1 > 7.887 ) and bondedto
      (attr store1 < 118.189  and attr store1 > 117.389 ))
6 0.1 0.1 peak 596 volume 48.99561 ppm1 7.917 ppm2 1.780
 
! ############### hot_gnoesyNhsqc_051903.597 NOT folded
assi (attr store1 < 1.687 and attr store1 > 1.587 ) 
     ((attr store1 < 7.947 and attr store1 > 7.887 ) and bondedto
      (attr store1 < 118.18  and attr store1 > 117.38 ))
6 0.1 0.1 peak 597 volume 29.57057 ppm1 7.917 ppm2 1.637
 
! ############### hot_gnoesyNhsqc_051903.598 NOT folded
assi (attr store1 < 4.318 and attr store1 > 4.218 ) 
     ((attr store1 < 7.76 and attr store1 > 7.7 ) and bondedto
      (attr store1 < 118.233  and attr store1 > 117.433 ))
6 0.1 0.1 peak 598 volume 14.75030 ppm1 7.730 ppm2 4.268
 
! ############### hot_gnoesyNhsqc_051903.600 NOT folded
assi (attr store1 < 3.584 and attr store1 > 3.484 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 118.2  and attr store1 > 117.4 ))
6 0.1 0.1 peak 600 volume 9.25455 ppm1 7.729 ppm2 3.534
 
! ############### hot_gnoesyNhsqc_051903.601 NOT folded
assi (attr store1 < 2.064 and attr store1 > 1.964 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 118.235  and attr store1 > 117.435 ))
6 0.1 0.1 peak 601 volume 18.09237 ppm1 7.729 ppm2 2.014
 
! ############### hot_gnoesyNhsqc_051903.602 NOT folded
assi (attr store1 < 1.882 and attr store1 > 1.782 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 118.251  and attr store1 > 117.451 ))
6 0.1 0.1 peak 602 volume 18.18769 ppm1 7.729 ppm2 1.832
 
! ############### hot_gnoesyNhsqc_051903.603 NOT folded
assi (attr store1 < 1.585 and attr store1 > 1.485 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 118.23  and attr store1 > 117.43 ))
6 0.1 0.1 peak 603 volume 33.60753 ppm1 7.729 ppm2 1.535
 
! ############### hot_gnoesyNhsqc_051903.604 NOT folded
assi (attr store1 < 1.455 and attr store1 > 1.355 ) 
     ((attr store1 < 7.76 and attr store1 > 7.7 ) and bondedto
      (attr store1 < 118.223  and attr store1 > 117.423 ))
6 0.1 0.1 peak 604 volume 28.77347 ppm1 7.730 ppm2 1.405
 
! ############### hot_gnoesyNhsqc_051903.605 NOT folded
assi (attr store1 < 1.263 and attr store1 > 1.163 ) 
     ((attr store1 < 7.761 and attr store1 > 7.701 ) and bondedto
      (attr store1 < 118.253  and attr store1 > 117.453 ))
6 0.1 0.1 peak 605 volume 28.51522 ppm1 7.731 ppm2 1.213
 
! ############### hot_gnoesyNhsqc_051903.606 NOT folded
assi (attr store1 < 1.011 and attr store1 > 0.911 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 118.252  and attr store1 > 117.452 ))
6 0.1 0.1 peak 606 volume 19.19274 ppm1 7.729 ppm2 0.961
 
! ############### hot_gnoesyNhsqc_051903.609 NOT folded
assi (attr store1 < 2.229 and attr store1 > 2.129 ) 
     ((attr store1 < 7.639 and attr store1 > 7.579 ) and bondedto
      (attr store1 < 118.256  and attr store1 > 117.456 ))
6 0.1 0.1 peak 609 volume 10.29053 ppm1 7.609 ppm2 2.179
 
! ############### hot_gnoesyNhsqc_051903.610 NOT folded
assi (attr store1 < 4.055 and attr store1 > 3.955 ) 
     ((attr store1 < 7.219 and attr store1 > 7.159 ) and bondedto
      (attr store1 < 118.252  and attr store1 > 117.452 ))
6 0.1 0.1 peak 610 volume 40.19859 ppm1 7.189 ppm2 4.005
 
! ############### hot_gnoesyNhsqc_051903.611 NOT folded
assi (attr store1 < 3.54 and attr store1 > 3.44 ) 
     ((attr store1 < 7.219 and attr store1 > 7.159 ) and bondedto
      (attr store1 < 118.225  and attr store1 > 117.425 ))
6 0.1 0.1 peak 611 volume 6.11099 ppm1 7.189 ppm2 3.490
 
! ############### hot_gnoesyNhsqc_051903.612 NOT folded
assi (attr store1 < 2.327 and attr store1 > 2.227 ) 
     ((attr store1 < 7.218 and attr store1 > 7.158 ) and bondedto
      (attr store1 < 118.241  and attr store1 > 117.441 ))
6 0.1 0.1 peak 612 volume 52.51316 ppm1 7.188 ppm2 2.277
 
! ############### hot_gnoesyNhsqc_051903.613 NOT folded
assi (attr store1 < 2.075 and attr store1 > 1.975 ) 
     ((attr store1 < 7.219 and attr store1 > 7.159 ) and bondedto
      (attr store1 < 118.246  and attr store1 > 117.446 ))
6 0.1 0.1 peak 613 volume 68.20515 ppm1 7.189 ppm2 2.025
 
! ############### hot_gnoesyNhsqc_051903.614 NOT folded
assi (attr store1 < 1.513 and attr store1 > 1.413 ) 
     ((attr store1 < 7.221 and attr store1 > 7.161 ) and bondedto
      (attr store1 < 118.251  and attr store1 > 117.451 ))
6 0.1 0.1 peak 614 volume 16.09697 ppm1 7.191 ppm2 1.463
 
! ############### hot_gnoesyNhsqc_051903.615 NOT folded
assi (attr store1 < 1.058 and attr store1 > 0.958 ) 
     ((attr store1 < 7.219 and attr store1 > 7.159 ) and bondedto
      (attr store1 < 118.243  and attr store1 > 117.443 ))
6 0.1 0.1 peak 615 volume 81.26035 ppm1 7.189 ppm2 1.008
 
! ############### hot_gnoesyNhsqc_051903.616 NOT folded
assi (attr store1 < 0.758 and attr store1 > 0.658 ) 
     ((attr store1 < 7.22 and attr store1 > 7.16 ) and bondedto
      (attr store1 < 118.267  and attr store1 > 117.467 ))
6 0.1 0.1 peak 616 volume 5.94519 ppm1 7.190 ppm2 0.708
 
! ############### hot_gnoesyNhsqc_051903.618 NOT folded
assi (attr store1 < 2.662 and attr store1 > 2.562 ) 
     ((attr store1 < 7.913 and attr store1 > 7.853 ) and bondedto
      (attr store1 < 117.917  and attr store1 > 117.117 ))
6 0.1 0.1 peak 618 volume 14.97805 ppm1 7.883 ppm2 2.612
 
! ############### hot_gnoesyNhsqc_051903.619 NOT folded
assi (attr store1 < 1.57 and attr store1 > 1.47 ) 
     ((attr store1 < 7.917 and attr store1 > 7.857 ) and bondedto
      (attr store1 < 117.948  and attr store1 > 117.148 ))
6 0.1 0.1 peak 619 volume 18.02953 ppm1 7.887 ppm2 1.520
 
! ############### hot_gnoesyNhsqc_051903.620 NOT folded
assi (attr store1 < 1.227 and attr store1 > 1.127 ) 
     ((attr store1 < 7.91 and attr store1 > 7.85 ) and bondedto
      (attr store1 < 117.948  and attr store1 > 117.148 ))
6 0.1 0.1 peak 620 volume 5.45191 ppm1 7.880 ppm2 1.177
 
! ############### hot_gnoesyNhsqc_051903.621 NOT folded
assi (attr store1 < 1.016 and attr store1 > 0.916 ) 
     ((attr store1 < 7.914 and attr store1 > 7.854 ) and bondedto
      (attr store1 < 117.914  and attr store1 > 117.114 ))
6 0.1 0.1 peak 621 volume 40.81641 ppm1 7.884 ppm2 0.966
 
! ############### hot_gnoesyNhsqc_051903.622 NOT folded
assi (attr store1 < 3.577 and attr store1 > 3.477 ) 
     ((attr store1 < 7.908 and attr store1 > 7.848 ) and bondedto
      (attr store1 < 117.856  and attr store1 > 117.056 ))
6 0.1 0.1 peak 622 volume 20.68682 ppm1 7.878 ppm2 3.527
 
! ############### hot_gnoesyNhsqc_051903.623 NOT folded
assi (attr store1 < 2.963 and attr store1 > 2.863 ) 
     ((attr store1 < 7.905 and attr store1 > 7.845 ) and bondedto
      (attr store1 < 117.912  and attr store1 > 117.112 ))
6 0.1 0.1 peak 623 volume 16.68855 ppm1 7.875 ppm2 2.913
 
! ############### hot_gnoesyNhsqc_051903.624 NOT folded
assi (attr store1 < 1.59 and attr store1 > 1.49 ) 
     ((attr store1 < 8.727 and attr store1 > 8.667 ) and bondedto
      (attr store1 < 117.651  and attr store1 > 116.851 ))
6 0.1 0.1 peak 624 volume 8.17550 ppm1 8.697 ppm2 1.540
 
! ############### hot_gnoesyNhsqc_051903.625 NOT folded
assi (attr store1 < 3.187 and attr store1 > 3.087 ) 
     ((attr store1 < 7.908 and attr store1 > 7.848 ) and bondedto
      (attr store1 < 117.688  and attr store1 > 116.888 ))
6 0.1 0.1 peak 625 volume 7.07801 ppm1 7.878 ppm2 3.137
 
! ############### hot_gnoesyNhsqc_051903.626 NOT folded
assi (attr store1 < 2.075 and attr store1 > 1.975 ) 
     ((attr store1 < 7.811 and attr store1 > 7.751 ) and bondedto
      (attr store1 < 117.779  and attr store1 > 116.979 ))
6 0.1 0.1 peak 626 volume 10.77974 ppm1 7.781 ppm2 2.025
 
! ############### hot_gnoesyNhsqc_051903.627 NOT folded
assi (attr store1 < 5.616 and attr store1 > 5.516 ) 
     ((attr store1 < 8.729 and attr store1 > 8.669 ) and bondedto
      (attr store1 < 117.567  and attr store1 > 116.767 ))
6 0.1 0.1 peak 627 volume 6.00845 ppm1 8.699 ppm2 5.566
 
! ############### hot_gnoesyNhsqc_051903.628 NOT folded
assi (attr store1 < 4.284 and attr store1 > 4.184 ) 
     ((attr store1 < 8.726 and attr store1 > 8.666 ) and bondedto
      (attr store1 < 117.545  and attr store1 > 116.745 ))
6 0.1 0.1 peak 628 volume 30.87920 ppm1 8.696 ppm2 4.234
 
! ############### hot_gnoesyNhsqc_051903.629 NOT folded
assi (attr store1 < 3.936 and attr store1 > 3.836 ) 
     ((attr store1 < 8.729 and attr store1 > 8.669 ) and bondedto
      (attr store1 < 117.517  and attr store1 > 116.717 ))
6 0.1 0.1 peak 629 volume 11.87473 ppm1 8.699 ppm2 3.886
 
! ############### hot_gnoesyNhsqc_051903.630 NOT folded
assi (attr store1 < 3.718 and attr store1 > 3.618 ) 
     ((attr store1 < 8.729 and attr store1 > 8.669 ) and bondedto
      (attr store1 < 117.516  and attr store1 > 116.716 ))
6 0.1 0.1 peak 630 volume 6.91928 ppm1 8.699 ppm2 3.668
 
! ############### hot_gnoesyNhsqc_051903.631 NOT folded
assi (attr store1 < 3.076 and attr store1 > 2.976 ) 
     ((attr store1 < 8.727 and attr store1 > 8.667 ) and bondedto
      (attr store1 < 117.574  and attr store1 > 116.774 ))
6 0.1 0.1 peak 631 volume 30.74526 ppm1 8.697 ppm2 3.026
 
! ############### hot_gnoesyNhsqc_051903.632 NOT folded
assi (attr store1 < 2.655 and attr store1 > 2.555 ) 
     ((attr store1 < 8.725 and attr store1 > 8.665 ) and bondedto
      (attr store1 < 117.594  and attr store1 > 116.794 ))
6 0.1 0.1 peak 632 volume 19.38054 ppm1 8.695 ppm2 2.605
 
! ############### hot_gnoesyNhsqc_051903.633 NOT folded
assi (attr store1 < 0.977 and attr store1 > 0.877 ) 
     ((attr store1 < 8.726 and attr store1 > 8.666 ) and bondedto
      (attr store1 < 117.568  and attr store1 > 116.768 ))
6 0.1 0.1 peak 633 volume 10.92438 ppm1 8.696 ppm2 0.927
 
! ############### hot_gnoesyNhsqc_051903.634 NOT folded
assi (attr store1 < 0.835 and attr store1 > 0.735 ) 
     ((attr store1 < 8.727 and attr store1 > 8.667 ) and bondedto
      (attr store1 < 117.579  and attr store1 > 116.779 ))
6 0.1 0.1 peak 634 volume 10.09081 ppm1 8.697 ppm2 0.785
 
! ############### hot_gnoesyNhsqc_051903.635 NOT folded
assi (attr store1 < 5.101 and attr store1 > 5.001 ) 
     ((attr store1 < 8.718 and attr store1 > 8.658 ) and bondedto
      (attr store1 < 117.056  and attr store1 > 116.256 ))
6 0.1 0.1 peak 635 volume 5.46664 ppm1 8.688 ppm2 5.051
 
! ############### hot_gnoesyNhsqc_051903.636 NOT folded
assi (attr store1 < 2.386 and attr store1 > 2.286 ) 
     ((attr store1 < 8.718 and attr store1 > 8.658 ) and bondedto
      (attr store1 < 117.086  and attr store1 > 116.286 ))
6 0.1 0.1 peak 636 volume 5.32729 ppm1 8.688 ppm2 2.336
 
! ############### hot_gnoesyNhsqc_051903.637 NOT folded
assi (attr store1 < 1.555 and attr store1 > 1.455 ) 
     ((attr store1 < 8.721 and attr store1 > 8.661 ) and bondedto
      (attr store1 < 117.095  and attr store1 > 116.295 ))
6 0.1 0.1 peak 637 volume 5.49242 ppm1 8.691 ppm2 1.505
 
! ############### hot_gnoesyNhsqc_051903.638 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.714 and attr store1 > 8.654 ) and bondedto
      (attr store1 < 117.065  and attr store1 > 116.265 ))
6 0.1 0.1 peak 638 volume 52.63091 ppm1 8.684 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.641 NOT folded
assi (attr store1 < 1.977 and attr store1 > 1.877 ) 
     ((attr store1 < 8.713 and attr store1 > 8.653 ) and bondedto
      (attr store1 < 117.098  and attr store1 > 116.298 ))
6 0.1 0.1 peak 641 volume 24.93134 ppm1 8.683 ppm2 1.927
 
! ############### hot_gnoesyNhsqc_051903.643 NOT folded
assi (attr store1 < 3.745 and attr store1 > 3.645 ) 
     ((attr store1 < 8.565 and attr store1 > 8.505 ) and bondedto
      (attr store1 < 117.062  and attr store1 > 116.262 ))
6 0.1 0.1 peak 643 volume 5.44181 ppm1 8.535 ppm2 3.695
 
! ############### hot_gnoesyNhsqc_051903.644 NOT folded
assi (attr store1 < 3.568 and attr store1 > 3.468 ) 
     ((attr store1 < 8.561 and attr store1 > 8.501 ) and bondedto
      (attr store1 < 117.087  and attr store1 > 116.287 ))
6 0.1 0.1 peak 644 volume 10.00972 ppm1 8.531 ppm2 3.518
 
! ############### hot_gnoesyNhsqc_051903.645 NOT folded
assi (attr store1 < 4.093 and attr store1 > 3.993 ) 
     ((attr store1 < 8.559 and attr store1 > 8.499 ) and bondedto
      (attr store1 < 117.09  and attr store1 > 116.29 ))
6 0.1 0.1 peak 645 volume 29.41662 ppm1 8.529 ppm2 4.043
 
! ############### hot_gnoesyNhsqc_051903.646 NOT folded
assi (attr store1 < 2.946 and attr store1 > 2.846 ) 
     ((attr store1 < 8.555 and attr store1 > 8.495 ) and bondedto
      (attr store1 < 117.109  and attr store1 > 116.309 ))
6 0.1 0.1 peak 646 volume 6.61637 ppm1 8.525 ppm2 2.896
 
! ############### hot_gnoesyNhsqc_051903.647 NOT folded
assi (attr store1 < 2.653 and attr store1 > 2.553 ) 
     ((attr store1 < 8.558 and attr store1 > 8.498 ) and bondedto
      (attr store1 < 117.099  and attr store1 > 116.299 ))
6 0.1 0.1 peak 647 volume 28.16779 ppm1 8.528 ppm2 2.603
 
! ############### hot_gnoesyNhsqc_051903.648 NOT folded
assi (attr store1 < 2.175 and attr store1 > 2.075 ) 
     ((attr store1 < 8.557 and attr store1 > 8.497 ) and bondedto
      (attr store1 < 117.088  and attr store1 > 116.288 ))
6 0.1 0.1 peak 648 volume 37.18933 ppm1 8.527 ppm2 2.125
 
! ############### hot_gnoesyNhsqc_051903.649 NOT folded
assi (attr store1 < 1.899 and attr store1 > 1.799 ) 
     ((attr store1 < 8.558 and attr store1 > 8.498 ) and bondedto
      (attr store1 < 117.096  and attr store1 > 116.296 ))
6 0.1 0.1 peak 649 volume 46.51284 ppm1 8.528 ppm2 1.849
 
! ############### hot_gnoesyNhsqc_051903.650 NOT folded
assi (attr store1 < 1.542 and attr store1 > 1.442 ) 
     ((attr store1 < 8.56 and attr store1 > 8.5 ) and bondedto
      (attr store1 < 117.076  and attr store1 > 116.276 ))
6 0.1 0.1 peak 650 volume 11.71334 ppm1 8.530 ppm2 1.492
 
! ############### hot_gnoesyNhsqc_051903.651 NOT folded
assi (attr store1 < 1.419 and attr store1 > 1.319 ) 
     ((attr store1 < 8.557 and attr store1 > 8.497 ) and bondedto
      (attr store1 < 117.094  and attr store1 > 116.294 ))
6 0.1 0.1 peak 651 volume 11.51152 ppm1 8.527 ppm2 1.369
 
! ############### hot_gnoesyNhsqc_051903.652 NOT folded
assi (attr store1 < 1.033 and attr store1 > 0.933 ) 
     ((attr store1 < 8.558 and attr store1 > 8.498 ) and bondedto
      (attr store1 < 117.095  and attr store1 > 116.295 ))
6 0.1 0.1 peak 652 volume 40.35815 ppm1 8.528 ppm2 0.983
 
! ############### hot_gnoesyNhsqc_051903.653 NOT folded
assi (attr store1 < 2.473 and attr store1 > 2.373 ) 
     ((attr store1 < 7.941 and attr store1 > 7.881 ) and bondedto
      (attr store1 < 117.077  and attr store1 > 116.277 ))
6 0.1 0.1 peak 653 volume 6.97282 ppm1 7.911 ppm2 2.423
 
! ############### hot_gnoesyNhsqc_051903.654 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.349 and attr store1 > 8.289 ) and bondedto
      (attr store1 < 116.799  and attr store1 > 115.999 ))
6 0.1 0.1 peak 654 volume 99.15791 ppm1 8.319 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.655 NOT folded
assi (attr store1 < 4.363 and attr store1 > 4.263 ) 
     ((attr store1 < 8.349 and attr store1 > 8.289 ) and bondedto
      (attr store1 < 116.799  and attr store1 > 115.999 ))
6 0.1 0.1 peak 655 volume 114.14836 ppm1 8.319 ppm2 4.313
 
! ############### hot_gnoesyNhsqc_051903.656 NOT folded
assi (attr store1 < 4.212 and attr store1 > 4.112 ) 
     ((attr store1 < 8.349 and attr store1 > 8.289 ) and bondedto
      (attr store1 < 116.795  and attr store1 > 115.995 ))
6 0.1 0.1 peak 656 volume 54.16150 ppm1 8.319 ppm2 4.162
 
! ############### hot_gnoesyNhsqc_051903.657 NOT folded
assi (attr store1 < 4.022 and attr store1 > 3.922 ) 
     ((attr store1 < 8.35 and attr store1 > 8.29 ) and bondedto
      (attr store1 < 116.794  and attr store1 > 115.994 ))
6 0.1 0.1 peak 657 volume 63.89980 ppm1 8.320 ppm2 3.972
 
! ############### hot_gnoesyNhsqc_051903.658 NOT folded
assi (attr store1 < 2.373 and attr store1 > 2.273 ) 
     ((attr store1 < 8.35 and attr store1 > 8.29 ) and bondedto
      (attr store1 < 116.803  and attr store1 > 116.003 ))
6 0.1 0.1 peak 658 volume 14.46142 ppm1 8.320 ppm2 2.323
 
! ############### hot_gnoesyNhsqc_051903.659 NOT folded
assi (attr store1 < 2.283 and attr store1 > 2.183 ) 
     ((attr store1 < 8.35 and attr store1 > 8.29 ) and bondedto
      (attr store1 < 116.79  and attr store1 > 115.99 ))
6 0.1 0.1 peak 659 volume 16.09932 ppm1 8.320 ppm2 2.233
 
! ############### hot_gnoesyNhsqc_051903.660 NOT folded
assi (attr store1 < 2.12 and attr store1 > 2.02 ) 
     ((attr store1 < 8.35 and attr store1 > 8.29 ) and bondedto
      (attr store1 < 116.801  and attr store1 > 116.001 ))
6 0.1 0.1 peak 660 volume 41.14165 ppm1 8.320 ppm2 2.070
 
! ############### hot_gnoesyNhsqc_051903.661 NOT folded
assi (attr store1 < 1.882 and attr store1 > 1.782 ) 
     ((attr store1 < 8.349 and attr store1 > 8.289 ) and bondedto
      (attr store1 < 116.8  and attr store1 > 116.0 ))
6 0.1 0.1 peak 661 volume 50.74736 ppm1 8.319 ppm2 1.832
 
! ############### hot_gnoesyNhsqc_051903.662 NOT folded
assi (attr store1 < 1.661 and attr store1 > 1.561 ) 
     ((attr store1 < 8.348 and attr store1 > 8.288 ) and bondedto
      (attr store1 < 116.787  and attr store1 > 115.987 ))
6 0.1 0.1 peak 662 volume 12.78900 ppm1 8.318 ppm2 1.611
 
! ############### hot_gnoesyNhsqc_051903.663 NOT folded
assi (attr store1 < 1.454 and attr store1 > 1.354 ) 
     ((attr store1 < 8.35 and attr store1 > 8.29 ) and bondedto
      (attr store1 < 116.798  and attr store1 > 115.998 ))
6 0.1 0.1 peak 663 volume 24.85875 ppm1 8.320 ppm2 1.404
 
! ############### hot_gnoesyNhsqc_051903.664 NOT folded
assi (attr store1 < 4.028 and attr store1 > 3.928 ) 
     ((attr store1 < 7.784 and attr store1 > 7.724 ) and bondedto
      (attr store1 < 116.48  and attr store1 > 115.68 ))
6 0.1 0.1 peak 664 volume 14.91986 ppm1 7.754 ppm2 3.978
 
! ############### hot_gnoesyNhsqc_051903.665 NOT folded
assi (attr store1 < 2.991 and attr store1 > 2.891 ) 
     ((attr store1 < 7.873 and attr store1 > 7.813 ) and bondedto
      (attr store1 < 116.331  and attr store1 > 115.531 ))
6 0.1 0.1 peak 665 volume 5.64884 ppm1 7.843 ppm2 2.941
 
! ############### hot_gnoesyNhsqc_051903.666 NOT folded
assi (attr store1 < 4.25 and attr store1 > 4.15 ) 
     ((attr store1 < 7.781 and attr store1 > 7.721 ) and bondedto
      (attr store1 < 116.417  and attr store1 > 115.617 ))
6 0.1 0.1 peak 666 volume 25.42797 ppm1 7.751 ppm2 4.200
 
! ############### hot_gnoesyNhsqc_051903.668 NOT folded
assi (attr store1 < 3.582 and attr store1 > 3.482 ) 
     ((attr store1 < 7.782 and attr store1 > 7.722 ) and bondedto
      (attr store1 < 116.436  and attr store1 > 115.636 ))
6 0.1 0.1 peak 668 volume 17.49282 ppm1 7.752 ppm2 3.532
 
! ############### hot_gnoesyNhsqc_051903.669 NOT folded
assi (attr store1 < 3.247 and attr store1 > 3.147 ) 
     ((attr store1 < 7.782 and attr store1 > 7.722 ) and bondedto
      (attr store1 < 116.443  and attr store1 > 115.643 ))
6 0.1 0.1 peak 669 volume 15.57103 ppm1 7.752 ppm2 3.197
 
! ############### hot_gnoesyNhsqc_051903.673 NOT folded
assi (attr store1 < 1.579 and attr store1 > 1.479 ) 
     ((attr store1 < 7.782 and attr store1 > 7.722 ) and bondedto
      (attr store1 < 116.436  and attr store1 > 115.636 ))
6 0.1 0.1 peak 673 volume 14.89505 ppm1 7.752 ppm2 1.529
 
! ############### hot_gnoesyNhsqc_051903.674 NOT folded
assi (attr store1 < 1.34 and attr store1 > 1.24 ) 
     ((attr store1 < 7.781 and attr store1 > 7.721 ) and bondedto
      (attr store1 < 116.419  and attr store1 > 115.619 ))
6 0.1 0.1 peak 674 volume 7.73669 ppm1 7.751 ppm2 1.290
 
! ############### hot_gnoesyNhsqc_051903.675 NOT folded
assi (attr store1 < 4.335 and attr store1 > 4.235 ) 
     ((attr store1 < 7.316 and attr store1 > 7.256 ) and bondedto
      (attr store1 < 116.294  and attr store1 > 115.494 ))
6 0.1 0.1 peak 675 volume 46.25334 ppm1 7.286 ppm2 4.285
 
! ############### hot_gnoesyNhsqc_051903.676 NOT folded
assi (attr store1 < 3.91 and attr store1 > 3.81 ) 
     ((attr store1 < 7.318 and attr store1 > 7.258 ) and bondedto
      (attr store1 < 116.286  and attr store1 > 115.486 ))
6 0.1 0.1 peak 676 volume 19.75121 ppm1 7.288 ppm2 3.860
 
! ############### hot_gnoesyNhsqc_051903.677 NOT folded
assi (attr store1 < 3.554 and attr store1 > 3.454 ) 
     ((attr store1 < 7.318 and attr store1 > 7.258 ) and bondedto
      (attr store1 < 116.302  and attr store1 > 115.502 ))
6 0.1 0.1 peak 677 volume 16.36203 ppm1 7.288 ppm2 3.504
 
! ############### hot_gnoesyNhsqc_051903.678 NOT folded
assi (attr store1 < 3.227 and attr store1 > 3.127 ) 
     ((attr store1 < 7.315 and attr store1 > 7.255 ) and bondedto
      (attr store1 < 116.322  and attr store1 > 115.522 ))
6 0.1 0.1 peak 678 volume 7.94422 ppm1 7.285 ppm2 3.177
 
! ############### hot_gnoesyNhsqc_051903.679 NOT folded
assi (attr store1 < 2.936 and attr store1 > 2.836 ) 
     ((attr store1 < 7.317 and attr store1 > 7.257 ) and bondedto
      (attr store1 < 116.281  and attr store1 > 115.481 ))
6 0.1 0.1 peak 679 volume 8.77662 ppm1 7.287 ppm2 2.886
 
! ############### hot_gnoesyNhsqc_051903.680 NOT folded
assi (attr store1 < 2.488 and attr store1 > 2.388 ) 
     ((attr store1 < 7.317 and attr store1 > 7.257 ) and bondedto
      (attr store1 < 116.299  and attr store1 > 115.499 ))
6 0.1 0.1 peak 680 volume 45.94386 ppm1 7.287 ppm2 2.438
 
! ############### hot_gnoesyNhsqc_051903.681 NOT folded
assi (attr store1 < 2.318 and attr store1 > 2.218 ) 
     ((attr store1 < 7.317 and attr store1 > 7.257 ) and bondedto
      (attr store1 < 116.295  and attr store1 > 115.495 ))
6 0.1 0.1 peak 681 volume 72.68308 ppm1 7.287 ppm2 2.268
 
! ############### hot_gnoesyNhsqc_051903.682 NOT folded
assi (attr store1 < 1.974 and attr store1 > 1.874 ) 
     ((attr store1 < 7.317 and attr store1 > 7.257 ) and bondedto
      (attr store1 < 116.296  and attr store1 > 115.496 ))
6 0.1 0.1 peak 682 volume 75.95146 ppm1 7.287 ppm2 1.924
 
! ############### hot_gnoesyNhsqc_051903.683 NOT folded
assi (attr store1 < 1.712 and attr store1 > 1.612 ) 
     ((attr store1 < 7.315 and attr store1 > 7.255 ) and bondedto
      (attr store1 < 116.294  and attr store1 > 115.494 ))
6 0.1 0.1 peak 683 volume 20.93331 ppm1 7.285 ppm2 1.662
 
! ############### hot_gnoesyNhsqc_051903.684 NOT folded
assi (attr store1 < 1.494 and attr store1 > 1.394 ) 
     ((attr store1 < 7.315 and attr store1 > 7.255 ) and bondedto
      (attr store1 < 116.309  and attr store1 > 115.509 ))
6 0.1 0.1 peak 684 volume 16.45562 ppm1 7.285 ppm2 1.444
 
! ############### hot_gnoesyNhsqc_051903.685 NOT folded
assi (attr store1 < 1.01 and attr store1 > 0.91 ) 
     ((attr store1 < 7.319 and attr store1 > 7.259 ) and bondedto
      (attr store1 < 116.3  and attr store1 > 115.5 ))
6 0.1 0.1 peak 685 volume 11.40048 ppm1 7.289 ppm2 0.960
 
! ############### hot_gnoesyNhsqc_051903.687 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.952 and attr store1 > 7.892 ) and bondedto
      (attr store1 < 116.043  and attr store1 > 115.243 ))
6 0.1 0.1 peak 687 volume 14.03199 ppm1 7.922 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.688 NOT folded
assi (attr store1 < 3.98 and attr store1 > 3.88 ) 
     ((attr store1 < 7.95 and attr store1 > 7.89 ) and bondedto
      (attr store1 < 116.022  and attr store1 > 115.222 ))
6 0.1 0.1 peak 688 volume 15.55606 ppm1 7.920 ppm2 3.930
 
! ############### hot_gnoesyNhsqc_051903.689 NOT folded
assi (attr store1 < 3.221 and attr store1 > 3.121 ) 
     ((attr store1 < 7.941 and attr store1 > 7.881 ) and bondedto
      (attr store1 < 116.044  and attr store1 > 115.244 ))
6 0.1 0.1 peak 689 volume 12.69037 ppm1 7.911 ppm2 3.171
 
! ############### hot_gnoesyNhsqc_051903.690 NOT folded
assi (attr store1 < 4.339 and attr store1 > 4.239 ) 
     ((attr store1 < 7.884 and attr store1 > 7.824 ) and bondedto
      (attr store1 < 116.111  and attr store1 > 115.311 ))
6 0.1 0.1 peak 690 volume 152.41711 ppm1 7.854 ppm2 4.289
 
! ############### hot_gnoesyNhsqc_051903.691 NOT folded
assi (attr store1 < 3.206 and attr store1 > 3.106 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 116.109  and attr store1 > 115.309 ))
6 0.1 0.1 peak 691 volume 33.27796 ppm1 7.855 ppm2 3.156
 
! ############### hot_gnoesyNhsqc_051903.692 NOT folded
assi (attr store1 < 2.844 and attr store1 > 2.744 ) 
     ((attr store1 < 7.884 and attr store1 > 7.824 ) and bondedto
      (attr store1 < 116.106  and attr store1 > 115.306 ))
6 0.1 0.1 peak 692 volume 34.74366 ppm1 7.854 ppm2 2.794
 
! ############### hot_gnoesyNhsqc_051903.693 NOT folded
assi (attr store1 < 2.044 and attr store1 > 1.944 ) 
     ((attr store1 < 7.886 and attr store1 > 7.826 ) and bondedto
      (attr store1 < 116.136  and attr store1 > 115.336 ))
6 0.1 0.1 peak 693 volume 11.43998 ppm1 7.856 ppm2 1.994
 
! ############### hot_gnoesyNhsqc_051903.694 NOT folded
assi (attr store1 < 1.88 and attr store1 > 1.78 ) 
     ((attr store1 < 7.888 and attr store1 > 7.828 ) and bondedto
      (attr store1 < 116.11  and attr store1 > 115.31 ))
6 0.1 0.1 peak 694 volume 14.11660 ppm1 7.858 ppm2 1.830
 
! ############### hot_gnoesyNhsqc_051903.695 NOT folded
assi (attr store1 < 1.257 and attr store1 > 1.157 ) 
     ((attr store1 < 7.883 and attr store1 > 7.823 ) and bondedto
      (attr store1 < 116.129  and attr store1 > 115.329 ))
6 0.1 0.1 peak 695 volume 10.39422 ppm1 7.853 ppm2 1.207
 
! ############### hot_gnoesyNhsqc_051903.699 NOT folded
assi (attr store1 < 3.593 and attr store1 > 3.493 ) 
     ((attr store1 < 7.881 and attr store1 > 7.821 ) and bondedto
      (attr store1 < 116.155  and attr store1 > 115.355 ))
6 0.1 0.1 peak 699 volume 7.31280 ppm1 7.851 ppm2 3.543
 
! ############### hot_gnoesyNhsqc_051903.700 NOT folded
assi (attr store1 < 1.585 and attr store1 > 1.485 ) 
     ((attr store1 < 7.881 and attr store1 > 7.821 ) and bondedto
      (attr store1 < 116.114  and attr store1 > 115.314 ))
6 0.1 0.1 peak 700 volume 28.27231 ppm1 7.851 ppm2 1.535
 
! ############### hot_gnoesyNhsqc_051903.701 NOT folded
assi (attr store1 < 4.824 and attr store1 > 4.724 ) 
     ((attr store1 < 6.958 and attr store1 > 6.898 ) and bondedto
      (attr store1 < 116.011  and attr store1 > 115.211 ))
6 0.1 0.1 peak 701 volume 9.10276 ppm1 6.928 ppm2 4.774
 
! ############### hot_gnoesyNhsqc_051903.702 NOT folded
assi (attr store1 < 3.984 and attr store1 > 3.884 ) 
     ((attr store1 < 6.953 and attr store1 > 6.893 ) and bondedto
      (attr store1 < 116.073  and attr store1 > 115.273 ))
6 0.1 0.1 peak 702 volume 12.73916 ppm1 6.923 ppm2 3.934
 
! ############### hot_gnoesyNhsqc_051903.703 NOT folded
assi (attr store1 < 3.232 and attr store1 > 3.132 ) 
     ((attr store1 < 6.953 and attr store1 > 6.893 ) and bondedto
      (attr store1 < 116.036  and attr store1 > 115.236 ))
6 0.1 0.1 peak 703 volume 12.64983 ppm1 6.923 ppm2 3.182
 
! ############### hot_gnoesyNhsqc_051903.704 NOT folded
assi (attr store1 < 2.463 and attr store1 > 2.363 ) 
     ((attr store1 < 6.954 and attr store1 > 6.894 ) and bondedto
      (attr store1 < 116.04  and attr store1 > 115.24 ))
6 0.1 0.1 peak 704 volume 66.33529 ppm1 6.924 ppm2 2.413
 
! ############### hot_gnoesyNhsqc_051903.705 NOT folded
assi (attr store1 < 2.221 and attr store1 > 2.121 ) 
     ((attr store1 < 6.955 and attr store1 > 6.895 ) and bondedto
      (attr store1 < 116.053  and attr store1 > 115.253 ))
6 0.1 0.1 peak 705 volume 10.87405 ppm1 6.925 ppm2 2.171
 
! ############### hot_gnoesyNhsqc_051903.706 NOT folded
assi (attr store1 < 2.113 and attr store1 > 2.013 ) 
     ((attr store1 < 6.956 and attr store1 > 6.896 ) and bondedto
      (attr store1 < 116.007  and attr store1 > 115.207 ))
6 0.1 0.1 peak 706 volume 8.95113 ppm1 6.926 ppm2 2.063
 
! ############### hot_gnoesyNhsqc_051903.707 NOT folded
assi (attr store1 < 1.965 and attr store1 > 1.865 ) 
     ((attr store1 < 6.953 and attr store1 > 6.893 ) and bondedto
      (attr store1 < 116.043  and attr store1 > 115.243 ))
6 0.1 0.1 peak 707 volume 15.98328 ppm1 6.923 ppm2 1.915
 
! ############### hot_gnoesyNhsqc_051903.708 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 9.565 and attr store1 > 9.505 ) and bondedto
      (attr store1 < 115.958  and attr store1 > 115.158 ))
6 0.1 0.1 peak 708 volume 6.47278 ppm1 9.535 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.709 NOT folded
assi (attr store1 < 1.229 and attr store1 > 1.129 ) 
     ((attr store1 < 9.564 and attr store1 > 9.504 ) and bondedto
      (attr store1 < 115.871  and attr store1 > 115.071 ))
6 0.1 0.1 peak 709 volume 5.42119 ppm1 9.534 ppm2 1.179
 
! ############### hot_gnoesyNhsqc_051903.710 NOT folded
assi (attr store1 < 4.21 and attr store1 > 4.11 ) 
     ((attr store1 < 9.562 and attr store1 > 9.502 ) and bondedto
      (attr store1 < 115.913  and attr store1 > 115.113 ))
6 0.1 0.1 peak 710 volume 5.26458 ppm1 9.532 ppm2 4.160
 
! ############### hot_gnoesyNhsqc_051903.711 NOT folded
assi (attr store1 < 2.986 and attr store1 > 2.886 ) 
     ((attr store1 < 9.563 and attr store1 > 9.503 ) and bondedto
      (attr store1 < 115.93  and attr store1 > 115.13 ))
6 0.1 0.1 peak 711 volume 12.91469 ppm1 9.533 ppm2 2.936
 
! ############### hot_gnoesyNhsqc_051903.712 NOT folded
assi (attr store1 < 1.908 and attr store1 > 1.808 ) 
     ((attr store1 < 9.563 and attr store1 > 9.503 ) and bondedto
      (attr store1 < 115.922  and attr store1 > 115.122 ))
6 0.1 0.1 peak 712 volume 25.85107 ppm1 9.533 ppm2 1.858
 
! ############### hot_gnoesyNhsqc_051903.713 NOT folded
assi (attr store1 < 1.546 and attr store1 > 1.446 ) 
     ((attr store1 < 9.561 and attr store1 > 9.501 ) and bondedto
      (attr store1 < 115.937  and attr store1 > 115.137 ))
6 0.1 0.1 peak 713 volume 6.93828 ppm1 9.531 ppm2 1.496
 
! ############### hot_gnoesyNhsqc_051903.714 NOT folded
assi (attr store1 < 0.96 and attr store1 > 0.86 ) 
     ((attr store1 < 9.561 and attr store1 > 9.501 ) and bondedto
      (attr store1 < 115.92  and attr store1 > 115.12 ))
6 0.1 0.1 peak 714 volume 18.71458 ppm1 9.531 ppm2 0.910
 
! ############### hot_gnoesyNhsqc_051903.715 NOT folded
assi (attr store1 < 1.898 and attr store1 > 1.798 ) 
     ((attr store1 < 9.446 and attr store1 > 9.386 ) and bondedto
      (attr store1 < 115.887  and attr store1 > 115.087 ))
6 0.1 0.1 peak 715 volume 6.37937 ppm1 9.416 ppm2 1.848
 
! ############### hot_gnoesyNhsqc_051903.716 NOT folded
assi (attr store1 < 2.463 and attr store1 > 2.363 ) 
     ((attr store1 < 7.951 and attr store1 > 7.891 ) and bondedto
      (attr store1 < 115.974  and attr store1 > 115.174 ))
6 0.1 0.1 peak 716 volume 96.60864 ppm1 7.921 ppm2 2.413
 
! ############### hot_gnoesyNhsqc_051903.717 NOT folded
assi (attr store1 < 2.214 and attr store1 > 2.114 ) 
     ((attr store1 < 7.951 and attr store1 > 7.891 ) and bondedto
      (attr store1 < 115.956  and attr store1 > 115.156 ))
6 0.1 0.1 peak 717 volume 15.02224 ppm1 7.921 ppm2 2.164
 
! ############### hot_gnoesyNhsqc_051903.718 NOT folded
assi (attr store1 < 2.131 and attr store1 > 2.031 ) 
     ((attr store1 < 7.951 and attr store1 > 7.891 ) and bondedto
      (attr store1 < 115.991  and attr store1 > 115.191 ))
6 0.1 0.1 peak 718 volume 13.75099 ppm1 7.921 ppm2 2.081
 
! ############### hot_gnoesyNhsqc_051903.719 NOT folded
assi (attr store1 < 1.957 and attr store1 > 1.857 ) 
     ((attr store1 < 7.951 and attr store1 > 7.891 ) and bondedto
      (attr store1 < 115.962  and attr store1 > 115.162 ))
6 0.1 0.1 peak 719 volume 18.17637 ppm1 7.921 ppm2 1.907
 
! ############### hot_gnoesyNhsqc_051903.720 NOT folded
assi (attr store1 < 1.825 and attr store1 > 1.725 ) 
     ((attr store1 < 6.953 and attr store1 > 6.893 ) and bondedto
      (attr store1 < 115.974  and attr store1 > 115.174 ))
6 0.1 0.1 peak 720 volume 6.36770 ppm1 6.923 ppm2 1.775
 
! ############### hot_gnoesyNhsqc_051903.721 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 6.61 and attr store1 > 6.55 ) and bondedto
      (attr store1 < 115.587  and attr store1 > 114.787 ))
6 0.1 0.1 peak 721 volume 44.51122 ppm1 6.580 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.722 NOT folded
assi (attr store1 < 3.697 and attr store1 > 3.597 ) 
     ((attr store1 < 6.609 and attr store1 > 6.549 ) and bondedto
      (attr store1 < 115.569  and attr store1 > 114.769 ))
6 0.1 0.1 peak 722 volume 10.39224 ppm1 6.579 ppm2 3.647
 
! ############### hot_gnoesyNhsqc_051903.723 NOT folded
assi (attr store1 < 3.204 and attr store1 > 3.104 ) 
     ((attr store1 < 6.609 and attr store1 > 6.549 ) and bondedto
      (attr store1 < 115.579  and attr store1 > 114.779 ))
6 0.1 0.1 peak 723 volume 20.10860 ppm1 6.579 ppm2 3.154
 
! ############### hot_gnoesyNhsqc_051903.724 NOT folded
assi (attr store1 < 2.345 and attr store1 > 2.245 ) 
     ((attr store1 < 6.613 and attr store1 > 6.553 ) and bondedto
      (attr store1 < 115.631  and attr store1 > 114.831 ))
6 0.1 0.1 peak 724 volume 5.86097 ppm1 6.583 ppm2 2.295
 
! ############### hot_gnoesyNhsqc_051903.725 NOT folded
assi (attr store1 < 1.967 and attr store1 > 1.867 ) 
     ((attr store1 < 6.611 and attr store1 > 6.551 ) and bondedto
      (attr store1 < 115.588  and attr store1 > 114.788 ))
6 0.1 0.1 peak 725 volume 30.71516 ppm1 6.581 ppm2 1.917
 
! ############### hot_gnoesyNhsqc_051903.726 NOT folded
assi (attr store1 < 1.824 and attr store1 > 1.724 ) 
     ((attr store1 < 6.613 and attr store1 > 6.553 ) and bondedto
      (attr store1 < 115.578  and attr store1 > 114.778 ))
6 0.1 0.1 peak 726 volume 19.18228 ppm1 6.583 ppm2 1.774
 
! ############### hot_gnoesyNhsqc_051903.727 NOT folded
assi (attr store1 < 3.908 and attr store1 > 3.808 ) 
     ((attr store1 < 6.605 and attr store1 > 6.545 ) and bondedto
      (attr store1 < 115.605  and attr store1 > 114.805 ))
6 0.1 0.1 peak 727 volume 10.83475 ppm1 6.575 ppm2 3.858
 
! ############### hot_gnoesyNhsqc_051903.728 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 9.361 and attr store1 > 9.301 ) and bondedto
      (attr store1 < 115.391  and attr store1 > 114.591 ))
6 0.1 0.1 peak 728 volume 12.84973 ppm1 9.331 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.729 NOT folded
assi (attr store1 < 4.512 and attr store1 > 4.412 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.391  and attr store1 > 114.591 ))
6 0.1 0.1 peak 729 volume 13.78767 ppm1 9.332 ppm2 4.462
 
! ############### hot_gnoesyNhsqc_051903.730 NOT folded
assi (attr store1 < 4.066 and attr store1 > 3.966 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.368  and attr store1 > 114.568 ))
6 0.1 0.1 peak 730 volume 61.53025 ppm1 9.332 ppm2 4.016
 
! ############### hot_gnoesyNhsqc_051903.731 NOT folded
assi (attr store1 < 2.462 and attr store1 > 2.362 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.374  and attr store1 > 114.574 ))
6 0.1 0.1 peak 731 volume 26.59619 ppm1 9.332 ppm2 2.412
 
! ############### hot_gnoesyNhsqc_051903.732 NOT folded
assi (attr store1 < 2.34 and attr store1 > 2.24 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.374  and attr store1 > 114.574 ))
6 0.1 0.1 peak 732 volume 41.34802 ppm1 9.332 ppm2 2.290
 
! ############### hot_gnoesyNhsqc_051903.733 NOT folded
assi (attr store1 < 2.072 and attr store1 > 1.972 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.371  and attr store1 > 114.571 ))
6 0.1 0.1 peak 733 volume 102.05950 ppm1 9.332 ppm2 2.022
 
! ############### hot_gnoesyNhsqc_051903.735 NOT folded
assi (attr store1 < 1.062 and attr store1 > 0.962 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.37  and attr store1 > 114.57 ))
6 0.1 0.1 peak 735 volume 82.57516 ppm1 9.332 ppm2 1.012
 
! ############### hot_gnoesyNhsqc_051903.736 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.202 and attr store1 > 8.142 ) and bondedto
      (attr store1 < 115.213  and attr store1 > 114.413 ))
6 0.1 0.1 peak 736 volume 213.45937 ppm1 8.172 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.737 NOT folded
assi (attr store1 < 4.528 and attr store1 > 4.428 ) 
     ((attr store1 < 8.202 and attr store1 > 8.142 ) and bondedto
      (attr store1 < 115.208  and attr store1 > 114.408 ))
6 0.1 0.1 peak 737 volume 36.13659 ppm1 8.172 ppm2 4.478
 
! ############### hot_gnoesyNhsqc_051903.738 NOT folded
assi (attr store1 < 4.331 and attr store1 > 4.231 ) 
     ((attr store1 < 8.201 and attr store1 > 8.141 ) and bondedto
      (attr store1 < 115.226  and attr store1 > 114.426 ))
6 0.1 0.1 peak 738 volume 7.72157 ppm1 8.171 ppm2 4.281
 
! ############### hot_gnoesyNhsqc_051903.739 NOT folded
assi (attr store1 < 4.011 and attr store1 > 3.911 ) 
     ((attr store1 < 8.202 and attr store1 > 8.142 ) and bondedto
      (attr store1 < 115.21  and attr store1 > 114.41 ))
6 0.1 0.1 peak 739 volume 120.60950 ppm1 8.172 ppm2 3.961
 
! ############### hot_gnoesyNhsqc_051903.740 NOT folded
assi (attr store1 < 4.824 and attr store1 > 4.724 ) 
     ((attr store1 < 7.502 and attr store1 > 7.442 ) and bondedto
      (attr store1 < 114.659  and attr store1 > 113.859 ))
6 0.1 0.1 peak 740 volume 9.89015 ppm1 7.472 ppm2 4.774
 
! ############### hot_gnoesyNhsqc_051903.741 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.384 and attr store1 > 7.324 ) and bondedto
      (attr store1 < 114.649  and attr store1 > 113.849 ))
6 0.1 0.1 peak 741 volume 110.55788 ppm1 7.354 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.742 NOT folded
assi (attr store1 < 3.983 and attr store1 > 3.883 ) 
     ((attr store1 < 7.379 and attr store1 > 7.319 ) and bondedto
      (attr store1 < 114.672  and attr store1 > 113.872 ))
6 0.1 0.1 peak 742 volume 6.62392 ppm1 7.349 ppm2 3.933
 
! ############### hot_gnoesyNhsqc_051903.743 NOT folded
assi (attr store1 < 3.229 and attr store1 > 3.129 ) 
     ((attr store1 < 7.383 and attr store1 > 7.323 ) and bondedto
      (attr store1 < 114.652  and attr store1 > 113.852 ))
6 0.1 0.1 peak 743 volume 35.81304 ppm1 7.353 ppm2 3.179
 
! ############### hot_gnoesyNhsqc_051903.744 NOT folded
assi (attr store1 < 1.956 and attr store1 > 1.856 ) 
     ((attr store1 < 7.384 and attr store1 > 7.324 ) and bondedto
      (attr store1 < 114.62  and attr store1 > 113.82 ))
6 0.1 0.1 peak 744 volume 11.48166 ppm1 7.354 ppm2 1.906
 
! ############### hot_gnoesyNhsqc_051903.745 NOT folded
assi (attr store1 < 1.798 and attr store1 > 1.698 ) 
     ((attr store1 < 7.384 and attr store1 > 7.324 ) and bondedto
      (attr store1 < 114.625  and attr store1 > 113.825 ))
6 0.1 0.1 peak 745 volume 11.49956 ppm1 7.354 ppm2 1.748
 
! ############### hot_gnoesyNhsqc_051903.746 NOT folded
assi (attr store1 < 1.63 and attr store1 > 1.53 ) 
     ((attr store1 < 7.384 and attr store1 > 7.324 ) and bondedto
      (attr store1 < 114.618  and attr store1 > 113.818 ))
6 0.1 0.1 peak 746 volume 9.87141 ppm1 7.354 ppm2 1.580
 
! ############### hot_gnoesyNhsqc_051903.747 NOT folded
assi (attr store1 < 4.824 and attr store1 > 4.724 ) 
     ((attr store1 < 7.26 and attr store1 > 7.2 ) and bondedto
      (attr store1 < 114.686  and attr store1 > 113.886 ))
6 0.1 0.1 peak 747 volume 20.42338 ppm1 7.230 ppm2 4.774
 
! ############### hot_gnoesyNhsqc_051903.748 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.22 and attr store1 > 7.16 ) and bondedto
      (attr store1 < 114.704  and attr store1 > 113.904 ))
6 0.1 0.1 peak 748 volume 25.18199 ppm1 7.190 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.749 NOT folded
assi (attr store1 < 1.85 and attr store1 > 1.75 ) 
     ((attr store1 < 7.22 and attr store1 > 7.16 ) and bondedto
      (attr store1 < 114.691  and attr store1 > 113.891 ))
6 0.1 0.1 peak 749 volume 9.21317 ppm1 7.190 ppm2 1.800
 
! ############### hot_gnoesyNhsqc_051903.750 NOT folded
assi (attr store1 < 4.82 and attr store1 > 4.72 ) 
     ((attr store1 < 7.098 and attr store1 > 7.038 ) and bondedto
      (attr store1 < 114.659  and attr store1 > 113.859 ))
6 0.1 0.1 peak 750 volume 7.01367 ppm1 7.068 ppm2 4.770
 
! ############### hot_gnoesyNhsqc_051903.751 NOT folded
assi (attr store1 < 4.817 and attr store1 > 4.717 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.168  and attr store1 > 113.368 ))
6 0.1 0.1 peak 751 volume 62.92482 ppm1 8.913 ppm2 4.767
 
! ############### hot_gnoesyNhsqc_051903.752 NOT folded
assi (attr store1 < 3.699 and attr store1 > 3.599 ) 
     ((attr store1 < 8.942 and attr store1 > 8.882 ) and bondedto
      (attr store1 < 114.176  and attr store1 > 113.376 ))
6 0.1 0.1 peak 752 volume 12.71924 ppm1 8.912 ppm2 3.649
 
! ############### hot_gnoesyNhsqc_051903.753 NOT folded
assi (attr store1 < 2.935 and attr store1 > 2.835 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.16  and attr store1 > 113.36 ))
6 0.1 0.1 peak 753 volume 45.10558 ppm1 8.913 ppm2 2.885
 
! ############### hot_gnoesyNhsqc_051903.754 NOT folded
assi (attr store1 < 2.501 and attr store1 > 2.401 ) 
     ((attr store1 < 8.946 and attr store1 > 8.886 ) and bondedto
      (attr store1 < 114.201  and attr store1 > 113.401 ))
6 0.1 0.1 peak 754 volume 10.07059 ppm1 8.916 ppm2 2.451
 
! ############### hot_gnoesyNhsqc_051903.755 NOT folded
assi (attr store1 < 2.352 and attr store1 > 2.252 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.158  and attr store1 > 113.358 ))
6 0.1 0.1 peak 755 volume 23.80253 ppm1 8.913 ppm2 2.302
 
! ############### hot_gnoesyNhsqc_051903.756 NOT folded
assi (attr store1 < 2.108 and attr store1 > 2.008 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.185  and attr store1 > 113.385 ))
6 0.1 0.1 peak 756 volume 39.51850 ppm1 8.913 ppm2 2.058
 
! ############### hot_gnoesyNhsqc_051903.757 NOT folded
assi (attr store1 < 1.84 and attr store1 > 1.74 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.186  and attr store1 > 113.386 ))
6 0.1 0.1 peak 757 volume 12.35169 ppm1 8.913 ppm2 1.790
 
! ############### hot_gnoesyNhsqc_051903.758 NOT folded
assi (attr store1 < 1.657 and attr store1 > 1.557 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.157  and attr store1 > 113.357 ))
6 0.1 0.1 peak 758 volume 11.90585 ppm1 8.913 ppm2 1.607
 
! ############### hot_gnoesyNhsqc_051903.759 NOT folded
assi (attr store1 < 0.961 and attr store1 > 0.861 ) 
     ((attr store1 < 8.944 and attr store1 > 8.884 ) and bondedto
      (attr store1 < 114.158  and attr store1 > 113.358 ))
6 0.1 0.1 peak 759 volume 5.61535 ppm1 8.914 ppm2 0.911
 
! ############### hot_gnoesyNhsqc_051903.760 NOT folded
assi (attr store1 < 0.844 and attr store1 > 0.744 ) 
     ((attr store1 < 8.937 and attr store1 > 8.877 ) and bondedto
      (attr store1 < 114.199  and attr store1 > 113.399 ))
6 0.1 0.1 peak 760 volume 5.41729 ppm1 8.907 ppm2 0.794
 
! ############### hot_gnoesyNhsqc_051903.761 NOT folded
assi (attr store1 < 4.385 and attr store1 > 4.285 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.129  and attr store1 > 113.329 ))
6 0.1 0.1 peak 761 volume 8.83159 ppm1 8.913 ppm2 4.335
 
! ############### hot_gnoesyNhsqc_051903.762 NOT folded
assi (attr store1 < 4.328 and attr store1 > 4.228 ) 
     ((attr store1 < 8.015 and attr store1 > 7.955 ) and bondedto
      (attr store1 < 113.765  and attr store1 > 112.965 ))
6 0.1 0.1 peak 762 volume 8.13202 ppm1 7.985 ppm2 4.278
 
! ############### hot_gnoesyNhsqc_051903.763 NOT folded
assi (attr store1 < 4.266 and attr store1 > 4.166 ) 
     ((attr store1 < 8.015 and attr store1 > 7.955 ) and bondedto
      (attr store1 < 113.798  and attr store1 > 112.998 ))
6 0.1 0.1 peak 763 volume 6.87515 ppm1 7.985 ppm2 4.216
 
! ############### hot_gnoesyNhsqc_051903.764 NOT folded
assi (attr store1 < 3.576 and attr store1 > 3.476 ) 
     ((attr store1 < 8.015 and attr store1 > 7.955 ) and bondedto
      (attr store1 < 113.772  and attr store1 > 112.972 ))
6 0.1 0.1 peak 764 volume 29.89865 ppm1 7.985 ppm2 3.526
 
! ############### hot_gnoesyNhsqc_051903.765 NOT folded
assi (attr store1 < 3.184 and attr store1 > 3.084 ) 
     ((attr store1 < 8.014 and attr store1 > 7.954 ) and bondedto
      (attr store1 < 113.771  and attr store1 > 112.971 ))
6 0.1 0.1 peak 765 volume 76.99558 ppm1 7.984 ppm2 3.134
 
! ############### hot_gnoesyNhsqc_051903.766 NOT folded
assi (attr store1 < 1.899 and attr store1 > 1.799 ) 
     ((attr store1 < 8.013 and attr store1 > 7.953 ) and bondedto
      (attr store1 < 113.77  and attr store1 > 112.97 ))
6 0.1 0.1 peak 766 volume 9.91468 ppm1 7.983 ppm2 1.849
 
! ############### hot_gnoesyNhsqc_051903.767 NOT folded
assi (attr store1 < 1.705 and attr store1 > 1.605 ) 
     ((attr store1 < 8.015 and attr store1 > 7.955 ) and bondedto
      (attr store1 < 113.744  and attr store1 > 112.944 ))
6 0.1 0.1 peak 767 volume 11.44314 ppm1 7.985 ppm2 1.655
 
! ############### hot_gnoesyNhsqc_051903.768 NOT folded
assi (attr store1 < 4.82 and attr store1 > 4.72 ) 
     ((attr store1 < 8.012 and attr store1 > 7.952 ) and bondedto
      (attr store1 < 113.775  and attr store1 > 112.975 ))
6 0.1 0.1 peak 768 volume 8.03322 ppm1 7.982 ppm2 4.770
 
! ############### hot_gnoesyNhsqc_051903.769 NOT folded
assi (attr store1 < 4.021 and attr store1 > 3.921 ) 
     ((attr store1 < 8.011 and attr store1 > 7.951 ) and bondedto
      (attr store1 < 113.769  and attr store1 > 112.969 ))
6 0.1 0.1 peak 769 volume 21.51297 ppm1 7.981 ppm2 3.971
 
! ############### hot_gnoesyNhsqc_051903.770 NOT folded
assi (attr store1 < 3.816 and attr store1 > 3.716 ) 
     ((attr store1 < 8.011 and attr store1 > 7.951 ) and bondedto
      (attr store1 < 113.764  and attr store1 > 112.964 ))
6 0.1 0.1 peak 770 volume 15.20280 ppm1 7.981 ppm2 3.766
 
! ############### hot_gnoesyNhsqc_051903.771 NOT folded
assi (attr store1 < 2.059 and attr store1 > 1.959 ) 
     ((attr store1 < 8.012 and attr store1 > 7.952 ) and bondedto
      (attr store1 < 113.741  and attr store1 > 112.941 ))
6 0.1 0.1 peak 771 volume 5.51058 ppm1 7.982 ppm2 2.009
 
! ############### hot_gnoesyNhsqc_051903.772 NOT folded
assi (attr store1 < 1.585 and attr store1 > 1.485 ) 
     ((attr store1 < 8.01 and attr store1 > 7.95 ) and bondedto
      (attr store1 < 113.75  and attr store1 > 112.95 ))
6 0.1 0.1 peak 772 volume 9.13920 ppm1 7.980 ppm2 1.535
 
! ############### hot_gnoesyNhsqc_051903.774 NOT folded
assi (attr store1 < 1.007 and attr store1 > 0.907 ) 
     ((attr store1 < 8.012 and attr store1 > 7.952 ) and bondedto
      (attr store1 < 113.772  and attr store1 > 112.972 ))
6 0.1 0.1 peak 774 volume 20.96687 ppm1 7.982 ppm2 0.957
 
! ############### hot_gnoesyNhsqc_051903.775 NOT folded
assi (attr store1 < 4.334 and attr store1 > 4.234 ) 
     ((attr store1 < 7.02 and attr store1 > 6.96 ) and bondedto
      (attr store1 < 113.77  and attr store1 > 112.97 ))
6 0.1 0.1 peak 775 volume 8.32222 ppm1 6.990 ppm2 4.284
 
! ############### hot_gnoesyNhsqc_051903.776 NOT folded
assi (attr store1 < 4.047 and attr store1 > 3.947 ) 
     ((attr store1 < 7.02 and attr store1 > 6.96 ) and bondedto
      (attr store1 < 113.777  and attr store1 > 112.977 ))
6 0.1 0.1 peak 776 volume 30.74758 ppm1 6.990 ppm2 3.997
 
! ############### hot_gnoesyNhsqc_051903.777 NOT folded
assi (attr store1 < 3.909 and attr store1 > 3.809 ) 
     ((attr store1 < 7.02 and attr store1 > 6.96 ) and bondedto
      (attr store1 < 113.774  and attr store1 > 112.974 ))
6 0.1 0.1 peak 777 volume 53.60434 ppm1 6.990 ppm2 3.859
 
! ############### hot_gnoesyNhsqc_051903.778 NOT folded
assi (attr store1 < 3.555 and attr store1 > 3.455 ) 
     ((attr store1 < 7.019 and attr store1 > 6.959 ) and bondedto
      (attr store1 < 113.738  and attr store1 > 112.938 ))
6 0.1 0.1 peak 778 volume 8.75561 ppm1 6.989 ppm2 3.505
 
! ############### hot_gnoesyNhsqc_051903.780 NOT folded
assi (attr store1 < 2.467 and attr store1 > 2.367 ) 
     ((attr store1 < 7.02 and attr store1 > 6.96 ) and bondedto
      (attr store1 < 113.737  and attr store1 > 112.937 ))
6 0.1 0.1 peak 780 volume 15.32822 ppm1 6.990 ppm2 2.417
 
! ############### hot_gnoesyNhsqc_051903.781 NOT folded
assi (attr store1 < 2.336 and attr store1 > 2.236 ) 
     ((attr store1 < 7.018 and attr store1 > 6.958 ) and bondedto
      (attr store1 < 113.736  and attr store1 > 112.936 ))
6 0.1 0.1 peak 781 volume 26.28062 ppm1 6.988 ppm2 2.286
 
! ############### hot_gnoesyNhsqc_051903.782 NOT folded
assi (attr store1 < 1.979 and attr store1 > 1.879 ) 
     ((attr store1 < 7.02 and attr store1 > 6.96 ) and bondedto
      (attr store1 < 113.771  and attr store1 > 112.971 ))
6 0.1 0.1 peak 782 volume 138.92403 ppm1 6.990 ppm2 1.929
 
! ############### hot_gnoesyNhsqc_051903.783 NOT folded
assi (attr store1 < 1.731 and attr store1 > 1.631 ) 
     ((attr store1 < 7.02 and attr store1 > 6.96 ) and bondedto
      (attr store1 < 113.756  and attr store1 > 112.956 ))
6 0.1 0.1 peak 783 volume 44.81825 ppm1 6.990 ppm2 1.681
 
! ############### hot_gnoesyNhsqc_051903.785 NOT folded
assi (attr store1 < 2.987 and attr store1 > 2.887 ) 
     ((attr store1 < 7.775 and attr store1 > 7.715 ) and bondedto
      (attr store1 < 113.523  and attr store1 > 112.723 ))
6 0.1 0.1 peak 785 volume 35.91113 ppm1 7.745 ppm2 2.937
 
! ############### hot_gnoesyNhsqc_051903.786 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.433 and attr store1 > 7.373 ) and bondedto
      (attr store1 < 113.609  and attr store1 > 112.809 ))
6 0.1 0.1 peak 786 volume 5.72817 ppm1 7.403 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.787 NOT folded
assi (attr store1 < 4.82 and attr store1 > 4.72 ) 
     ((attr store1 < 7.018 and attr store1 > 6.958 ) and bondedto
      (attr store1 < 113.622  and attr store1 > 112.822 ))
6 0.1 0.1 peak 787 volume 19.85546 ppm1 6.988 ppm2 4.770
 
! ############### hot_gnoesyNhsqc_051903.788 NOT folded
assi (attr store1 < 4.71 and attr store1 > 4.61 ) 
     ((attr store1 < 7.015 and attr store1 > 6.955 ) and bondedto
      (attr store1 < 113.545  and attr store1 > 112.745 ))
6 0.1 0.1 peak 788 volume 6.48008 ppm1 6.985 ppm2 4.660
 
! ############### hot_gnoesyNhsqc_051903.789 NOT folded
assi (attr store1 < 2.967 and attr store1 > 2.867 ) 
     ((attr store1 < 7.016 and attr store1 > 6.956 ) and bondedto
      (attr store1 < 113.618  and attr store1 > 112.818 ))
6 0.1 0.1 peak 789 volume 36.15019 ppm1 6.986 ppm2 2.917
 
! ############### hot_gnoesyNhsqc_051903.790 NOT folded
assi (attr store1 < 0.97 and attr store1 > 0.87 ) 
     ((attr store1 < 7.018 and attr store1 > 6.958 ) and bondedto
      (attr store1 < 113.645  and attr store1 > 112.845 ))
6 0.1 0.1 peak 790 volume 15.23388 ppm1 6.988 ppm2 0.920
 
! ############### hot_gnoesyNhsqc_051903.791 NOT folded
assi (attr store1 < 0.832 and attr store1 > 0.732 ) 
     ((attr store1 < 7.018 and attr store1 > 6.958 ) and bondedto
      (attr store1 < 113.586  and attr store1 > 112.786 ))
6 0.1 0.1 peak 791 volume 13.95085 ppm1 6.988 ppm2 0.782
 
! ############### hot_gnoesyNhsqc_051903.792 NOT folded
assi (attr store1 < 4.821 and attr store1 > 4.721 ) 
     ((attr store1 < 7.782 and attr store1 > 7.722 ) and bondedto
      (attr store1 < 113.294  and attr store1 > 112.494 ))
6 0.1 0.1 peak 792 volume 44.30042 ppm1 7.752 ppm2 4.771
 
! ############### hot_gnoesyNhsqc_051903.793 NOT folded
assi (attr store1 < 4.312 and attr store1 > 4.212 ) 
     ((attr store1 < 7.785 and attr store1 > 7.725 ) and bondedto
      (attr store1 < 113.237  and attr store1 > 112.437 ))
6 0.1 0.1 peak 793 volume 48.60205 ppm1 7.755 ppm2 4.262
 
! ############### hot_gnoesyNhsqc_051903.794 NOT folded
assi (attr store1 < 4.163 and attr store1 > 4.063 ) 
     ((attr store1 < 7.785 and attr store1 > 7.725 ) and bondedto
      (attr store1 < 113.226  and attr store1 > 112.426 ))
6 0.1 0.1 peak 794 volume 62.54906 ppm1 7.755 ppm2 4.113
 
! ############### hot_gnoesyNhsqc_051903.795 NOT folded
assi (attr store1 < 2.208 and attr store1 > 2.108 ) 
     ((attr store1 < 7.783 and attr store1 > 7.723 ) and bondedto
      (attr store1 < 113.291  and attr store1 > 112.491 ))
6 0.1 0.1 peak 795 volume 11.03628 ppm1 7.753 ppm2 2.158
 
! ############### hot_gnoesyNhsqc_051903.796 NOT folded
assi (attr store1 < 2.077 and attr store1 > 1.977 ) 
     ((attr store1 < 7.782 and attr store1 > 7.722 ) and bondedto
      (attr store1 < 113.336  and attr store1 > 112.536 ))
6 0.1 0.1 peak 796 volume 8.89323 ppm1 7.752 ppm2 2.027
 
! ############### hot_gnoesyNhsqc_051903.797 NOT folded
assi (attr store1 < 1.812 and attr store1 > 1.712 ) 
     ((attr store1 < 7.785 and attr store1 > 7.725 ) and bondedto
      (attr store1 < 113.234  and attr store1 > 112.434 ))
6 0.1 0.1 peak 797 volume 31.11361 ppm1 7.755 ppm2 1.762
 
! ############### hot_gnoesyNhsqc_051903.798 NOT folded
assi (attr store1 < 1.605 and attr store1 > 1.505 ) 
     ((attr store1 < 7.784 and attr store1 > 7.724 ) and bondedto
      (attr store1 < 113.261  and attr store1 > 112.461 ))
6 0.1 0.1 peak 798 volume 32.26987 ppm1 7.754 ppm2 1.555
 
! ############### hot_gnoesyNhsqc_051903.799 NOT folded
assi (attr store1 < 1.414 and attr store1 > 1.314 ) 
     ((attr store1 < 7.784 and attr store1 > 7.724 ) and bondedto
      (attr store1 < 113.257  and attr store1 > 112.457 ))
6 0.1 0.1 peak 799 volume 5.91993 ppm1 7.754 ppm2 1.364
 
! ############### hot_gnoesyNhsqc_051903.800 NOT folded
assi (attr store1 < 0.958 and attr store1 > 0.858 ) 
     ((attr store1 < 7.781 and attr store1 > 7.721 ) and bondedto
      (attr store1 < 113.31  and attr store1 > 112.51 ))
6 0.1 0.1 peak 800 volume 16.83066 ppm1 7.751 ppm2 0.908
 
! ############### hot_gnoesyNhsqc_051903.801 NOT folded
assi (attr store1 < 0.835 and attr store1 > 0.735 ) 
     ((attr store1 < 7.783 and attr store1 > 7.723 ) and bondedto
      (attr store1 < 113.29  and attr store1 > 112.49 ))
6 0.1 0.1 peak 801 volume 29.15237 ppm1 7.753 ppm2 0.785
 
! ############### hot_gnoesyNhsqc_051903.802 NOT folded
assi (attr store1 < 4.823 and attr store1 > 4.723 ) 
     ((attr store1 < 7.633 and attr store1 > 7.573 ) and bondedto
      (attr store1 < 113.283  and attr store1 > 112.483 ))
6 0.1 0.1 peak 802 volume 70.96585 ppm1 7.603 ppm2 4.773
 
! ############### hot_gnoesyNhsqc_051903.803 NOT folded
assi (attr store1 < 4.614 and attr store1 > 4.514 ) 
     ((attr store1 < 7.633 and attr store1 > 7.573 ) and bondedto
      (attr store1 < 113.244  and attr store1 > 112.444 ))
6 0.1 0.1 peak 803 volume 7.28559 ppm1 7.603 ppm2 4.564
 
! ############### hot_gnoesyNhsqc_051903.804 NOT folded
assi (attr store1 < 2.725 and attr store1 > 2.625 ) 
     ((attr store1 < 7.632 and attr store1 > 7.572 ) and bondedto
      (attr store1 < 113.275  and attr store1 > 112.475 ))
6 0.1 0.1 peak 804 volume 31.68271 ppm1 7.602 ppm2 2.675
 
! ############### hot_gnoesyNhsqc_051903.805 NOT folded
assi (attr store1 < 2.586 and attr store1 > 2.486 ) 
     ((attr store1 < 7.632 and attr store1 > 7.572 ) and bondedto
      (attr store1 < 113.271  and attr store1 > 112.471 ))
6 0.1 0.1 peak 805 volume 39.46978 ppm1 7.602 ppm2 2.536
 
! ############### hot_gnoesyNhsqc_051903.806 NOT folded
assi (attr store1 < 1.422 and attr store1 > 1.322 ) 
     ((attr store1 < 7.634 and attr store1 > 7.574 ) and bondedto
      (attr store1 < 113.252  and attr store1 > 112.452 ))
6 0.1 0.1 peak 806 volume 9.05864 ppm1 7.604 ppm2 1.372
 
! ############### hot_gnoesyNhsqc_051903.807 NOT folded
assi (attr store1 < 4.685 and attr store1 > 4.585 ) 
     ((attr store1 < 6.978 and attr store1 > 6.918 ) and bondedto
      (attr store1 < 113.333  and attr store1 > 112.533 ))
6 0.1 0.1 peak 807 volume 6.03022 ppm1 6.948 ppm2 4.635
 
! ############### hot_gnoesyNhsqc_051903.808 NOT folded
assi (attr store1 < 4.567 and attr store1 > 4.467 ) 
     ((attr store1 < 6.979 and attr store1 > 6.919 ) and bondedto
      (attr store1 < 113.255  and attr store1 > 112.455 ))
6 0.1 0.1 peak 808 volume 8.31292 ppm1 6.949 ppm2 4.517
 
! ############### hot_gnoesyNhsqc_051903.809 NOT folded
assi (attr store1 < 3.098 and attr store1 > 2.998 ) 
     ((attr store1 < 6.979 and attr store1 > 6.919 ) and bondedto
      (attr store1 < 113.29  and attr store1 > 112.49 ))
6 0.1 0.1 peak 809 volume 20.53084 ppm1 6.949 ppm2 3.048
 
! ############### hot_gnoesyNhsqc_051903.810 NOT folded
assi (attr store1 < 3.009 and attr store1 > 2.909 ) 
     ((attr store1 < 6.983 and attr store1 > 6.923 ) and bondedto
      (attr store1 < 113.324  and attr store1 > 112.524 ))
6 0.1 0.1 peak 810 volume 22.19380 ppm1 6.953 ppm2 2.959
 
! ############### hot_gnoesyNhsqc_051903.811 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 6.844 and attr store1 > 6.784 ) and bondedto
      (attr store1 < 113.241  and attr store1 > 112.441 ))
6 0.1 0.1 peak 811 volume 54.83588 ppm1 6.814 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.812 NOT folded
assi (attr store1 < 4.611 and attr store1 > 4.511 ) 
     ((attr store1 < 6.845 and attr store1 > 6.785 ) and bondedto
      (attr store1 < 113.278  and attr store1 > 112.478 ))
6 0.1 0.1 peak 812 volume 5.67852 ppm1 6.815 ppm2 4.561
 
! ############### hot_gnoesyNhsqc_051903.813 NOT folded
assi (attr store1 < 2.723 and attr store1 > 2.623 ) 
     ((attr store1 < 6.844 and attr store1 > 6.784 ) and bondedto
      (attr store1 < 113.28  and attr store1 > 112.48 ))
6 0.1 0.1 peak 813 volume 17.40566 ppm1 6.814 ppm2 2.673
 
! ############### hot_gnoesyNhsqc_051903.814 NOT folded
assi (attr store1 < 2.59 and attr store1 > 2.49 ) 
     ((attr store1 < 6.845 and attr store1 > 6.785 ) and bondedto
      (attr store1 < 113.289  and attr store1 > 112.489 ))
6 0.1 0.1 peak 814 volume 21.63462 ppm1 6.815 ppm2 2.540
 
! ############### hot_gnoesyNhsqc_051903.815 NOT folded
assi (attr store1 < 1.421 and attr store1 > 1.321 ) 
     ((attr store1 < 6.842 and attr store1 > 6.782 ) and bondedto
      (attr store1 < 113.3  and attr store1 > 112.5 ))
6 0.1 0.1 peak 815 volume 11.91053 ppm1 6.812 ppm2 1.371
 
! ############### hot_gnoesyNhsqc_051903.816 NOT folded
assi (attr store1 < 4.569 and attr store1 > 4.469 ) 
     ((attr store1 < 7.883 and attr store1 > 7.823 ) and bondedto
      (attr store1 < 113.147  and attr store1 > 112.347 ))
6 0.1 0.1 peak 816 volume 10.08941 ppm1 7.853 ppm2 4.519
 
! ############### hot_gnoesyNhsqc_051903.817 NOT folded
assi (attr store1 < 3.11 and attr store1 > 3.01 ) 
     ((attr store1 < 7.883 and attr store1 > 7.823 ) and bondedto
      (attr store1 < 113.17  and attr store1 > 112.37 ))
6 0.1 0.1 peak 817 volume 22.46648 ppm1 7.853 ppm2 3.060
 
! ############### hot_gnoesyNhsqc_051903.818 NOT folded
assi (attr store1 < 3.01 and attr store1 > 2.91 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 113.185  and attr store1 > 112.385 ))
6 0.1 0.1 peak 818 volume 22.32188 ppm1 7.855 ppm2 2.960
 
! ############### hot_gnoesyNhsqc_051903.819 NOT folded
assi (attr store1 < 1.62 and attr store1 > 1.52 ) 
     ((attr store1 < 7.884 and attr store1 > 7.824 ) and bondedto
      (attr store1 < 113.159  and attr store1 > 112.359 ))
6 0.1 0.1 peak 819 volume 6.16497 ppm1 7.854 ppm2 1.570
 
! ############### hot_gnoesyNhsqc_051903.820 NOT folded
assi (attr store1 < 4.718 and attr store1 > 4.618 ) 
     ((attr store1 < 7.88 and attr store1 > 7.82 ) and bondedto
      (attr store1 < 113.15  and attr store1 > 112.35 ))
6 0.1 0.1 peak 820 volume 6.55552 ppm1 7.850 ppm2 4.668
 
! ############### hot_gnoesyNhsqc_051903.821 NOT folded
assi (attr store1 < 1.946 and attr store1 > 1.846 ) 
     ((attr store1 < 7.879 and attr store1 > 7.819 ) and bondedto
      (attr store1 < 113.204  and attr store1 > 112.404 ))
6 0.1 0.1 peak 821 volume 5.67553 ppm1 7.849 ppm2 1.896
 
! ############### hot_gnoesyNhsqc_051903.822 NOT folded
assi (attr store1 < 2.434 and attr store1 > 2.334 ) 
     ((attr store1 < 7.784 and attr store1 > 7.724 ) and bondedto
      (attr store1 < 113.199  and attr store1 > 112.399 ))
6 0.1 0.1 peak 822 volume 6.02804 ppm1 7.754 ppm2 2.384
 
! ############### hot_gnoesyNhsqc_051903.823 NOT folded
assi (attr store1 < 3.181 and attr store1 > 3.081 ) 
     ((attr store1 < 8.008 and attr store1 > 7.948 ) and bondedto
      (attr store1 < 112.847  and attr store1 > 112.047 ))
6 0.1 0.1 peak 823 volume 6.00454 ppm1 7.978 ppm2 3.131
 
! ############### hot_gnoesyNhsqc_051903.824 NOT folded
assi (attr store1 < 2.335 and attr store1 > 2.235 ) 
     ((attr store1 < 7.561 and attr store1 > 7.501 ) and bondedto
      (attr store1 < 112.801  and attr store1 > 112.001 ))
6 0.1 0.1 peak 824 volume 26.34315 ppm1 7.531 ppm2 2.285
 
! ############### hot_gnoesyNhsqc_051903.825 NOT folded
assi (attr store1 < 4.823 and attr store1 > 4.723 ) 
     ((attr store1 < 7.558 and attr store1 > 7.498 ) and bondedto
      (attr store1 < 112.734  and attr store1 > 111.934 ))
6 0.1 0.1 peak 825 volume 45.22269 ppm1 7.528 ppm2 4.773
 
! ############### hot_gnoesyNhsqc_051903.826 NOT folded
assi (attr store1 < 1.865 and attr store1 > 1.765 ) 
     ((attr store1 < 7.379 and attr store1 > 7.319 ) and bondedto
      (attr store1 < 112.607  and attr store1 > 111.807 ))
6 0.1 0.1 peak 826 volume 6.22799 ppm1 7.349 ppm2 1.815
 
! ############### hot_gnoesyNhsqc_051903.827 NOT folded
assi (attr store1 < 1.986 and attr store1 > 1.886 ) 
     ((attr store1 < 6.913 and attr store1 > 6.853 ) and bondedto
      (attr store1 < 112.6  and attr store1 > 111.8 ))
6 0.1 0.1 peak 827 volume 7.76022 ppm1 6.883 ppm2 1.936
 
! ############### hot_gnoesyNhsqc_051903.828 NOT folded
assi (attr store1 < 1.692 and attr store1 > 1.592 ) 
     ((attr store1 < 6.909 and attr store1 > 6.849 ) and bondedto
      (attr store1 < 112.546  and attr store1 > 111.746 ))
6 0.1 0.1 peak 828 volume 17.12276 ppm1 6.879 ppm2 1.642
 
! ############### hot_gnoesyNhsqc_051903.829 NOT folded
assi (attr store1 < 1.686 and attr store1 > 1.586 ) 
     ((attr store1 < 6.373 and attr store1 > 6.313 ) and bondedto
      (attr store1 < 112.598  and attr store1 > 111.798 ))
6 0.1 0.1 peak 829 volume 12.31648 ppm1 6.343 ppm2 1.636
 
! ############### hot_gnoesyNhsqc_051903.830 NOT folded
assi (attr store1 < 1.008 and attr store1 > 0.908 ) 
     ((attr store1 < 6.377 and attr store1 > 6.317 ) and bondedto
      (attr store1 < 112.69  and attr store1 > 111.89 ))
6 0.1 0.1 peak 830 volume 5.12610 ppm1 6.347 ppm2 0.958
 
! ############### hot_gnoesyNhsqc_051903.831 NOT folded
assi (attr store1 < 0.75 and attr store1 > 0.65 ) 
     ((attr store1 < 6.369 and attr store1 > 6.309 ) and bondedto
      (attr store1 < 112.609  and attr store1 > 111.809 ))
6 0.1 0.1 peak 831 volume 11.38442 ppm1 6.339 ppm2 0.700
 
! ############### hot_gnoesyNhsqc_051903.832 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.659 and attr store1 > 7.599 ) and bondedto
      (attr store1 < 112.472  and attr store1 > 111.672 ))
6 0.1 0.1 peak 832 volume 23.93592 ppm1 7.629 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.833 NOT folded
assi (attr store1 < 2.388 and attr store1 > 2.288 ) 
     ((attr store1 < 7.66 and attr store1 > 7.6 ) and bondedto
      (attr store1 < 112.414  and attr store1 > 111.614 ))
6 0.1 0.1 peak 833 volume 45.63948 ppm1 7.630 ppm2 2.338
 
! ############### hot_gnoesyNhsqc_051903.834 NOT folded
assi (attr store1 < 2.056 and attr store1 > 1.956 ) 
     ((attr store1 < 7.659 and attr store1 > 7.599 ) and bondedto
      (attr store1 < 112.418  and attr store1 > 111.618 ))
6 0.1 0.1 peak 834 volume 9.04585 ppm1 7.629 ppm2 2.006
 
! ############### hot_gnoesyNhsqc_051903.835 NOT folded
assi (attr store1 < 1.059 and attr store1 > 0.959 ) 
     ((attr store1 < 7.659 and attr store1 > 7.599 ) and bondedto
      (attr store1 < 112.408  and attr store1 > 111.608 ))
6 0.1 0.1 peak 835 volume 15.70976 ppm1 7.629 ppm2 1.009
 
! ############### hot_gnoesyNhsqc_051903.837 NOT folded
assi (attr store1 < 1.811 and attr store1 > 1.711 ) 
     ((attr store1 < 7.545 and attr store1 > 7.485 ) and bondedto
      (attr store1 < 112.408  and attr store1 > 111.608 ))
6 0.1 0.1 peak 837 volume 8.93285 ppm1 7.515 ppm2 1.761
 
! ############### hot_gnoesyNhsqc_051903.838 NOT folded
assi (attr store1 < 4.333 and attr store1 > 4.233 ) 
     ((attr store1 < 7.54 and attr store1 > 7.48 ) and bondedto
      (attr store1 < 112.368  and attr store1 > 111.568 ))
6 0.1 0.1 peak 838 volume 8.77940 ppm1 7.510 ppm2 4.283
 
! ############### hot_gnoesyNhsqc_051903.839 NOT folded
assi (attr store1 < 4.145 and attr store1 > 4.045 ) 
     ((attr store1 < 7.54 and attr store1 > 7.48 ) and bondedto
      (attr store1 < 112.374  and attr store1 > 111.574 ))
6 0.1 0.1 peak 839 volume 12.05286 ppm1 7.510 ppm2 4.095
 
! ############### hot_gnoesyNhsqc_051903.840 NOT folded
assi (attr store1 < 2.437 and attr store1 > 2.337 ) 
     ((attr store1 < 7.542 and attr store1 > 7.482 ) and bondedto
      (attr store1 < 112.367  and attr store1 > 111.567 ))
6 0.1 0.1 peak 840 volume 55.34369 ppm1 7.512 ppm2 2.387
 
! ############### hot_gnoesyNhsqc_051903.841 NOT folded
assi (attr store1 < 2.21 and attr store1 > 2.11 ) 
     ((attr store1 < 7.543 and attr store1 > 7.483 ) and bondedto
      (attr store1 < 112.375  and attr store1 > 111.575 ))
6 0.1 0.1 peak 841 volume 12.40635 ppm1 7.513 ppm2 2.160
 
! ############### hot_gnoesyNhsqc_051903.842 NOT folded
assi (attr store1 < 2.064 and attr store1 > 1.964 ) 
     ((attr store1 < 7.541 and attr store1 > 7.481 ) and bondedto
      (attr store1 < 112.361  and attr store1 > 111.561 ))
6 0.1 0.1 peak 842 volume 11.49864 ppm1 7.511 ppm2 2.014
 
! ############### hot_gnoesyNhsqc_051903.843 NOT folded
assi (attr store1 < 1.594 and attr store1 > 1.494 ) 
     ((attr store1 < 7.543 and attr store1 > 7.483 ) and bondedto
      (attr store1 < 112.383  and attr store1 > 111.583 ))
6 0.1 0.1 peak 843 volume 12.84291 ppm1 7.513 ppm2 1.544
 
! ############### hot_gnoesyNhsqc_051903.844 NOT folded
assi (attr store1 < 0.834 and attr store1 > 0.734 ) 
     ((attr store1 < 7.542 and attr store1 > 7.482 ) and bondedto
      (attr store1 < 112.369  and attr store1 > 111.569 ))
6 0.1 0.1 peak 844 volume 22.42546 ppm1 7.512 ppm2 0.784
 
! ############### hot_gnoesyNhsqc_051903.846 NOT folded
assi (attr store1 < 4.823 and attr store1 > 4.723 ) 
     ((attr store1 < 7.504 and attr store1 > 7.444 ) and bondedto
      (attr store1 < 112.388  and attr store1 > 111.588 ))
6 0.1 0.1 peak 846 volume 25.36570 ppm1 7.474 ppm2 4.773
 
! ############### hot_gnoesyNhsqc_051903.847 NOT folded
assi (attr store1 < 4.341 and attr store1 > 4.241 ) 
     ((attr store1 < 7.502 and attr store1 > 7.442 ) and bondedto
      (attr store1 < 112.388  and attr store1 > 111.588 ))
6 0.1 0.1 peak 847 volume 12.20589 ppm1 7.472 ppm2 4.291
 
! ############### hot_gnoesyNhsqc_051903.848 NOT folded
assi (attr store1 < 4.006 and attr store1 > 3.906 ) 
     ((attr store1 < 7.502 and attr store1 > 7.442 ) and bondedto
      (attr store1 < 112.35  and attr store1 > 111.55 ))
6 0.1 0.1 peak 848 volume 5.62021 ppm1 7.472 ppm2 3.956
 
! ############### hot_gnoesyNhsqc_051903.849 NOT folded
assi (attr store1 < 3.209 and attr store1 > 3.109 ) 
     ((attr store1 < 7.501 and attr store1 > 7.441 ) and bondedto
      (attr store1 < 112.375  and attr store1 > 111.575 ))
6 0.1 0.1 peak 849 volume 27.92556 ppm1 7.471 ppm2 3.159
 
! ############### hot_gnoesyNhsqc_051903.850 NOT folded
assi (attr store1 < 2.842 and attr store1 > 2.742 ) 
     ((attr store1 < 7.502 and attr store1 > 7.442 ) and bondedto
      (attr store1 < 112.371  and attr store1 > 111.571 ))
6 0.1 0.1 peak 850 volume 36.20932 ppm1 7.472 ppm2 2.792
 
! ############### hot_gnoesyNhsqc_051903.851 NOT folded
assi (attr store1 < 1.901 and attr store1 > 1.801 ) 
     ((attr store1 < 7.499 and attr store1 > 7.439 ) and bondedto
      (attr store1 < 112.413  and attr store1 > 111.613 ))
6 0.1 0.1 peak 851 volume 5.11981 ppm1 7.469 ppm2 1.851
 
! ############### hot_gnoesyNhsqc_051903.852 NOT folded
assi (attr store1 < 4.823 and attr store1 > 4.723 ) 
     ((attr store1 < 7.38 and attr store1 > 7.32 ) and bondedto
      (attr store1 < 112.472  and attr store1 > 111.672 ))
6 0.1 0.1 peak 852 volume 21.57181 ppm1 7.350 ppm2 4.773
 
! ############### hot_gnoesyNhsqc_051903.853 NOT folded
assi (attr store1 < 2.863 and attr store1 > 2.763 ) 
     ((attr store1 < 7.38 and attr store1 > 7.32 ) and bondedto
      (attr store1 < 112.496  and attr store1 > 111.696 ))
6 0.1 0.1 peak 853 volume 7.70426 ppm1 7.350 ppm2 2.813
 
! ############### hot_gnoesyNhsqc_051903.854 NOT folded
assi (attr store1 < 1.115 and attr store1 > 1.015 ) 
     ((attr store1 < 7.375 and attr store1 > 7.315 ) and bondedto
      (attr store1 < 112.483  and attr store1 > 111.683 ))
6 0.1 0.1 peak 854 volume 9.47744 ppm1 7.345 ppm2 1.065
 
! ############### hot_gnoesyNhsqc_051903.855 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 6.941 and attr store1 > 6.881 ) and bondedto
      (attr store1 < 112.39  and attr store1 > 111.59 ))
6 0.1 0.1 peak 855 volume 24.00168 ppm1 6.911 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.856 NOT folded
assi (attr store1 < 4.339 and attr store1 > 4.239 ) 
     ((attr store1 < 6.94 and attr store1 > 6.88 ) and bondedto
      (attr store1 < 112.401  and attr store1 > 111.601 ))
6 0.1 0.1 peak 856 volume 5.75534 ppm1 6.910 ppm2 4.289
 
! ############### hot_gnoesyNhsqc_051903.857 NOT folded
assi (attr store1 < 4.139 and attr store1 > 4.039 ) 
     ((attr store1 < 6.938 and attr store1 > 6.878 ) and bondedto
      (attr store1 < 112.396  and attr store1 > 111.596 ))
6 0.1 0.1 peak 857 volume 7.34563 ppm1 6.908 ppm2 4.089
 
! ############### hot_gnoesyNhsqc_051903.858 NOT folded
assi (attr store1 < 2.437 and attr store1 > 2.337 ) 
     ((attr store1 < 6.94 and attr store1 > 6.88 ) and bondedto
      (attr store1 < 112.398  and attr store1 > 111.598 ))
6 0.1 0.1 peak 858 volume 36.32571 ppm1 6.910 ppm2 2.387
 
! ############### hot_gnoesyNhsqc_051903.859 NOT folded
assi (attr store1 < 2.208 and attr store1 > 2.108 ) 
     ((attr store1 < 6.939 and attr store1 > 6.879 ) and bondedto
      (attr store1 < 112.413  and attr store1 > 111.613 ))
6 0.1 0.1 peak 859 volume 8.53903 ppm1 6.909 ppm2 2.158
 
! ############### hot_gnoesyNhsqc_051903.860 NOT folded
assi (attr store1 < 2.075 and attr store1 > 1.975 ) 
     ((attr store1 < 6.939 and attr store1 > 6.879 ) and bondedto
      (attr store1 < 112.441  and attr store1 > 111.641 ))
6 0.1 0.1 peak 860 volume 8.74069 ppm1 6.909 ppm2 2.025
 
! ############### hot_gnoesyNhsqc_051903.861 NOT folded
assi (attr store1 < 1.6 and attr store1 > 1.5 ) 
     ((attr store1 < 6.937 and attr store1 > 6.877 ) and bondedto
      (attr store1 < 112.417  and attr store1 > 111.617 ))
6 0.1 0.1 peak 861 volume 11.26532 ppm1 6.907 ppm2 1.550
 
! ############### hot_gnoesyNhsqc_051903.862 NOT folded
assi (attr store1 < 1.0 and attr store1 > 0.9 ) 
     ((attr store1 < 6.933 and attr store1 > 6.873 ) and bondedto
      (attr store1 < 112.443  and attr store1 > 111.643 ))
6 0.1 0.1 peak 862 volume 7.86350 ppm1 6.903 ppm2 0.950
 
! ############### hot_gnoesyNhsqc_051903.863 NOT folded
assi (attr store1 < 0.826 and attr store1 > 0.726 ) 
     ((attr store1 < 6.94 and attr store1 > 6.88 ) and bondedto
      (attr store1 < 112.386  and attr store1 > 111.586 ))
6 0.1 0.1 peak 863 volume 23.40523 ppm1 6.910 ppm2 0.776
 
! ############### hot_gnoesyNhsqc_051903.865 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.333  and attr store1 > 111.533 ))
6 0.1 0.1 peak 865 volume 62.24759 ppm1 6.829 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.866 NOT folded
assi (attr store1 < 4.041 and attr store1 > 3.941 ) 
     ((attr store1 < 6.861 and attr store1 > 6.801 ) and bondedto
      (attr store1 < 112.396  and attr store1 > 111.596 ))
6 0.1 0.1 peak 866 volume 6.28624 ppm1 6.831 ppm2 3.991
 
! ############### hot_gnoesyNhsqc_051903.867 NOT folded
assi (attr store1 < 3.24 and attr store1 > 3.14 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.328  and attr store1 > 111.528 ))
6 0.1 0.1 peak 867 volume 8.09421 ppm1 6.829 ppm2 3.190
 
! ############### hot_gnoesyNhsqc_051903.868 NOT folded
assi (attr store1 < 2.396 and attr store1 > 2.296 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.43  and attr store1 > 111.63 ))
6 0.1 0.1 peak 868 volume 38.95353 ppm1 6.829 ppm2 2.346
 
! ############### hot_gnoesyNhsqc_051903.869 NOT folded
assi (attr store1 < 1.95 and attr store1 > 1.85 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.383  and attr store1 > 111.583 ))
6 0.1 0.1 peak 869 volume 14.41821 ppm1 6.829 ppm2 1.900
 
! ############### hot_gnoesyNhsqc_051903.870 NOT folded
assi (attr store1 < 1.514 and attr store1 > 1.414 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.405  and attr store1 > 111.605 ))
6 0.1 0.1 peak 870 volume 8.08975 ppm1 6.829 ppm2 1.464
 
! ############### hot_gnoesyNhsqc_051903.871 NOT folded
assi (attr store1 < 1.017 and attr store1 > 0.917 ) 
     ((attr store1 < 6.86 and attr store1 > 6.8 ) and bondedto
      (attr store1 < 112.301  and attr store1 > 111.501 ))
6 0.1 0.1 peak 871 volume 20.27598 ppm1 6.830 ppm2 0.967
 
! ############### hot_gnoesyNhsqc_051903.872 NOT folded
assi (attr store1 < 0.897 and attr store1 > 0.797 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.396  and attr store1 > 111.596 ))
6 0.1 0.1 peak 872 volume 25.58360 ppm1 6.829 ppm2 0.847
 
! ############### hot_gnoesyNhsqc_051903.873 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 6.795 and attr store1 > 6.735 ) and bondedto
      (attr store1 < 112.365  and attr store1 > 111.565 ))
6 0.1 0.1 peak 873 volume 20.57741 ppm1 6.765 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.874 NOT folded
assi (attr store1 < 4.338 and attr store1 > 4.238 ) 
     ((attr store1 < 6.796 and attr store1 > 6.736 ) and bondedto
      (attr store1 < 112.394  and attr store1 > 111.594 ))
6 0.1 0.1 peak 874 volume 8.26725 ppm1 6.766 ppm2 4.288
 
! ############### hot_gnoesyNhsqc_051903.877 NOT folded
assi (attr store1 < 2.463 and attr store1 > 2.363 ) 
     ((attr store1 < 6.369 and attr store1 > 6.309 ) and bondedto
      (attr store1 < 112.521  and attr store1 > 111.721 ))
6 0.1 0.1 peak 877 volume 7.34175 ppm1 6.339 ppm2 2.413
 
! ############### hot_gnoesyNhsqc_051903.879 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.18  and attr store1 > 111.38 ))
6 0.1 0.1 peak 879 volume 58.28734 ppm1 7.399 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.880 NOT folded
assi (attr store1 < 4.283 and attr store1 > 4.183 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.204  and attr store1 > 111.404 ))
6 0.1 0.1 peak 880 volume 8.56040 ppm1 7.399 ppm2 4.233
 
! ############### hot_gnoesyNhsqc_051903.881 NOT folded
assi (attr store1 < 4.169 and attr store1 > 4.069 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.155  and attr store1 > 111.355 ))
6 0.1 0.1 peak 881 volume 6.87903 ppm1 7.399 ppm2 4.119
 
! ############### hot_gnoesyNhsqc_051903.882 NOT folded
assi (attr store1 < 2.574 and attr store1 > 2.474 ) 
     ((attr store1 < 7.428 and attr store1 > 7.368 ) and bondedto
      (attr store1 < 112.161  and attr store1 > 111.361 ))
6 0.1 0.1 peak 882 volume 27.68918 ppm1 7.398 ppm2 2.524
 
! ############### hot_gnoesyNhsqc_051903.883 NOT folded
assi (attr store1 < 2.441 and attr store1 > 2.341 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.162  and attr store1 > 111.362 ))
6 0.1 0.1 peak 883 volume 17.00747 ppm1 7.399 ppm2 2.391
 
! ############### hot_gnoesyNhsqc_051903.884 NOT folded
assi (attr store1 < 2.22 and attr store1 > 2.12 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.197  and attr store1 > 111.397 ))
6 0.1 0.1 peak 884 volume 8.85626 ppm1 7.399 ppm2 2.170
 
! ############### hot_gnoesyNhsqc_051903.885 NOT folded
assi (attr store1 < 1.896 and attr store1 > 1.796 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.215  and attr store1 > 111.415 ))
6 0.1 0.1 peak 885 volume 11.57825 ppm1 7.399 ppm2 1.846
 
! ############### hot_gnoesyNhsqc_051903.886 NOT folded
assi (attr store1 < 1.605 and attr store1 > 1.505 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.225  and attr store1 > 111.425 ))
6 0.1 0.1 peak 886 volume 8.00129 ppm1 7.399 ppm2 1.555
 
! ############### hot_gnoesyNhsqc_051903.887 NOT folded
assi (attr store1 < 1.014 and attr store1 > 0.914 ) 
     ((attr store1 < 7.43 and attr store1 > 7.37 ) and bondedto
      (attr store1 < 112.202  and attr store1 > 111.402 ))
6 0.1 0.1 peak 887 volume 13.93917 ppm1 7.400 ppm2 0.964
 
! ############### hot_gnoesyNhsqc_051903.888 NOT folded
assi (attr store1 < 0.832 and attr store1 > 0.732 ) 
     ((attr store1 < 7.43 and attr store1 > 7.37 ) and bondedto
      (attr store1 < 112.169  and attr store1 > 111.369 ))
6 0.1 0.1 peak 888 volume 8.47933 ppm1 7.400 ppm2 0.782
 
! ############### hot_gnoesyNhsqc_051903.889 NOT folded
assi (attr store1 < 4.29 and attr store1 > 4.19 ) 
     ((attr store1 < 6.858 and attr store1 > 6.798 ) and bondedto
      (attr store1 < 112.271  and attr store1 > 111.471 ))
6 0.1 0.1 peak 889 volume 6.93768 ppm1 6.828 ppm2 4.240
 
! ############### hot_gnoesyNhsqc_051903.890 NOT folded
assi (attr store1 < 2.564 and attr store1 > 2.464 ) 
     ((attr store1 < 6.861 and attr store1 > 6.801 ) and bondedto
      (attr store1 < 112.245  and attr store1 > 111.445 ))
6 0.1 0.1 peak 890 volume 17.54241 ppm1 6.831 ppm2 2.514
 
! ############### hot_gnoesyNhsqc_051903.891 NOT folded
assi (attr store1 < 1.602 and attr store1 > 1.502 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.269  and attr store1 > 111.469 ))
6 0.1 0.1 peak 891 volume 8.16521 ppm1 6.829 ppm2 1.552
 
! ############### hot_gnoesyNhsqc_051903.892 NOT folded
assi (attr store1 < 4.822 and attr store1 > 4.722 ) 
     ((attr store1 < 8.5 and attr store1 > 8.44 ) and bondedto
      (attr store1 < 110.644  and attr store1 > 109.844 ))
6 0.1 0.1 peak 892 volume 124.04306 ppm1 8.470 ppm2 4.772
 
! ############### hot_gnoesyNhsqc_051903.893 NOT folded
assi (attr store1 < 4.324 and attr store1 > 4.224 ) 
     ((attr store1 < 8.5 and attr store1 > 8.44 ) and bondedto
      (attr store1 < 110.648  and attr store1 > 109.848 ))
6 0.1 0.1 peak 893 volume 94.08873 ppm1 8.470 ppm2 4.274
 
! ############### hot_gnoesyNhsqc_051903.894 NOT folded
assi (attr store1 < 4.014 and attr store1 > 3.914 ) 
     ((attr store1 < 8.5 and attr store1 > 8.44 ) and bondedto
      (attr store1 < 110.642  and attr store1 > 109.842 ))
6 0.1 0.1 peak 894 volume 97.63710 ppm1 8.470 ppm2 3.964
 
! ############### hot_gnoesyNhsqc_051903.895 NOT folded
assi (attr store1 < 1.853 and attr store1 > 1.753 ) 
     ((attr store1 < 8.5 and attr store1 > 8.44 ) and bondedto
      (attr store1 < 110.666  and attr store1 > 109.866 ))
6 0.1 0.1 peak 895 volume 23.15612 ppm1 8.470 ppm2 1.803
 
! ############### hot_gnoesyNhsqc_051903.896 NOT folded
assi (attr store1 < 1.544 and attr store1 > 1.444 ) 
     ((attr store1 < 8.5 and attr store1 > 8.44 ) and bondedto
      (attr store1 < 110.627  and attr store1 > 109.827 ))
6 0.1 0.1 peak 896 volume 18.49894 ppm1 8.470 ppm2 1.494
 
! ############### hot_gnoesyNhsqc_051903.898 NOT folded
assi (attr store1 < 2.304 and attr store1 > 2.204 ) 
     ((attr store1 < 8.366 and attr store1 > 8.306 ) and bondedto
      (attr store1 < 109.839  and attr store1 > 109.039 ))
6 0.1 0.1 peak 898 volume 5.18323 ppm1 8.336 ppm2 2.254
 
! ############### hot_gnoesyNhsqc_051903.899 NOT folded
assi (attr store1 < 1.406 and attr store1 > 1.306 ) 
     ((attr store1 < 8.365 and attr store1 > 8.305 ) and bondedto
      (attr store1 < 109.85  and attr store1 > 109.05 ))
6 0.1 0.1 peak 899 volume 11.60124 ppm1 8.335 ppm2 1.356
 
! ############### hot_gnoesyNhsqc_051903.900 NOT folded
assi (attr store1 < 4.033 and attr store1 > 3.933 ) 
     ((attr store1 < 8.362 and attr store1 > 8.302 ) and bondedto
      (attr store1 < 109.868  and attr store1 > 109.068 ))
6 0.1 0.1 peak 900 volume 23.23255 ppm1 8.332 ppm2 3.983
 
! ############### hot_gnoesyNhsqc_051903.901 NOT folded
assi (attr store1 < 3.89 and attr store1 > 3.79 ) 
     ((attr store1 < 8.363 and attr store1 > 8.303 ) and bondedto
      (attr store1 < 109.862  and attr store1 > 109.062 ))
6 0.1 0.1 peak 901 volume 38.05093 ppm1 8.333 ppm2 3.840
 
! ############### hot_gnoesyNhsqc_051903.902 NOT folded
assi (attr store1 < 3.549 and attr store1 > 3.449 ) 
     ((attr store1 < 8.362 and attr store1 > 8.302 ) and bondedto
      (attr store1 < 109.859  and attr store1 > 109.059 ))
6 0.1 0.1 peak 902 volume 44.95882 ppm1 8.332 ppm2 3.499
 
! ############### hot_gnoesyNhsqc_051903.903 NOT folded
assi (attr store1 < 3.185 and attr store1 > 3.085 ) 
     ((attr store1 < 8.362 and attr store1 > 8.302 ) and bondedto
      (attr store1 < 109.86  and attr store1 > 109.06 ))
6 0.1 0.1 peak 903 volume 32.52378 ppm1 8.332 ppm2 3.135
 
! ############### hot_gnoesyNhsqc_051903.904 NOT folded
assi (attr store1 < 3.018 and attr store1 > 2.918 ) 
     ((attr store1 < 8.361 and attr store1 > 8.301 ) and bondedto
      (attr store1 < 109.87  and attr store1 > 109.07 ))
6 0.1 0.1 peak 904 volume 9.71913 ppm1 8.331 ppm2 2.968
 
! ############### hot_gnoesyNhsqc_051903.905 NOT folded
assi (attr store1 < 1.911 and attr store1 > 1.811 ) 
     ((attr store1 < 8.364 and attr store1 > 8.304 ) and bondedto
      (attr store1 < 109.878  and attr store1 > 109.078 ))
6 0.1 0.1 peak 905 volume 9.41801 ppm1 8.334 ppm2 1.861
 
! ############### hot_gnoesyNhsqc_051903.906 NOT folded
assi (attr store1 < 1.706 and attr store1 > 1.606 ) 
     ((attr store1 < 8.362 and attr store1 > 8.302 ) and bondedto
      (attr store1 < 109.839  and attr store1 > 109.039 ))
6 0.1 0.1 peak 906 volume 8.72931 ppm1 8.332 ppm2 1.656
 
! ############### hot_gnoesyNhsqc_051903.907 NOT folded
assi (attr store1 < 1.291 and attr store1 > 1.191 ) 
     ((attr store1 < 8.362 and attr store1 > 8.302 ) and bondedto
      (attr store1 < 109.885  and attr store1 > 109.085 ))
6 0.1 0.1 peak 907 volume 7.48447 ppm1 8.332 ppm2 1.241
 
! ############### hot_gnoesyNhsqc_051903.908 NOT folded
assi (attr store1 < 1.007 and attr store1 > 0.907 ) 
     ((attr store1 < 8.362 and attr store1 > 8.302 ) and bondedto
      (attr store1 < 109.859  and attr store1 > 109.059 ))
6 0.1 0.1 peak 908 volume 24.83034 ppm1 8.332 ppm2 0.957
 
! ############### hot_gnoesyNhsqc_051903.909 NOT folded
assi (attr store1 < 8.271 and attr store1 > 8.171 ) 
     ((attr store1 < 8.171 and attr store1 > 8.111 ) and bondedto
      (attr store1 < 133.467  and attr store1 > 132.667 ))
6 0.1 0.1 peak 909 volume 5.15486 ppm1 8.141 ppm2 8.221
 
! ############### hot_gnoesyNhsqc_051903.910 NOT folded
assi (attr store1 < 10.176 and attr store1 > 10.076 ) 
     ((attr store1 < 10.182 and attr store1 > 10.122 ) and bondedto
      (attr store1 < 133.178  and attr store1 > 132.378 ))
6 0.1 0.1 peak 910 volume 8.63720 ppm1 10.152 ppm2 10.126
 
! ############### hot_gnoesyNhsqc_051903.911 NOT folded
assi (attr store1 < 8.411 and attr store1 > 8.311 ) 
     ((attr store1 < 8.351 and attr store1 > 8.291 ) and bondedto
      (attr store1 < 133.247  and attr store1 > 132.447 ))
6 0.1 0.1 peak 911 volume 5.12678 ppm1 8.321 ppm2 8.361
 
! ############### hot_gnoesyNhsqc_051903.912 NOT folded
assi (attr store1 < 9.379 and attr store1 > 9.279 ) 
     ((attr store1 < 9.36 and attr store1 > 9.3 ) and bondedto
      (attr store1 < 132.725  and attr store1 > 131.925 ))
6 0.1 0.1 peak 912 volume 152.32591 ppm1 9.330 ppm2 9.329
 
! ############### hot_gnoesyNhsqc_051903.913 NOT folded
assi (attr store1 < 8.646 and attr store1 > 8.546 ) 
     ((attr store1 < 9.36 and attr store1 > 9.3 ) and bondedto
      (attr store1 < 132.745  and attr store1 > 131.945 ))
6 0.1 0.1 peak 913 volume 6.41677 ppm1 9.330 ppm2 8.596
 
! ############### hot_gnoesyNhsqc_051903.914 NOT folded
assi (attr store1 < 7.235 and attr store1 > 7.135 ) 
     ((attr store1 < 9.359 and attr store1 > 9.299 ) and bondedto
      (attr store1 < 132.718  and attr store1 > 131.918 ))
6 0.1 0.1 peak 914 volume 5.96804 ppm1 9.329 ppm2 7.185
 
! ############### hot_gnoesyNhsqc_051903.915 NOT folded
assi (attr store1 < 10.179 and attr store1 > 10.079 ) 
     ((attr store1 < 10.183 and attr store1 > 10.123 ) and bondedto
      (attr store1 < 132.13  and attr store1 > 131.33 ))
6 0.1 0.1 peak 915 volume 10.63058 ppm1 10.153 ppm2 10.129
 
! ############### hot_gnoesyNhsqc_051903.916 NOT folded
assi (attr store1 < 8.009 and attr store1 > 7.909 ) 
     ((attr store1 < 8.005 and attr store1 > 7.945 ) and bondedto
      (attr store1 < 131.761  and attr store1 > 130.961 ))
6 0.1 0.1 peak 916 volume 8.66613 ppm1 7.975 ppm2 7.959
 
! ############### hot_gnoesyNhsqc_051903.917 NOT folded
assi (attr store1 < 10.246 and attr store1 > 10.146 ) 
     ((attr store1 < 10.208 and attr store1 > 10.148 ) and bondedto
      (attr store1 < 131.376  and attr store1 > 130.576 ))
6 0.1 0.1 peak 917 volume 8.66466 ppm1 10.178 ppm2 10.196
 
! ############### hot_gnoesyNhsqc_051903.918 NOT folded
assi (attr store1 < 10.181 and attr store1 > 10.081 ) 
     ((attr store1 < 10.185 and attr store1 > 10.125 ) and bondedto
      (attr store1 < 131.452  and attr store1 > 130.652 ))
6 0.1 0.1 peak 918 volume 9.28773 ppm1 10.155 ppm2 10.131
 
! ############### hot_gnoesyNhsqc_051903.919 NOT folded
assi (attr store1 < 8.374 and attr store1 > 8.274 ) 
     ((attr store1 < 8.35 and attr store1 > 8.29 ) and bondedto
      (attr store1 < 131.126  and attr store1 > 130.326 ))
6 0.1 0.1 peak 919 volume 5.46725 ppm1 8.320 ppm2 8.324
 
! ############### hot_gnoesyNhsqc_051903.920 NOT folded
assi (attr store1 < 10.308 and attr store1 > 10.208 ) 
     ((attr store1 < 10.285 and attr store1 > 10.225 ) and bondedto
      (attr store1 < 130.937  and attr store1 > 130.137 ))
6 0.1 0.1 peak 920 volume 7.80113 ppm1 10.255 ppm2 10.258
 
! ############### hot_gnoesyNhsqc_051903.921 NOT folded
assi (attr store1 < 8.002 and attr store1 > 7.902 ) 
     ((attr store1 < 8.011 and attr store1 > 7.951 ) and bondedto
      (attr store1 < 130.923  and attr store1 > 130.123 ))
6 0.1 0.1 peak 921 volume 6.28808 ppm1 7.981 ppm2 7.952
 
! ############### hot_gnoesyNhsqc_051903.922 NOT folded
assi (attr store1 < 7.967 and attr store1 > 7.867 ) 
     ((attr store1 < 7.951 and attr store1 > 7.891 ) and bondedto
      (attr store1 < 130.852  and attr store1 > 130.052 ))
6 0.1 0.1 peak 922 volume 5.97897 ppm1 7.921 ppm2 7.917
 
! ############### hot_gnoesyNhsqc_051903.923 NOT folded
assi (attr store1 < 8.061 and attr store1 > 7.961 ) 
     ((attr store1 < 8.037 and attr store1 > 7.977 ) and bondedto
      (attr store1 < 130.56  and attr store1 > 129.76 ))
6 0.1 0.1 peak 923 volume 16.65299 ppm1 8.007 ppm2 8.011
 
! ############### hot_gnoesyNhsqc_051903.924 NOT folded
assi (attr store1 < 7.834 and attr store1 > 7.734 ) 
     ((attr store1 < 7.987 and attr store1 > 7.927 ) and bondedto
      (attr store1 < 130.464  and attr store1 > 129.664 ))
6 0.1 0.1 peak 924 volume 5.19785 ppm1 7.957 ppm2 7.784
 
! ############### hot_gnoesyNhsqc_051903.925 NOT folded
assi (attr store1 < 8.01 and attr store1 > 7.91 ) 
     ((attr store1 < 7.932 and attr store1 > 7.872 ) and bondedto
      (attr store1 < 130.451  and attr store1 > 129.651 ))
6 0.1 0.1 peak 925 volume 5.26674 ppm1 7.902 ppm2 7.960
 
! ############### hot_gnoesyNhsqc_051903.926 NOT folded
assi (attr store1 < 10.221 and attr store1 > 10.121 ) 
     ((attr store1 < 10.379 and attr store1 > 10.319 ) and bondedto
      (attr store1 < 130.029  and attr store1 > 129.229 ))
6 0.1 0.1 peak 926 volume 10.58174 ppm1 10.349 ppm2 10.171
 
! ############### hot_gnoesyNhsqc_051903.927 NOT folded
assi (attr store1 < 10.221 and attr store1 > 10.121 ) 
     ((attr store1 < 10.314 and attr store1 > 10.254 ) and bondedto
      (attr store1 < 130.02  and attr store1 > 129.22 ))
6 0.1 0.1 peak 927 volume 25.26477 ppm1 10.284 ppm2 10.171
 
! ############### hot_gnoesyNhsqc_051903.928 NOT folded
assi (attr store1 < 7.178 and attr store1 > 7.078 ) 
     ((attr store1 < 10.202 and attr store1 > 10.142 ) and bondedto
      (attr store1 < 130.023  and attr store1 > 129.223 ))
6 0.1 0.1 peak 928 volume 70.52411 ppm1 10.172 ppm2 7.128
 
! ############### hot_gnoesyNhsqc_051903.929 NOT folded
assi (attr store1 < 10.444 and attr store1 > 10.344 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.011  and attr store1 > 129.211 ))
6 0.1 0.1 peak 929 volume 10.14281 ppm1 10.168 ppm2 10.394
 
! ############### hot_gnoesyNhsqc_051903.930 NOT folded
assi (attr store1 < 10.22 and attr store1 > 10.12 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.023  and attr store1 > 129.223 ))
6 0.1 0.1 peak 930 volume 3423.24243 ppm1 10.168 ppm2 10.170
 
! ############### hot_gnoesyNhsqc_051903.931 NOT folded
assi (attr store1 < 7.466 and attr store1 > 7.366 ) 
     ((attr store1 < 10.196 and attr store1 > 10.136 ) and bondedto
      (attr store1 < 130.023  and attr store1 > 129.223 ))
6 0.1 0.1 peak 931 volume 117.30684 ppm1 10.166 ppm2 7.416
 
! ############### hot_gnoesyNhsqc_051903.932 NOT folded
assi (attr store1 < 7.333 and attr store1 > 7.233 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.025  and attr store1 > 129.225 ))
6 0.1 0.1 peak 932 volume 152.06520 ppm1 10.168 ppm2 7.283
 
! ############### hot_gnoesyNhsqc_051903.933 NOT folded
assi (attr store1 < 6.943 and attr store1 > 6.843 ) 
     ((attr store1 < 10.197 and attr store1 > 10.137 ) and bondedto
      (attr store1 < 130.037  and attr store1 > 129.237 ))
6 0.1 0.1 peak 933 volume 7.13978 ppm1 10.167 ppm2 6.893
 
! ############### hot_gnoesyNhsqc_051903.934 NOT folded
assi (attr store1 < 6.862 and attr store1 > 6.762 ) 
     ((attr store1 < 10.198 and attr store1 > 10.138 ) and bondedto
      (attr store1 < 130.045  and attr store1 > 129.245 ))
6 0.1 0.1 peak 934 volume 7.30008 ppm1 10.168 ppm2 6.812
 
! ############### hot_gnoesyNhsqc_051903.935 NOT folded
assi (attr store1 < 10.22 and attr store1 > 10.12 ) 
     ((attr store1 < 10.087 and attr store1 > 10.027 ) and bondedto
      (attr store1 < 130.041  and attr store1 > 129.241 ))
6 0.1 0.1 peak 935 volume 32.36256 ppm1 10.057 ppm2 10.170
 
! ############### hot_gnoesyNhsqc_051903.936 NOT folded
assi (attr store1 < 10.216 and attr store1 > 10.116 ) 
     ((attr store1 < 10.021 and attr store1 > 9.961 ) and bondedto
      (attr store1 < 130.029  and attr store1 > 129.229 ))
6 0.1 0.1 peak 936 volume 14.38721 ppm1 9.991 ppm2 10.166
 
! ############### hot_gnoesyNhsqc_051903.937 NOT folded
assi (attr store1 < 10.225 and attr store1 > 10.125 ) 
     ((attr store1 < 9.947 and attr store1 > 9.887 ) and bondedto
      (attr store1 < 130.012  and attr store1 > 129.212 ))
6 0.1 0.1 peak 937 volume 5.83489 ppm1 9.917 ppm2 10.175
 
! ############### hot_gnoesyNhsqc_051903.938 NOT folded
assi (attr store1 < 10.224 and attr store1 > 10.124 ) 
     ((attr store1 < 9.896 and attr store1 > 9.836 ) and bondedto
      (attr store1 < 130.035  and attr store1 > 129.235 ))
6 0.1 0.1 peak 938 volume 9.41406 ppm1 9.866 ppm2 10.174
 
! ############### hot_gnoesyNhsqc_051903.939 NOT folded
assi (attr store1 < 10.22 and attr store1 > 10.12 ) 
     ((attr store1 < 9.844 and attr store1 > 9.784 ) and bondedto
      (attr store1 < 130.053  and attr store1 > 129.253 ))
6 0.1 0.1 peak 939 volume 10.04981 ppm1 9.814 ppm2 10.170
 
! ############### hot_gnoesyNhsqc_051903.940 NOT folded
assi (attr store1 < 8.33 and attr store1 > 8.23 ) 
     ((attr store1 < 8.31 and attr store1 > 8.25 ) and bondedto
      (attr store1 < 129.954  and attr store1 > 129.154 ))
6 0.1 0.1 peak 940 volume 8.58503 ppm1 8.280 ppm2 8.280
 
! ############### hot_gnoesyNhsqc_051903.941 NOT folded
assi (attr store1 < 10.221 and attr store1 > 10.121 ) 
     ((attr store1 < 7.461 and attr store1 > 7.401 ) and bondedto
      (attr store1 < 130.009  and attr store1 > 129.209 ))
6 0.1 0.1 peak 941 volume 6.91404 ppm1 7.431 ppm2 10.171
 
! ############### hot_gnoesyNhsqc_051903.942 NOT folded
assi (attr store1 < 10.221 and attr store1 > 10.121 ) 
     ((attr store1 < 7.163 and attr store1 > 7.103 ) and bondedto
      (attr store1 < 130.005  and attr store1 > 129.205 ))
6 0.1 0.1 peak 942 volume 8.87063 ppm1 7.133 ppm2 10.171
 
! ############### hot_gnoesyNhsqc_051903.943 NOT folded
assi (attr store1 < 8.044 and attr store1 > 7.944 ) 
     ((attr store1 < 7.356 and attr store1 > 7.296 ) and bondedto
      (attr store1 < 129.423  and attr store1 > 128.623 ))
6 0.1 0.1 peak 943 volume 5.46066 ppm1 7.326 ppm2 7.994
 
! ############### hot_gnoesyNhsqc_051903.944 NOT folded
assi (attr store1 < 10.212 and attr store1 > 10.112 ) 
     ((attr store1 < 10.201 and attr store1 > 10.141 ) and bondedto
      (attr store1 < 129.304  and attr store1 > 128.504 ))
6 0.1 0.1 peak 944 volume 18.12006 ppm1 10.171 ppm2 10.162
 
! ############### hot_gnoesyNhsqc_051903.945 NOT folded
assi (attr store1 < 8.046 and attr store1 > 7.946 ) 
     ((attr store1 < 8.814 and attr store1 > 8.754 ) and bondedto
      (attr store1 < 129.307  and attr store1 > 128.507 ))
6 0.1 0.1 peak 945 volume 5.96090 ppm1 8.784 ppm2 7.996
 
! ############### hot_gnoesyNhsqc_051903.946 NOT folded
assi (attr store1 < 8.046 and attr store1 > 7.946 ) 
     ((attr store1 < 8.381 and attr store1 > 8.321 ) and bondedto
      (attr store1 < 129.277  and attr store1 > 128.477 ))
6 0.1 0.1 peak 946 volume 11.79617 ppm1 8.351 ppm2 7.996
 
! ############### hot_gnoesyNhsqc_051903.947 NOT folded
assi (attr store1 < 8.043 and attr store1 > 7.943 ) 
     ((attr store1 < 8.328 and attr store1 > 8.268 ) and bondedto
      (attr store1 < 129.286  and attr store1 > 128.486 ))
6 0.1 0.1 peak 947 volume 8.06350 ppm1 8.298 ppm2 7.993
 
! ############### hot_gnoesyNhsqc_051903.948 NOT folded
assi (attr store1 < 8.043 and attr store1 > 7.943 ) 
     ((attr store1 < 8.205 and attr store1 > 8.145 ) and bondedto
      (attr store1 < 129.306  and attr store1 > 128.506 ))
6 0.1 0.1 peak 948 volume 12.52986 ppm1 8.175 ppm2 7.993
 
! ############### hot_gnoesyNhsqc_051903.949 NOT folded
assi (attr store1 < 8.046 and attr store1 > 7.946 ) 
     ((attr store1 < 8.141 and attr store1 > 8.081 ) and bondedto
      (attr store1 < 129.333  and attr store1 > 128.533 ))
6 0.1 0.1 peak 949 volume 24.48656 ppm1 8.111 ppm2 7.996
 
! ############### hot_gnoesyNhsqc_051903.950 NOT folded
assi (attr store1 < 8.542 and attr store1 > 8.442 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 129.355  and attr store1 > 128.555 ))
6 0.1 0.1 peak 950 volume 5.22666 ppm1 7.993 ppm2 8.492
 
! ############### hot_gnoesyNhsqc_051903.951 NOT folded
assi (attr store1 < 8.438 and attr store1 > 8.338 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 129.297  and attr store1 > 128.497 ))
6 0.1 0.1 peak 951 volume 6.18441 ppm1 7.992 ppm2 8.388
 
! ############### hot_gnoesyNhsqc_051903.952 NOT folded
assi (attr store1 < 8.366 and attr store1 > 8.266 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 129.307  and attr store1 > 128.507 ))
6 0.1 0.1 peak 952 volume 22.60586 ppm1 7.992 ppm2 8.316
 
! ############### hot_gnoesyNhsqc_051903.953 NOT folded
assi (attr store1 < 8.283 and attr store1 > 8.183 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 129.303  and attr store1 > 128.503 ))
6 0.1 0.1 peak 953 volume 22.94305 ppm1 7.993 ppm2 8.233
 
! ############### hot_gnoesyNhsqc_051903.954 NOT folded
assi (attr store1 < 8.191 and attr store1 > 8.091 ) 
     ((attr store1 < 8.024 and attr store1 > 7.964 ) and bondedto
      (attr store1 < 129.313  and attr store1 > 128.513 ))
6 0.1 0.1 peak 954 volume 86.89918 ppm1 7.994 ppm2 8.141
 
! ############### hot_gnoesyNhsqc_051903.955 NOT folded
assi (attr store1 < 8.046 and attr store1 > 7.946 ) 
     ((attr store1 < 8.024 and attr store1 > 7.964 ) and bondedto
      (attr store1 < 129.307  and attr store1 > 128.507 ))
6 0.1 0.1 peak 955 volume 7676.91895 ppm1 7.994 ppm2 7.996
 
! ############### hot_gnoesyNhsqc_051903.956 NOT folded
assi (attr store1 < 7.878 and attr store1 > 7.778 ) 
     ((attr store1 < 8.024 and attr store1 > 7.964 ) and bondedto
      (attr store1 < 129.295  and attr store1 > 128.495 ))
6 0.1 0.1 peak 956 volume 23.93271 ppm1 7.994 ppm2 7.828
 
! ############### hot_gnoesyNhsqc_051903.957 NOT folded
assi (attr store1 < 8.046 and attr store1 > 7.946 ) 
     ((attr store1 < 7.908 and attr store1 > 7.848 ) and bondedto
      (attr store1 < 129.346  and attr store1 > 128.546 ))
6 0.1 0.1 peak 957 volume 34.53576 ppm1 7.878 ppm2 7.996
 
! ############### hot_gnoesyNhsqc_051903.958 NOT folded
assi (attr store1 < 8.047 and attr store1 > 7.947 ) 
     ((attr store1 < 7.842 and attr store1 > 7.782 ) and bondedto
      (attr store1 < 129.336  and attr store1 > 128.536 ))
6 0.1 0.1 peak 958 volume 21.64517 ppm1 7.812 ppm2 7.997
 
! ############### hot_gnoesyNhsqc_051903.959 NOT folded
assi (attr store1 < 8.045 and attr store1 > 7.945 ) 
     ((attr store1 < 7.72 and attr store1 > 7.66 ) and bondedto
      (attr store1 < 129.349  and attr store1 > 128.549 ))
6 0.1 0.1 peak 959 volume 12.63310 ppm1 7.690 ppm2 7.995
 
! ############### hot_gnoesyNhsqc_051903.960 NOT folded
assi (attr store1 < 8.049 and attr store1 > 7.949 ) 
     ((attr store1 < 7.667 and attr store1 > 7.607 ) and bondedto
      (attr store1 < 129.351  and attr store1 > 128.551 ))
6 0.1 0.1 peak 960 volume 13.19818 ppm1 7.637 ppm2 7.999
 
! ############### hot_gnoesyNhsqc_051903.961 NOT folded
assi (attr store1 < 8.044 and attr store1 > 7.944 ) 
     ((attr store1 < 7.236 and attr store1 > 7.176 ) and bondedto
      (attr store1 < 129.381  and attr store1 > 128.581 ))
6 0.1 0.1 peak 961 volume 6.24304 ppm1 7.206 ppm2 7.994
 
! ############### hot_gnoesyNhsqc_051903.962 NOT folded
assi (attr store1 < 10.236 and attr store1 > 10.136 ) 
     ((attr store1 < 10.203 and attr store1 > 10.143 ) and bondedto
      (attr store1 < 128.784  and attr store1 > 127.984 ))
6 0.1 0.1 peak 962 volume 13.78331 ppm1 10.173 ppm2 10.186
 
! ############### hot_gnoesyNhsqc_051903.963 NOT folded
assi (attr store1 < 8.045 and attr store1 > 7.945 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 128.605  and attr store1 > 127.805 ))
6 0.1 0.1 peak 963 volume 29.62807 ppm1 7.993 ppm2 7.995
 
! ############### hot_gnoesyNhsqc_051903.964 NOT folded
assi (attr store1 < 7.925 and attr store1 > 7.825 ) 
     ((attr store1 < 7.906 and attr store1 > 7.846 ) and bondedto
      (attr store1 < 128.573  and attr store1 > 127.773 ))
6 0.1 0.1 peak 964 volume 23.03831 ppm1 7.876 ppm2 7.875
 
! ############### hot_gnoesyNhsqc_051903.965 NOT folded
assi (attr store1 < 10.179 and attr store1 > 10.079 ) 
     ((attr store1 < 10.188 and attr store1 > 10.128 ) and bondedto
      (attr store1 < 128.323  and attr store1 > 127.523 ))
6 0.1 0.1 peak 965 volume 9.01776 ppm1 10.158 ppm2 10.129
 
! ############### hot_gnoesyNhsqc_051903.966 NOT folded
assi (attr store1 < 8.37 and attr store1 > 8.27 ) 
     ((attr store1 < 8.346 and attr store1 > 8.286 ) and bondedto
      (attr store1 < 128.285  and attr store1 > 127.485 ))
6 0.1 0.1 peak 966 volume 8.19121 ppm1 8.316 ppm2 8.320
 
! ############### hot_gnoesyNhsqc_051903.967 NOT folded
assi (attr store1 < 9.379 and attr store1 > 9.279 ) 
     ((attr store1 < 8.628 and attr store1 > 8.568 ) and bondedto
      (attr store1 < 128.169  and attr store1 > 127.369 ))
6 0.1 0.1 peak 967 volume 8.70419 ppm1 8.598 ppm2 9.329
 
! ############### hot_gnoesyNhsqc_051903.968 NOT folded
assi (attr store1 < 8.643 and attr store1 > 8.543 ) 
     ((attr store1 < 8.623 and attr store1 > 8.563 ) and bondedto
      (attr store1 < 128.13  and attr store1 > 127.33 ))
6 0.1 0.1 peak 968 volume 104.89882 ppm1 8.593 ppm2 8.593
 
! ############### hot_gnoesyNhsqc_051903.969 NOT folded
assi (attr store1 < 7.783 and attr store1 > 7.683 ) 
     ((attr store1 < 8.623 and attr store1 > 8.563 ) and bondedto
      (attr store1 < 128.136  and attr store1 > 127.336 ))
6 0.1 0.1 peak 969 volume 9.86332 ppm1 8.593 ppm2 7.733
 
! ############### hot_gnoesyNhsqc_051903.970 NOT folded
assi (attr store1 < 8.154 and attr store1 > 8.054 ) 
     ((attr store1 < 8.154 and attr store1 > 8.094 ) and bondedto
      (attr store1 < 128.037  and attr store1 > 127.237 ))
6 0.1 0.1 peak 970 volume 6.65091 ppm1 8.124 ppm2 8.104
 
! ############### hot_gnoesyNhsqc_051903.971 NOT folded
assi (attr store1 < 8.056 and attr store1 > 7.956 ) 
     ((attr store1 < 8.03 and attr store1 > 7.97 ) and bondedto
      (attr store1 < 128.063  and attr store1 > 127.263 ))
6 0.1 0.1 peak 971 volume 22.60546 ppm1 8.000 ppm2 8.006
 
! ############### hot_gnoesyNhsqc_051903.972 NOT folded
assi (attr store1 < 10.18 and attr store1 > 10.08 ) 
     ((attr store1 < 10.184 and attr store1 > 10.124 ) and bondedto
      (attr store1 < 127.878  and attr store1 > 127.078 ))
6 0.1 0.1 peak 972 volume 9.91306 ppm1 10.154 ppm2 10.130
 
! ############### hot_gnoesyNhsqc_051903.973 NOT folded
assi (attr store1 < 8.368 and attr store1 > 8.268 ) 
     ((attr store1 < 8.346 and attr store1 > 8.286 ) and bondedto
      (attr store1 < 127.961  and attr store1 > 127.161 ))
6 0.1 0.1 peak 973 volume 19.35377 ppm1 8.316 ppm2 8.318
 
! ############### hot_gnoesyNhsqc_051903.974 NOT folded
assi (attr store1 < 8.169 and attr store1 > 8.069 ) 
     ((attr store1 < 8.152 and attr store1 > 8.092 ) and bondedto
      (attr store1 < 127.666  and attr store1 > 126.866 ))
6 0.1 0.1 peak 974 volume 9.00803 ppm1 8.122 ppm2 8.119
 
! ############### hot_gnoesyNhsqc_051903.975 NOT folded
assi (attr store1 < 8.058 and attr store1 > 7.958 ) 
     ((attr store1 < 8.028 and attr store1 > 7.968 ) and bondedto
      (attr store1 < 127.78  and attr store1 > 126.98 ))
6 0.1 0.1 peak 975 volume 18.27374 ppm1 7.998 ppm2 8.008
 
! ############### hot_gnoesyNhsqc_051903.976 NOT folded
assi (attr store1 < 10.272 and attr store1 > 10.172 ) 
     ((attr store1 < 10.213 and attr store1 > 10.153 ) and bondedto
      (attr store1 < 127.47  and attr store1 > 126.67 ))
6 0.1 0.1 peak 976 volume 5.48361 ppm1 10.183 ppm2 10.222
 
! ############### hot_gnoesyNhsqc_051903.977 NOT folded
assi (attr store1 < 10.18 and attr store1 > 10.08 ) 
     ((attr store1 < 10.183 and attr store1 > 10.123 ) and bondedto
      (attr store1 < 127.549  and attr store1 > 126.749 ))
6 0.1 0.1 peak 977 volume 9.16501 ppm1 10.153 ppm2 10.130
 
! ############### hot_gnoesyNhsqc_051903.978 NOT folded
assi (attr store1 < 8.466 and attr store1 > 8.366 ) 
     ((attr store1 < 8.466 and attr store1 > 8.406 ) and bondedto
      (attr store1 < 127.468  and attr store1 > 126.668 ))
6 0.1 0.1 peak 978 volume 5.48903 ppm1 8.436 ppm2 8.416
 
! ############### hot_gnoesyNhsqc_051903.979 NOT folded
assi (attr store1 < 8.362 and attr store1 > 8.262 ) 
     ((attr store1 < 8.34 and attr store1 > 8.28 ) and bondedto
      (attr store1 < 127.506  and attr store1 > 126.706 ))
6 0.1 0.1 peak 979 volume 27.62433 ppm1 8.310 ppm2 8.312
 
! ############### hot_gnoesyNhsqc_051903.980 NOT folded
assi (attr store1 < 8.277 and attr store1 > 8.177 ) 
     ((attr store1 < 8.254 and attr store1 > 8.194 ) and bondedto
      (attr store1 < 127.224  and attr store1 > 126.424 ))
6 0.1 0.1 peak 980 volume 12.18118 ppm1 8.224 ppm2 8.227
 
! ############### hot_gnoesyNhsqc_051903.981 NOT folded
assi (attr store1 < 8.172 and attr store1 > 8.072 ) 
     ((attr store1 < 8.161 and attr store1 > 8.101 ) and bondedto
      (attr store1 < 127.211  and attr store1 > 126.411 ))
6 0.1 0.1 peak 981 volume 20.52246 ppm1 8.131 ppm2 8.122
 
! ############### hot_gnoesyNhsqc_051903.982 NOT folded
assi (attr store1 < 10.182 and attr store1 > 10.082 ) 
     ((attr store1 < 10.185 and attr store1 > 10.125 ) and bondedto
      (attr store1 < 127.006  and attr store1 > 126.206 ))
6 0.1 0.1 peak 982 volume 9.27014 ppm1 10.155 ppm2 10.132
 
! ############### hot_gnoesyNhsqc_051903.983 NOT folded
assi (attr store1 < 7.925 and attr store1 > 7.825 ) 
     ((attr store1 < 7.905 and attr store1 > 7.845 ) and bondedto
      (attr store1 < 127.013  and attr store1 > 126.213 ))
6 0.1 0.1 peak 983 volume 5.15441 ppm1 7.875 ppm2 7.875
 
! ############### hot_gnoesyNhsqc_051903.984 NOT folded
assi (attr store1 < 8.358 and attr store1 > 8.258 ) 
     ((attr store1 < 8.644 and attr store1 > 8.584 ) and bondedto
      (attr store1 < 126.706  and attr store1 > 125.906 ))
6 0.1 0.1 peak 984 volume 9.50798 ppm1 8.614 ppm2 8.308
 
! ############### hot_gnoesyNhsqc_051903.985 NOT folded
assi (attr store1 < 8.363 and attr store1 > 8.263 ) 
     ((attr store1 < 8.577 and attr store1 > 8.517 ) and bondedto
      (attr store1 < 126.732  and attr store1 > 125.932 ))
6 0.1 0.1 peak 985 volume 6.29569 ppm1 8.547 ppm2 8.313
 
! ############### hot_gnoesyNhsqc_051903.986 NOT folded
assi (attr store1 < 8.362 and attr store1 > 8.262 ) 
     ((attr store1 < 8.522 and attr store1 > 8.462 ) and bondedto
      (attr store1 < 126.729  and attr store1 > 125.929 ))
6 0.1 0.1 peak 986 volume 15.68911 ppm1 8.492 ppm2 8.312
 
! ############### hot_gnoesyNhsqc_051903.987 NOT folded
assi (attr store1 < 8.675 and attr store1 > 8.575 ) 
     ((attr store1 < 8.342 and attr store1 > 8.282 ) and bondedto
      (attr store1 < 126.74  and attr store1 > 125.94 ))
6 0.1 0.1 peak 987 volume 7.15842 ppm1 8.312 ppm2 8.625
 
! ############### hot_gnoesyNhsqc_051903.988 NOT folded
assi (attr store1 < 8.586 and attr store1 > 8.486 ) 
     ((attr store1 < 8.342 and attr store1 > 8.282 ) and bondedto
      (attr store1 < 126.718  and attr store1 > 125.918 ))
6 0.1 0.1 peak 988 volume 14.65297 ppm1 8.312 ppm2 8.536
 
! ############### hot_gnoesyNhsqc_051903.989 NOT folded
assi (attr store1 < 8.362 and attr store1 > 8.262 ) 
     ((attr store1 < 8.342 and attr store1 > 8.282 ) and bondedto
      (attr store1 < 126.725  and attr store1 > 125.925 ))
6 0.1 0.1 peak 989 volume 4625.54492 ppm1 8.312 ppm2 8.312
 
! ############### hot_gnoesyNhsqc_051903.990 NOT folded
assi (attr store1 < 8.012 and attr store1 > 7.912 ) 
     ((attr store1 < 8.342 and attr store1 > 8.282 ) and bondedto
      (attr store1 < 126.724  and attr store1 > 125.924 ))
6 0.1 0.1 peak 990 volume 25.00325 ppm1 8.312 ppm2 7.962
 
! ############### hot_gnoesyNhsqc_051903.991 NOT folded
assi (attr store1 < 7.978 and attr store1 > 7.878 ) 
     ((attr store1 < 7.951 and attr store1 > 7.891 ) and bondedto
      (attr store1 < 126.827  and attr store1 > 126.027 ))
6 0.1 0.1 peak 991 volume 5.32837 ppm1 7.921 ppm2 7.928
 
! ############### hot_gnoesyNhsqc_051903.992 NOT folded
assi (attr store1 < 8.183 and attr store1 > 8.083 ) 
     ((attr store1 < 8.065 and attr store1 > 8.005 ) and bondedto
      (attr store1 < 126.466  and attr store1 > 125.666 ))
6 0.1 0.1 peak 992 volume 11.28388 ppm1 8.035 ppm2 8.133
 
! ############### hot_gnoesyNhsqc_051903.993 NOT folded
assi (attr store1 < 8.106 and attr store1 > 8.006 ) 
     ((attr store1 < 8.036 and attr store1 > 7.976 ) and bondedto
      (attr store1 < 126.551  and attr store1 > 125.751 ))
6 0.1 0.1 peak 993 volume 8.92466 ppm1 8.006 ppm2 8.056
 
! ############### hot_gnoesyNhsqc_051903.994 NOT folded
assi (attr store1 < 8.187 and attr store1 > 8.087 ) 
     ((attr store1 < 8.471 and attr store1 > 8.411 ) and bondedto
      (attr store1 < 126.343  and attr store1 > 125.543 ))
6 0.1 0.1 peak 994 volume 5.22720 ppm1 8.441 ppm2 8.137
 
! ############### hot_gnoesyNhsqc_051903.995 NOT folded
assi (attr store1 < 8.185 and attr store1 > 8.085 ) 
     ((attr store1 < 8.452 and attr store1 > 8.392 ) and bondedto
      (attr store1 < 126.387  and attr store1 > 125.587 ))
6 0.1 0.1 peak 995 volume 5.57498 ppm1 8.422 ppm2 8.135
 
! ############### hot_gnoesyNhsqc_051903.996 NOT folded
assi (attr store1 < 8.18 and attr store1 > 8.08 ) 
     ((attr store1 < 8.16 and attr store1 > 8.1 ) and bondedto
      (attr store1 < 126.384  and attr store1 > 125.584 ))
6 0.1 0.1 peak 996 volume 1382.55103 ppm1 8.130 ppm2 8.130
 
! ############### hot_gnoesyNhsqc_051903.997 NOT folded
assi (attr store1 < 7.827 and attr store1 > 7.727 ) 
     ((attr store1 < 8.159 and attr store1 > 8.099 ) and bondedto
      (attr store1 < 126.382  and attr store1 > 125.582 ))
6 0.1 0.1 peak 997 volume 94.79957 ppm1 8.129 ppm2 7.777
 
! ############### hot_gnoesyNhsqc_051903.998 NOT folded
assi (attr store1 < 7.672 and attr store1 > 7.572 ) 
     ((attr store1 < 8.161 and attr store1 > 8.101 ) and bondedto
      (attr store1 < 126.395  and attr store1 > 125.595 ))
6 0.1 0.1 peak 998 volume 5.26394 ppm1 8.131 ppm2 7.622
 
! ############### hot_gnoesyNhsqc_051903.999 NOT folded
assi (attr store1 < 8.486 and attr store1 > 8.386 ) 
     ((attr store1 < 8.156 and attr store1 > 8.096 ) and bondedto
      (attr store1 < 126.346  and attr store1 > 125.546 ))
6 0.1 0.1 peak 999 volume 5.58753 ppm1 8.126 ppm2 8.436
 
! ############### hot_gnoesyNhsqc_051903.1000 NOT folded
assi (attr store1 < 10.181 and attr store1 > 10.081 ) 
     ((attr store1 < 10.183 and attr store1 > 10.123 ) and bondedto
      (attr store1 < 125.735  and attr store1 > 124.935 ))
6 0.1 0.1 peak 1000 volume 8.79358 ppm1 10.153 ppm2 10.131
 
! ############### hot_gnoesyNhsqc_051903.1001 NOT folded
assi (attr store1 < 8.362 and attr store1 > 8.262 ) 
     ((attr store1 < 8.342 and attr store1 > 8.282 ) and bondedto
      (attr store1 < 125.736  and attr store1 > 124.936 ))
6 0.1 0.1 peak 1001 volume 13.99451 ppm1 8.312 ppm2 8.312
 
! ############### hot_gnoesyNhsqc_051903.1002 NOT folded
assi (attr store1 < 8.173 and attr store1 > 8.073 ) 
     ((attr store1 < 8.162 and attr store1 > 8.102 ) and bondedto
      (attr store1 < 125.636  and attr store1 > 124.836 ))
6 0.1 0.1 peak 1002 volume 32.29156 ppm1 8.132 ppm2 8.123
 
! ############### hot_gnoesyNhsqc_051903.1003 NOT folded
assi (attr store1 < 8.409 and attr store1 > 8.309 ) 
     ((attr store1 < 8.392 and attr store1 > 8.332 ) and bondedto
      (attr store1 < 125.337  and attr store1 > 124.537 ))
6 0.1 0.1 peak 1003 volume 6.43408 ppm1 8.362 ppm2 8.359
 
! ############### hot_gnoesyNhsqc_051903.1004 NOT folded
assi (attr store1 < 8.371 and attr store1 > 8.271 ) 
     ((attr store1 < 8.346 and attr store1 > 8.286 ) and bondedto
      (attr store1 < 125.352  and attr store1 > 124.552 ))
6 0.1 0.1 peak 1004 volume 19.55599 ppm1 8.316 ppm2 8.321
 
! ############### hot_gnoesyNhsqc_051903.1005 NOT folded
assi (attr store1 < 7.564 and attr store1 > 7.464 ) 
     ((attr store1 < 8.027 and attr store1 > 7.967 ) and bondedto
      (attr store1 < 125.387  and attr store1 > 124.587 ))
6 0.1 0.1 peak 1005 volume 6.02526 ppm1 7.997 ppm2 7.514
 
! ############### hot_gnoesyNhsqc_051903.1006 NOT folded
assi (attr store1 < 8.764 and attr store1 > 8.664 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 125.372  and attr store1 > 124.572 ))
6 0.1 0.1 peak 1006 volume 37.68122 ppm1 7.992 ppm2 8.714
 
! ############### hot_gnoesyNhsqc_051903.1007 NOT folded
assi (attr store1 < 8.319 and attr store1 > 8.219 ) 
     ((attr store1 < 8.022 and attr store1 > 7.962 ) and bondedto
      (attr store1 < 125.385  and attr store1 > 124.585 ))
6 0.1 0.1 peak 1007 volume 7.94795 ppm1 7.992 ppm2 8.269
 
! ############### hot_gnoesyNhsqc_051903.1008 NOT folded
assi (attr store1 < 8.037 and attr store1 > 7.937 ) 
     ((attr store1 < 8.02 and attr store1 > 7.96 ) and bondedto
      (attr store1 < 125.338  and attr store1 > 124.538 ))
6 0.1 0.1 peak 1008 volume 92.62347 ppm1 7.990 ppm2 7.987
 
! ############### hot_gnoesyNhsqc_051903.1009 NOT folded
assi (attr store1 < 7.811 and attr store1 > 7.711 ) 
     ((attr store1 < 8.019 and attr store1 > 7.959 ) and bondedto
      (attr store1 < 125.4  and attr store1 > 124.6 ))
6 0.1 0.1 peak 1009 volume 6.82186 ppm1 7.989 ppm2 7.761
 
! ############### hot_gnoesyNhsqc_051903.1010 NOT folded
assi (attr store1 < 7.197 and attr store1 > 7.097 ) 
     ((attr store1 < 8.023 and attr store1 > 7.963 ) and bondedto
      (attr store1 < 125.364  and attr store1 > 124.564 ))
6 0.1 0.1 peak 1010 volume 14.00219 ppm1 7.993 ppm2 7.147
 
! ############### hot_gnoesyNhsqc_051903.1011 NOT folded
assi (attr store1 < 7.099 and attr store1 > 6.999 ) 
     ((attr store1 < 8.021 and attr store1 > 7.961 ) and bondedto
      (attr store1 < 125.368  and attr store1 > 124.568 ))
6 0.1 0.1 peak 1011 volume 10.17106 ppm1 7.991 ppm2 7.049
 
! ############### hot_gnoesyNhsqc_051903.1012 NOT folded
assi (attr store1 < 8.489 and attr store1 > 8.389 ) 
     ((attr store1 < 8.474 and attr store1 > 8.414 ) and bondedto
      (attr store1 < 125.069  and attr store1 > 124.269 ))
6 0.1 0.1 peak 1012 volume 7.93969 ppm1 8.444 ppm2 8.439
 
! ############### hot_gnoesyNhsqc_051903.1013 NOT folded
assi (attr store1 < 8.193 and attr store1 > 8.093 ) 
     ((attr store1 < 8.176 and attr store1 > 8.116 ) and bondedto
      (attr store1 < 125.165  and attr store1 > 124.365 ))
6 0.1 0.1 peak 1013 volume 20.85041 ppm1 8.146 ppm2 8.143
 
! ############### hot_gnoesyNhsqc_051903.1014 NOT folded
assi (attr store1 < 8.054 and attr store1 > 7.954 ) 
     ((attr store1 < 8.173 and attr store1 > 8.113 ) and bondedto
      (attr store1 < 125.034  and attr store1 > 124.234 ))
6 0.1 0.1 peak 1014 volume 5.37809 ppm1 8.143 ppm2 8.004
 
! ############### hot_gnoesyNhsqc_051903.1015 NOT folded
assi (attr store1 < 8.192 and attr store1 > 8.092 ) 
     ((attr store1 < 8.202 and attr store1 > 8.142 ) and bondedto
      (attr store1 < 125.008  and attr store1 > 124.208 ))
6 0.1 0.1 peak 1015 volume 40.79363 ppm1 8.172 ppm2 8.142
 
! ############### hot_gnoesyNhsqc_051903.1016 NOT folded
assi (attr store1 < 10.181 and attr store1 > 10.081 ) 
     ((attr store1 < 10.185 and attr store1 > 10.125 ) and bondedto
      (attr store1 < 124.781  and attr store1 > 123.981 ))
6 0.1 0.1 peak 1016 volume 7.56447 ppm1 10.155 ppm2 10.131
 
! ############### hot_gnoesyNhsqc_051903.1017 NOT folded
assi (attr store1 < 8.952 and attr store1 > 8.852 ) 
     ((attr store1 < 8.933 and attr store1 > 8.873 ) and bondedto
      (attr store1 < 124.6  and attr store1 > 123.8 ))
6 0.1 0.1 peak 1017 volume 201.29047 ppm1 8.903 ppm2 8.902
 
! ############### hot_gnoesyNhsqc_051903.1018 NOT folded
assi (attr store1 < 8.324 and attr store1 > 8.224 ) 
     ((attr store1 < 8.932 and attr store1 > 8.872 ) and bondedto
      (attr store1 < 124.585  and attr store1 > 123.785 ))
6 0.1 0.1 peak 1018 volume 6.01344 ppm1 8.902 ppm2 8.274
 
! ############### hot_gnoesyNhsqc_051903.1019 NOT folded
assi (attr store1 < 6.636 and attr store1 > 6.536 ) 
     ((attr store1 < 8.933 and attr store1 > 8.873 ) and bondedto
      (attr store1 < 124.603  and attr store1 > 123.803 ))
6 0.1 0.1 peak 1019 volume 6.05272 ppm1 8.903 ppm2 6.586
 
! ############### hot_gnoesyNhsqc_051903.1020 NOT folded
assi (attr store1 < 8.63 and attr store1 > 8.53 ) 
     ((attr store1 < 8.61 and attr store1 > 8.55 ) and bondedto
      (attr store1 < 124.737  and attr store1 > 123.937 ))
6 0.1 0.1 peak 1020 volume 109.40944 ppm1 8.580 ppm2 8.580
 
! ############### hot_gnoesyNhsqc_051903.1021 NOT folded
assi (attr store1 < 8.488 and attr store1 > 8.388 ) 
     ((attr store1 < 8.476 and attr store1 > 8.416 ) and bondedto
      (attr store1 < 124.699  and attr store1 > 123.899 ))
6 0.1 0.1 peak 1021 volume 9.94175 ppm1 8.446 ppm2 8.438
 
! ############### hot_gnoesyNhsqc_051903.1022 NOT folded
assi (attr store1 < 8.194 and attr store1 > 8.094 ) 
     ((attr store1 < 8.176 and attr store1 > 8.116 ) and bondedto
      (attr store1 < 124.731  and attr store1 > 123.931 ))
6 0.1 0.1 peak 1022 volume 58.75163 ppm1 8.146 ppm2 8.144
 
! ############### hot_gnoesyNhsqc_051903.1023 NOT folded
assi (attr store1 < 8.671 and attr store1 > 8.571 ) 
     ((attr store1 < 8.649 and attr store1 > 8.589 ) and bondedto
      (attr store1 < 124.205  and attr store1 > 123.405 ))
6 0.1 0.1 peak 1023 volume 141.37653 ppm1 8.619 ppm2 8.621
 
! ############### hot_gnoesyNhsqc_051903.1024 NOT folded
assi (attr store1 < 8.451 and attr store1 > 8.351 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 124.19  and attr store1 > 123.39 ))
6 0.1 0.1 peak 1024 volume 9.51302 ppm1 8.618 ppm2 8.401
 
! ############### hot_gnoesyNhsqc_051903.1025 NOT folded
assi (attr store1 < 7.969 and attr store1 > 7.869 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 124.206  and attr store1 > 123.406 ))
6 0.1 0.1 peak 1025 volume 36.98064 ppm1 8.618 ppm2 7.919
 
! ############### hot_gnoesyNhsqc_051903.1026 NOT folded
assi (attr store1 < 7.791 and attr store1 > 7.691 ) 
     ((attr store1 < 8.647 and attr store1 > 8.587 ) and bondedto
      (attr store1 < 124.161  and attr store1 > 123.361 ))
6 0.1 0.1 peak 1026 volume 8.27871 ppm1 8.617 ppm2 7.741
 
! ############### hot_gnoesyNhsqc_051903.1028 NOT folded
assi (attr store1 < 8.409 and attr store1 > 8.309 ) 
     ((attr store1 < 8.554 and attr store1 > 8.494 ) and bondedto
      (attr store1 < 124.177  and attr store1 > 123.377 ))
6 0.1 0.1 peak 1028 volume 7.76810 ppm1 8.524 ppm2 8.359
 
! ############### hot_gnoesyNhsqc_051903.1029 NOT folded
assi (attr store1 < 8.498 and attr store1 > 8.398 ) 
     ((attr store1 < 8.486 and attr store1 > 8.426 ) and bondedto
      (attr store1 < 124.196  and attr store1 > 123.396 ))
6 0.1 0.1 peak 1029 volume 17.94805 ppm1 8.456 ppm2 8.448
 
! ############### hot_gnoesyNhsqc_051903.1030 NOT folded
assi (attr store1 < 8.674 and attr store1 > 8.574 ) 
     ((attr store1 < 8.451 and attr store1 > 8.391 ) and bondedto
      (attr store1 < 124.148  and attr store1 > 123.348 ))
6 0.1 0.1 peak 1030 volume 5.36854 ppm1 8.421 ppm2 8.624
 
! ############### hot_gnoesyNhsqc_051903.1031 NOT folded
assi (attr store1 < 8.407 and attr store1 > 8.307 ) 
     ((attr store1 < 8.387 and attr store1 > 8.327 ) and bondedto
      (attr store1 < 124.157  and attr store1 > 123.357 ))
6 0.1 0.1 peak 1031 volume 819.07550 ppm1 8.357 ppm2 8.357
 
! ############### hot_gnoesyNhsqc_051903.1032 NOT folded
assi (attr store1 < 8.235 and attr store1 > 8.135 ) 
     ((attr store1 < 8.387 and attr store1 > 8.327 ) and bondedto
      (attr store1 < 124.16  and attr store1 > 123.36 ))
6 0.1 0.1 peak 1032 volume 31.71254 ppm1 8.357 ppm2 8.185
 
! ############### hot_gnoesyNhsqc_051903.1033 NOT folded
assi (attr store1 < 7.929 and attr store1 > 7.829 ) 
     ((attr store1 < 7.913 and attr store1 > 7.853 ) and bondedto
      (attr store1 < 124.242  and attr store1 > 123.442 ))
6 0.1 0.1 peak 1033 volume 6.10033 ppm1 7.883 ppm2 7.879
 
! ############### hot_gnoesyNhsqc_051903.1034 NOT folded
assi (attr store1 < 8.197 and attr store1 > 8.097 ) 
     ((attr store1 < 10.119 and attr store1 > 10.059 ) and bondedto
      (attr store1 < 123.938  and attr store1 > 123.138 ))
6 0.1 0.1 peak 1034 volume 6.10724 ppm1 10.089 ppm2 8.147
 
! ############### hot_gnoesyNhsqc_051903.1035 NOT folded
assi (attr store1 < 8.197 and attr store1 > 8.097 ) 
     ((attr store1 < 8.773 and attr store1 > 8.713 ) and bondedto
      (attr store1 < 123.92  and attr store1 > 123.12 ))
6 0.1 0.1 peak 1035 volume 6.44860 ppm1 8.743 ppm2 8.147
 
! ############### hot_gnoesyNhsqc_051903.1036 NOT folded
assi (attr store1 < 8.195 and attr store1 > 8.095 ) 
     ((attr store1 < 8.643 and attr store1 > 8.583 ) and bondedto
      (attr store1 < 124.081  and attr store1 > 123.281 ))
6 0.1 0.1 peak 1036 volume 7.64630 ppm1 8.613 ppm2 8.145
 
! ############### hot_gnoesyNhsqc_051903.1037 NOT folded
assi (attr store1 < 8.191 and attr store1 > 8.091 ) 
     ((attr store1 < 8.534 and attr store1 > 8.474 ) and bondedto
      (attr store1 < 123.946  and attr store1 > 123.146 ))
6 0.1 0.1 peak 1037 volume 7.61770 ppm1 8.504 ppm2 8.141
 
! ############### hot_gnoesyNhsqc_051903.1038 NOT folded
assi (attr store1 < 8.194 and attr store1 > 8.094 ) 
     ((attr store1 < 8.467 and attr store1 > 8.407 ) and bondedto
      (attr store1 < 123.936  and attr store1 > 123.136 ))
6 0.1 0.1 peak 1038 volume 9.46075 ppm1 8.437 ppm2 8.144
 
! ############### hot_gnoesyNhsqc_051903.1039 NOT folded
assi (attr store1 < 8.582 and attr store1 > 8.482 ) 
     ((attr store1 < 8.176 and attr store1 > 8.116 ) and bondedto
      (attr store1 < 123.999  and attr store1 > 123.199 ))
6 0.1 0.1 peak 1039 volume 5.44126 ppm1 8.146 ppm2 8.532
 
! ############### hot_gnoesyNhsqc_051903.1040 NOT folded
assi (attr store1 < 8.193 and attr store1 > 8.093 ) 
     ((attr store1 < 8.175 and attr store1 > 8.115 ) and bondedto
      (attr store1 < 123.932  and attr store1 > 123.132 ))
6 0.1 0.1 peak 1040 volume 4788.67383 ppm1 8.145 ppm2 8.143
 
! ############### hot_gnoesyNhsqc_051903.1041 NOT folded
assi (attr store1 < 8.052 and attr store1 > 7.952 ) 
     ((attr store1 < 8.175 and attr store1 > 8.115 ) and bondedto
      (attr store1 < 123.928  and attr store1 > 123.128 ))
6 0.1 0.1 peak 1041 volume 63.64979 ppm1 8.145 ppm2 8.002
 
! ############### hot_gnoesyNhsqc_051903.1042 NOT folded
assi (attr store1 < 7.98 and attr store1 > 7.88 ) 
     ((attr store1 < 8.175 and attr store1 > 8.115 ) and bondedto
      (attr store1 < 123.936  and attr store1 > 123.136 ))
6 0.1 0.1 peak 1042 volume 40.42448 ppm1 8.145 ppm2 7.930
 
! ############### hot_gnoesyNhsqc_051903.1043 NOT folded
assi (attr store1 < 10.182 and attr store1 > 10.082 ) 
     ((attr store1 < 10.184 and attr store1 > 10.124 ) and bondedto
      (attr store1 < 123.816  and attr store1 > 123.016 ))
6 0.1 0.1 peak 1043 volume 6.45197 ppm1 10.154 ppm2 10.132
 
! ############### hot_gnoesyNhsqc_051903.1044 NOT folded
assi (attr store1 < 8.495 and attr store1 > 8.395 ) 
     ((attr store1 < 8.479 and attr store1 > 8.419 ) and bondedto
      (attr store1 < 123.768  and attr store1 > 122.968 ))
6 0.1 0.1 peak 1044 volume 45.73137 ppm1 8.449 ppm2 8.445
 
! ############### hot_gnoesyNhsqc_051903.1045 NOT folded
assi (attr store1 < 8.354 and attr store1 > 8.254 ) 
     ((attr store1 < 8.333 and attr store1 > 8.273 ) and bondedto
      (attr store1 < 123.757  and attr store1 > 122.957 ))
6 0.1 0.1 peak 1045 volume 102.96227 ppm1 8.303 ppm2 8.304
 
! ############### hot_gnoesyNhsqc_051903.1046 NOT folded
assi (attr store1 < 8.742 and attr store1 > 8.642 ) 
     ((attr store1 < 7.559 and attr store1 > 7.499 ) and bondedto
      (attr store1 < 123.813  and attr store1 > 123.013 ))
6 0.1 0.1 peak 1046 volume 23.40409 ppm1 7.529 ppm2 8.692
 
! ############### hot_gnoesyNhsqc_051903.1047 NOT folded
assi (attr store1 < 8.32 and attr store1 > 8.22 ) 
     ((attr store1 < 7.558 and attr store1 > 7.498 ) and bondedto
      (attr store1 < 123.824  and attr store1 > 123.024 ))
6 0.1 0.1 peak 1047 volume 58.73573 ppm1 7.528 ppm2 8.270
 
! ############### hot_gnoesyNhsqc_051903.1048 NOT folded
assi (attr store1 < 7.575 and attr store1 > 7.475 ) 
     ((attr store1 < 7.559 and attr store1 > 7.499 ) and bondedto
      (attr store1 < 123.832  and attr store1 > 123.032 ))
6 0.1 0.1 peak 1048 volume 147.16640 ppm1 7.529 ppm2 7.525
 
! ############### hot_gnoesyNhsqc_051903.1049 NOT folded
assi (attr store1 < 6.636 and attr store1 > 6.536 ) 
     ((attr store1 < 7.559 and attr store1 > 7.499 ) and bondedto
      (attr store1 < 123.765  and attr store1 > 122.965 ))
6 0.1 0.1 peak 1049 volume 6.70205 ppm1 7.529 ppm2 6.586
 
! ############### hot_gnoesyNhsqc_051903.1050 NOT folded
assi (attr store1 < 8.956 and attr store1 > 8.856 ) 
     ((attr store1 < 7.556 and attr store1 > 7.496 ) and bondedto
      (attr store1 < 123.808  and attr store1 > 123.008 ))
6 0.1 0.1 peak 1050 volume 12.14892 ppm1 7.526 ppm2 8.906
 
! ############### hot_gnoesyNhsqc_051903.1051 NOT folded
assi (attr store1 < 8.041 and attr store1 > 7.941 ) 
     ((attr store1 < 7.556 and attr store1 > 7.496 ) and bondedto
      (attr store1 < 123.844  and attr store1 > 123.044 ))
6 0.1 0.1 peak 1051 volume 6.78618 ppm1 7.526 ppm2 7.991
 
! ############### hot_gnoesyNhsqc_051903.1052 NOT folded
assi (attr store1 < 8.102 and attr store1 > 8.002 ) 
     ((attr store1 < 8.083 and attr store1 > 8.023 ) and bondedto
      (attr store1 < 123.563  and attr store1 > 122.763 ))
6 0.1 0.1 peak 1052 volume 614.59369 ppm1 8.053 ppm2 8.052
 
! ############### hot_gnoesyNhsqc_051903.1053 NOT folded
assi (attr store1 < 7.987 and attr store1 > 7.887 ) 
     ((attr store1 < 8.086 and attr store1 > 8.026 ) and bondedto
      (attr store1 < 123.575  and attr store1 > 122.775 ))
6 0.1 0.1 peak 1053 volume 102.44241 ppm1 8.056 ppm2 7.937
 
! ############### hot_gnoesyNhsqc_051903.1054 NOT folded
assi (attr store1 < 7.532 and attr store1 > 7.432 ) 
     ((attr store1 < 8.086 and attr store1 > 8.026 ) and bondedto
      (attr store1 < 123.581  and attr store1 > 122.781 ))
6 0.1 0.1 peak 1054 volume 11.39692 ppm1 8.056 ppm2 7.482
 
! ############### hot_gnoesyNhsqc_051903.1055 NOT folded
assi (attr store1 < 7.838 and attr store1 > 7.738 ) 
     ((attr store1 < 7.917 and attr store1 > 7.857 ) and bondedto
      (attr store1 < 123.63  and attr store1 > 122.83 ))
6 0.1 0.1 peak 1055 volume 5.21096 ppm1 7.887 ppm2 7.788
 
! ############### hot_gnoesyNhsqc_051903.1056 NOT folded
assi (attr store1 < 7.798 and attr store1 > 7.698 ) 
     ((attr store1 < 7.783 and attr store1 > 7.723 ) and bondedto
      (attr store1 < 123.474  and attr store1 > 122.674 ))
6 0.1 0.1 peak 1056 volume 6.02336 ppm1 7.753 ppm2 7.748
 
! ############### hot_gnoesyNhsqc_051903.1057 NOT folded
assi (attr store1 < 8.755 and attr store1 > 8.655 ) 
     ((attr store1 < 9.187 and attr store1 > 9.127 ) and bondedto
      (attr store1 < 123.183  and attr store1 > 122.383 ))
6 0.1 0.1 peak 1057 volume 17.02758 ppm1 9.157 ppm2 8.705
 
! ############### hot_gnoesyNhsqc_051903.1058 NOT folded
assi (attr store1 < 7.653 and attr store1 > 7.553 ) 
     ((attr store1 < 9.188 and attr store1 > 9.128 ) and bondedto
      (attr store1 < 123.182  and attr store1 > 122.382 ))
6 0.1 0.1 peak 1058 volume 24.84524 ppm1 9.158 ppm2 7.603
 
! ############### hot_gnoesyNhsqc_051903.1059 NOT folded
assi (attr store1 < 7.441 and attr store1 > 7.341 ) 
     ((attr store1 < 9.188 and attr store1 > 9.128 ) and bondedto
      (attr store1 < 123.216  and attr store1 > 122.416 ))
6 0.1 0.1 peak 1059 volume 5.29968 ppm1 9.158 ppm2 7.391
 
! ############### hot_gnoesyNhsqc_051903.1060 NOT folded
assi (attr store1 < 8.721 and attr store1 > 8.621 ) 
     ((attr store1 < 8.7 and attr store1 > 8.64 ) and bondedto
      (attr store1 < 123.22  and attr store1 > 122.42 ))
6 0.1 0.1 peak 1060 volume 52.88714 ppm1 8.670 ppm2 8.671
 
! ############### hot_gnoesyNhsqc_051903.1061 NOT folded
assi (attr store1 < 8.261 and attr store1 > 8.161 ) 
     ((attr store1 < 8.24 and attr store1 > 8.18 ) and bondedto
      (attr store1 < 123.203  and attr store1 > 122.403 ))
6 0.1 0.1 peak 1061 volume 1647.75928 ppm1 8.210 ppm2 8.211
 
! ############### hot_gnoesyNhsqc_051903.1062 NOT folded
assi (attr store1 < 9.207 and attr store1 > 9.107 ) 
     ((attr store1 < 9.187 and attr store1 > 9.127 ) and bondedto
      (attr store1 < 123.169  and attr store1 > 122.369 ))
6 0.1 0.1 peak 1062 volume 69.71541 ppm1 9.157 ppm2 9.157
 
! ############### hot_gnoesyNhsqc_051903.1063 NOT folded
assi (attr store1 < 8.499 and attr store1 > 8.399 ) 
     ((attr store1 < 8.849 and attr store1 > 8.789 ) and bondedto
      (attr store1 < 122.96  and attr store1 > 122.16 ))
6 0.1 0.1 peak 1063 volume 6.08212 ppm1 8.819 ppm2 8.449
 
! ############### hot_gnoesyNhsqc_051903.1064 NOT folded
assi (attr store1 < 8.495 and attr store1 > 8.395 ) 
     ((attr store1 < 8.774 and attr store1 > 8.714 ) and bondedto
      (attr store1 < 123.03  and attr store1 > 122.23 ))
6 0.1 0.1 peak 1064 volume 8.91189 ppm1 8.744 ppm2 8.445
 
! ############### hot_gnoesyNhsqc_051903.1065 NOT folded
assi (attr store1 < 8.486 and attr store1 > 8.386 ) 
     ((attr store1 < 8.704 and attr store1 > 8.644 ) and bondedto
      (attr store1 < 123.142  and attr store1 > 122.342 ))
6 0.1 0.1 peak 1065 volume 21.75994 ppm1 8.674 ppm2 8.436
 
! ############### hot_gnoesyNhsqc_051903.1066 NOT folded
assi (attr store1 < 8.238 and attr store1 > 8.138 ) 
     ((attr store1 < 8.602 and attr store1 > 8.542 ) and bondedto
      (attr store1 < 123.093  and attr store1 > 122.293 ))
6 0.1 0.1 peak 1066 volume 5.08377 ppm1 8.572 ppm2 8.188
 
! ############### hot_gnoesyNhsqc_051903.1067 NOT folded
assi (attr store1 < 8.501 and attr store1 > 8.401 ) 
     ((attr store1 < 8.483 and attr store1 > 8.423 ) and bondedto
      (attr store1 < 123.0  and attr store1 > 122.2 ))
6 0.1 0.1 peak 1067 volume 2808.63428 ppm1 8.453 ppm2 8.451
 
! ############### hot_gnoesyNhsqc_051903.1068 NOT folded
assi (attr store1 < 7.906 and attr store1 > 7.806 ) 
     ((attr store1 < 8.483 and attr store1 > 8.423 ) and bondedto
      (attr store1 < 123.003  and attr store1 > 122.203 ))
6 0.1 0.1 peak 1068 volume 92.16734 ppm1 8.453 ppm2 7.856
 
! ############### hot_gnoesyNhsqc_051903.1069 NOT folded
assi (attr store1 < 8.28 and attr store1 > 8.18 ) 
     ((attr store1 < 8.479 and attr store1 > 8.419 ) and bondedto
      (attr store1 < 123.008  and attr store1 > 122.208 ))
6 0.1 0.1 peak 1069 volume 17.03863 ppm1 8.449 ppm2 8.230
 
! ############### hot_gnoesyNhsqc_051903.1070 NOT folded
assi (attr store1 < 8.245 and attr store1 > 8.145 ) 
     ((attr store1 < 8.422 and attr store1 > 8.362 ) and bondedto
      (attr store1 < 123.098  and attr store1 > 122.298 ))
6 0.1 0.1 peak 1070 volume 13.80798 ppm1 8.392 ppm2 8.195
 
! ############### hot_gnoesyNhsqc_051903.1071 NOT folded
assi (attr store1 < 8.409 and attr store1 > 8.309 ) 
     ((attr store1 < 8.236 and attr store1 > 8.176 ) and bondedto
      (attr store1 < 123.169  and attr store1 > 122.369 ))
6 0.1 0.1 peak 1071 volume 41.79596 ppm1 8.206 ppm2 8.359
 
! ############### hot_gnoesyNhsqc_051903.1072 NOT folded
assi (attr store1 < 8.668 and attr store1 > 8.568 ) 
     ((attr store1 < 8.195 and attr store1 > 8.135 ) and bondedto
      (attr store1 < 122.997  and attr store1 > 122.197 ))
6 0.1 0.1 peak 1072 volume 13.26166 ppm1 8.165 ppm2 8.618
 
! ############### hot_gnoesyNhsqc_051903.1073 NOT folded
assi (attr store1 < 8.215 and attr store1 > 8.115 ) 
     ((attr store1 < 8.193 and attr store1 > 8.133 ) and bondedto
      (attr store1 < 123.131  and attr store1 > 122.331 ))
6 0.1 0.1 peak 1073 volume 861.11859 ppm1 8.163 ppm2 8.165
 
! ############### hot_gnoesyNhsqc_051903.1074 NOT folded
assi (attr store1 < 8.058 and attr store1 > 7.958 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 122.962  and attr store1 > 122.162 ))
6 0.1 0.1 peak 1074 volume 57.75155 ppm1 8.162 ppm2 8.008
 
! ############### hot_gnoesyNhsqc_051903.1075 NOT folded
assi (attr store1 < 7.294 and attr store1 > 7.194 ) 
     ((attr store1 < 8.191 and attr store1 > 8.131 ) and bondedto
      (attr store1 < 123.008  and attr store1 > 122.208 ))
6 0.1 0.1 peak 1075 volume 5.85721 ppm1 8.161 ppm2 7.244
 
! ############### hot_gnoesyNhsqc_051903.1076 NOT folded
assi (attr store1 < 7.101 and attr store1 > 7.001 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 123.054  and attr store1 > 122.254 ))
6 0.1 0.1 peak 1076 volume 9.34850 ppm1 8.162 ppm2 7.051
 
! ############### hot_gnoesyNhsqc_051903.1077 NOT folded
assi (attr store1 < 6.952 and attr store1 > 6.852 ) 
     ((attr store1 < 8.192 and attr store1 > 8.132 ) and bondedto
      (attr store1 < 123.091  and attr store1 > 122.291 ))
6 0.1 0.1 peak 1077 volume 13.10101 ppm1 8.162 ppm2 6.902
 
! ############### hot_gnoesyNhsqc_051903.1078 NOT folded
assi (attr store1 < 7.61 and attr store1 > 7.51 ) 
     ((attr store1 < 7.513 and attr store1 > 7.453 ) and bondedto
      (attr store1 < 123.039  and attr store1 > 122.239 ))
6 0.1 0.1 peak 1078 volume 5.83273 ppm1 7.483 ppm2 7.560
 
! ############### hot_gnoesyNhsqc_051903.1079 NOT folded
assi (attr store1 < 8.102 and attr store1 > 8.002 ) 
     ((attr store1 < 8.693 and attr store1 > 8.633 ) and bondedto
      (attr store1 < 122.826  and attr store1 > 122.026 ))
6 0.1 0.1 peak 1079 volume 5.61925 ppm1 8.663 ppm2 8.052
 
! ############### hot_gnoesyNhsqc_051903.1080 NOT folded
assi (attr store1 < 9.379 and attr store1 > 9.279 ) 
     ((attr store1 < 8.479 and attr store1 > 8.419 ) and bondedto
      (attr store1 < 122.909  and attr store1 > 122.109 ))
6 0.1 0.1 peak 1080 volume 8.17788 ppm1 8.449 ppm2 9.329
 
! ############### hot_gnoesyNhsqc_051903.1081 NOT folded
assi (attr store1 < 8.105 and attr store1 > 8.005 ) 
     ((attr store1 < 8.476 and attr store1 > 8.416 ) and bondedto
      (attr store1 < 122.913  and attr store1 > 122.113 ))
6 0.1 0.1 peak 1081 volume 10.93053 ppm1 8.446 ppm2 8.055
 
! ############### hot_gnoesyNhsqc_051903.1082 NOT folded
assi (attr store1 < 7.578 and attr store1 > 7.478 ) 
     ((attr store1 < 8.478 and attr store1 > 8.418 ) and bondedto
      (attr store1 < 122.884  and attr store1 > 122.084 ))
6 0.1 0.1 peak 1082 volume 42.90335 ppm1 8.448 ppm2 7.528
 
! ############### hot_gnoesyNhsqc_051903.1083 NOT folded
assi (attr store1 < 7.229 and attr store1 > 7.129 ) 
     ((attr store1 < 8.479 and attr store1 > 8.419 ) and bondedto
      (attr store1 < 122.9  and attr store1 > 122.1 ))
6 0.1 0.1 peak 1083 volume 24.68375 ppm1 8.449 ppm2 7.179
 
! ############### hot_gnoesyNhsqc_051903.1084 NOT folded
assi (attr store1 < 7.042 and attr store1 > 6.942 ) 
     ((attr store1 < 8.479 and attr store1 > 8.419 ) and bondedto
      (attr store1 < 122.892  and attr store1 > 122.092 ))
6 0.1 0.1 peak 1084 volume 45.03310 ppm1 8.449 ppm2 6.992
 
! ############### hot_gnoesyNhsqc_051903.1085 NOT folded
assi (attr store1 < 8.065 and attr store1 > 7.965 ) 
     ((attr store1 < 8.411 and attr store1 > 8.351 ) and bondedto
      (attr store1 < 122.826  and attr store1 > 122.026 ))
6 0.1 0.1 peak 1085 volume 14.92249 ppm1 8.381 ppm2 8.015
 
! ############### hot_gnoesyNhsqc_051903.1086 NOT folded
assi (attr store1 < 7.918 and attr store1 > 7.818 ) 
     ((attr store1 < 8.414 and attr store1 > 8.354 ) and bondedto
      (attr store1 < 122.838  and attr store1 > 122.038 ))
6 0.1 0.1 peak 1086 volume 34.92196 ppm1 8.384 ppm2 7.868
 
! ############### hot_gnoesyNhsqc_051903.1087 NOT folded
assi (attr store1 < 8.481 and attr store1 > 8.381 ) 
     ((attr store1 < 8.088 and attr store1 > 8.028 ) and bondedto
      (attr store1 < 122.709  and attr store1 > 121.909 ))
6 0.1 0.1 peak 1087 volume 10.92765 ppm1 8.058 ppm2 8.431
 
! ############### hot_gnoesyNhsqc_051903.1088 NOT folded
assi (attr store1 < 7.918 and attr store1 > 7.818 ) 
     ((attr store1 < 7.824 and attr store1 > 7.764 ) and bondedto
      (attr store1 < 122.736  and attr store1 > 121.936 ))
6 0.1 0.1 peak 1088 volume 8.13577 ppm1 7.794 ppm2 7.868
 
! ############### hot_gnoesyNhsqc_051903.1089 NOT folded
assi (attr store1 < 8.106 and attr store1 > 8.006 ) 
     ((attr store1 < 7.723 and attr store1 > 7.663 ) and bondedto
      (attr store1 < 122.755  and attr store1 > 121.955 ))
6 0.1 0.1 peak 1089 volume 5.07229 ppm1 7.693 ppm2 8.056
 
! ############### hot_gnoesyNhsqc_051903.1090 NOT folded
assi (attr store1 < 8.666 and attr store1 > 8.566 ) 
     ((attr store1 < 8.645 and attr store1 > 8.585 ) and bondedto
      (attr store1 < 122.674  and attr store1 > 121.874 ))
6 0.1 0.1 peak 1090 volume 169.76015 ppm1 8.615 ppm2 8.616
 
! ############### hot_gnoesyNhsqc_051903.1091 NOT folded
assi (attr store1 < 7.905 and attr store1 > 7.805 ) 
     ((attr store1 < 8.644 and attr store1 > 8.584 ) and bondedto
      (attr store1 < 122.655  and attr store1 > 121.855 ))
6 0.1 0.1 peak 1091 volume 56.05588 ppm1 8.614 ppm2 7.855
 
! ############### hot_gnoesyNhsqc_051903.1092 NOT folded
assi (attr store1 < 8.096 and attr store1 > 7.996 ) 
     ((attr store1 < 8.302 and attr store1 > 8.242 ) and bondedto
      (attr store1 < 122.543  and attr store1 > 121.743 ))
6 0.1 0.1 peak 1092 volume 15.71253 ppm1 8.272 ppm2 8.046
 
! ############### hot_gnoesyNhsqc_051903.1093 NOT folded
assi (attr store1 < 8.106 and attr store1 > 8.006 ) 
     ((attr store1 < 8.087 and attr store1 > 8.027 ) and bondedto
      (attr store1 < 122.698  and attr store1 > 121.898 ))
6 0.1 0.1 peak 1093 volume 2643.72314 ppm1 8.057 ppm2 8.056
 
! ############### hot_gnoesyNhsqc_051903.1094 NOT folded
assi (attr store1 < 7.893 and attr store1 > 7.793 ) 
     ((attr store1 < 8.087 and attr store1 > 8.027 ) and bondedto
      (attr store1 < 122.632  and attr store1 > 121.832 ))
6 0.1 0.1 peak 1094 volume 73.82649 ppm1 8.057 ppm2 7.843
 
! ############### hot_gnoesyNhsqc_051903.1095 NOT folded
assi (attr store1 < 7.709 and attr store1 > 7.609 ) 
     ((attr store1 < 8.084 and attr store1 > 8.024 ) and bondedto
      (attr store1 < 122.695  and attr store1 > 121.895 ))
6 0.1 0.1 peak 1095 volume 5.95924 ppm1 8.054 ppm2 7.659
 
! ############### hot_gnoesyNhsqc_051903.1096 NOT folded
assi (attr store1 < 7.169 and attr store1 > 7.069 ) 
     ((attr store1 < 8.085 and attr store1 > 8.025 ) and bondedto
      (attr store1 < 122.588  and attr store1 > 121.788 ))
6 0.1 0.1 peak 1096 volume 8.38645 ppm1 8.055 ppm2 7.119
 
! ############### hot_gnoesyNhsqc_051903.1097 NOT folded
assi (attr store1 < 7.036 and attr store1 > 6.936 ) 
     ((attr store1 < 8.089 and attr store1 > 8.029 ) and bondedto
      (attr store1 < 122.62  and attr store1 > 121.82 ))
6 0.1 0.1 peak 1097 volume 5.15218 ppm1 8.059 ppm2 6.986
 
! ############### hot_gnoesyNhsqc_051903.1098 NOT folded
assi (attr store1 < 8.1 and attr store1 > 8.0 ) 
     ((attr store1 < 7.786 and attr store1 > 7.726 ) and bondedto
      (attr store1 < 122.633  and attr store1 > 121.833 ))
6 0.1 0.1 peak 1098 volume 5.26840 ppm1 7.756 ppm2 8.050
 
! ############### hot_gnoesyNhsqc_051903.1099 NOT folded
assi (attr store1 < 8.725 and attr store1 > 8.625 ) 
     ((attr store1 < 8.713 and attr store1 > 8.653 ) and bondedto
      (attr store1 < 122.416  and attr store1 > 121.616 ))
6 0.1 0.1 peak 1099 volume 40.95237 ppm1 8.683 ppm2 8.675
 
! ############### hot_gnoesyNhsqc_051903.1100 NOT folded
assi (attr store1 < 8.67 and attr store1 > 8.57 ) 
     ((attr store1 < 8.41 and attr store1 > 8.35 ) and bondedto
      (attr store1 < 122.337  and attr store1 > 121.537 ))
6 0.1 0.1 peak 1100 volume 8.35614 ppm1 8.380 ppm2 8.620
 
! ############### hot_gnoesyNhsqc_051903.1101 NOT folded
assi (attr store1 < 8.793 and attr store1 > 8.693 ) 
     ((attr store1 < 8.308 and attr store1 > 8.248 ) and bondedto
      (attr store1 < 122.392  and attr store1 > 121.592 ))
6 0.1 0.1 peak 1101 volume 15.21877 ppm1 8.278 ppm2 8.743
 
! ############### hot_gnoesyNhsqc_051903.1102 NOT folded
assi (attr store1 < 8.327 and attr store1 > 8.227 ) 
     ((attr store1 < 8.309 and attr store1 > 8.249 ) and bondedto
      (attr store1 < 122.366  and attr store1 > 121.566 ))
6 0.1 0.1 peak 1102 volume 201.54701 ppm1 8.279 ppm2 8.277
 
! ############### hot_gnoesyNhsqc_051903.1103 NOT folded
assi (attr store1 < 7.8 and attr store1 > 7.7 ) 
     ((attr store1 < 8.308 and attr store1 > 8.248 ) and bondedto
      (attr store1 < 122.376  and attr store1 > 121.576 ))
6 0.1 0.1 peak 1103 volume 37.37378 ppm1 8.278 ppm2 7.750
 
! ############### hot_gnoesyNhsqc_051903.1104 NOT folded
assi (attr store1 < 7.424 and attr store1 > 7.324 ) 
     ((attr store1 < 8.303 and attr store1 > 8.243 ) and bondedto
      (attr store1 < 122.383  and attr store1 > 121.583 ))
6 0.1 0.1 peak 1104 volume 5.30736 ppm1 8.273 ppm2 7.374
 
! ############### hot_gnoesyNhsqc_051903.1105 NOT folded
assi (attr store1 < 7.192 and attr store1 > 7.092 ) 
     ((attr store1 < 8.306 and attr store1 > 8.246 ) and bondedto
      (attr store1 < 122.439  and attr store1 > 121.639 ))
6 0.1 0.1 peak 1105 volume 5.39351 ppm1 8.276 ppm2 7.142
 
! ############### hot_gnoesyNhsqc_051903.1106 NOT folded
assi (attr store1 < 8.481 and attr store1 > 8.381 ) 
     ((attr store1 < 8.46 and attr store1 > 8.4 ) and bondedto
      (attr store1 < 122.117  and attr store1 > 121.317 ))
6 0.1 0.1 peak 1106 volume 702.72919 ppm1 8.430 ppm2 8.431
 
! ############### hot_gnoesyNhsqc_051903.1107 NOT folded
assi (attr store1 < 8.433 and attr store1 > 8.333 ) 
     ((attr store1 < 8.412 and attr store1 > 8.352 ) and bondedto
      (attr store1 < 122.194  and attr store1 > 121.394 ))
6 0.1 0.1 peak 1107 volume 1514.90942 ppm1 8.382 ppm2 8.383
 
! ############### hot_gnoesyNhsqc_051903.1108 NOT folded
assi (attr store1 < 8.282 and attr store1 > 8.182 ) 
     ((attr store1 < 8.412 and attr store1 > 8.352 ) and bondedto
      (attr store1 < 122.198  and attr store1 > 121.398 ))
6 0.1 0.1 peak 1108 volume 45.85643 ppm1 8.382 ppm2 8.232
 
! ############### hot_gnoesyNhsqc_051903.1109 NOT folded
assi (attr store1 < 8.178 and attr store1 > 8.078 ) 
     ((attr store1 < 8.157 and attr store1 > 8.097 ) and bondedto
      (attr store1 < 122.205  and attr store1 > 121.405 ))
6 0.1 0.1 peak 1109 volume 126.10330 ppm1 8.127 ppm2 8.128
 
! ############### hot_gnoesyNhsqc_051903.1110 NOT folded
assi (attr store1 < 8.231 and attr store1 > 8.131 ) 
     ((attr store1 < 7.929 and attr store1 > 7.869 ) and bondedto
      (attr store1 < 122.134  and attr store1 > 121.334 ))
6 0.1 0.1 peak 1110 volume 85.09921 ppm1 7.899 ppm2 8.181
 
! ############### hot_gnoesyNhsqc_051903.1111 NOT folded
assi (attr store1 < 7.951 and attr store1 > 7.851 ) 
     ((attr store1 < 7.928 and attr store1 > 7.868 ) and bondedto
      (attr store1 < 122.134  and attr store1 > 121.334 ))
6 0.1 0.1 peak 1111 volume 1819.17554 ppm1 7.898 ppm2 7.901
 
! ############### hot_gnoesyNhsqc_051903.1112 NOT folded
assi (attr store1 < 7.691 and attr store1 > 7.591 ) 
     ((attr store1 < 7.929 and attr store1 > 7.869 ) and bondedto
      (attr store1 < 122.111  and attr store1 > 121.311 ))
6 0.1 0.1 peak 1112 volume 20.57013 ppm1 7.899 ppm2 7.641
 
! ############### hot_gnoesyNhsqc_051903.1113 NOT folded
assi (attr store1 < 7.494 and attr store1 > 7.394 ) 
     ((attr store1 < 7.929 and attr store1 > 7.869 ) and bondedto
      (attr store1 < 122.122  and attr store1 > 121.322 ))
6 0.1 0.1 peak 1113 volume 19.72110 ppm1 7.899 ppm2 7.444
 
! ############### hot_gnoesyNhsqc_051903.1114 NOT folded
assi (attr store1 < 7.334 and attr store1 > 7.234 ) 
     ((attr store1 < 7.929 and attr store1 > 7.869 ) and bondedto
      (attr store1 < 122.136  and attr store1 > 121.336 ))
6 0.1 0.1 peak 1114 volume 30.28506 ppm1 7.899 ppm2 7.284
 
! ############### hot_gnoesyNhsqc_051903.1115 NOT folded
assi (attr store1 < 7.174 and attr store1 > 7.074 ) 
     ((attr store1 < 7.929 and attr store1 > 7.869 ) and bondedto
      (attr store1 < 122.124  and attr store1 > 121.324 ))
6 0.1 0.1 peak 1115 volume 17.39435 ppm1 7.899 ppm2 7.124
 
! ############### hot_gnoesyNhsqc_051903.1116 NOT folded
assi (attr store1 < 8.643 and attr store1 > 8.543 ) 
     ((attr store1 < 7.768 and attr store1 > 7.708 ) and bondedto
      (attr store1 < 122.132  and attr store1 > 121.332 ))
6 0.1 0.1 peak 1116 volume 15.67700 ppm1 7.738 ppm2 8.593
 
! ############### hot_gnoesyNhsqc_051903.1117 NOT folded
assi (attr store1 < 7.789 and attr store1 > 7.689 ) 
     ((attr store1 < 7.768 and attr store1 > 7.708 ) and bondedto
      (attr store1 < 122.13  and attr store1 > 121.33 ))
6 0.1 0.1 peak 1117 volume 357.44934 ppm1 7.738 ppm2 7.739
 
! ############### hot_gnoesyNhsqc_051903.1118 NOT folded
assi (attr store1 < 7.796 and attr store1 > 7.696 ) 
     ((attr store1 < 7.557 and attr store1 > 7.497 ) and bondedto
      (attr store1 < 122.069  and attr store1 > 121.269 ))
6 0.1 0.1 peak 1118 volume 9.97038 ppm1 7.527 ppm2 7.746
 
! ############### hot_gnoesyNhsqc_051903.1119 NOT folded
assi (attr store1 < 8.803 and attr store1 > 8.703 ) 
     ((attr store1 < 8.782 and attr store1 > 8.722 ) and bondedto
      (attr store1 < 121.949  and attr store1 > 121.149 ))
6 0.1 0.1 peak 1119 volume 90.03988 ppm1 8.752 ppm2 8.753
 
! ############### hot_gnoesyNhsqc_051903.1120 NOT folded
assi (attr store1 < 8.096 and attr store1 > 7.996 ) 
     ((attr store1 < 8.781 and attr store1 > 8.721 ) and bondedto
      (attr store1 < 121.935  and attr store1 > 121.135 ))
6 0.1 0.1 peak 1120 volume 20.97169 ppm1 8.751 ppm2 8.046
 
! ############### hot_gnoesyNhsqc_051903.1121 NOT folded
assi (attr store1 < 7.431 and attr store1 > 7.331 ) 
     ((attr store1 < 8.783 and attr store1 > 8.723 ) and bondedto
      (attr store1 < 121.919  and attr store1 > 121.119 ))
6 0.1 0.1 peak 1121 volume 7.85398 ppm1 8.753 ppm2 7.381
 
! ############### hot_gnoesyNhsqc_051903.1122 NOT folded
assi (attr store1 < 8.465 and attr store1 > 8.365 ) 
     ((attr store1 < 8.778 and attr store1 > 8.718 ) and bondedto
      (attr store1 < 121.964  and attr store1 > 121.164 ))
6 0.1 0.1 peak 1122 volume 20.98836 ppm1 8.748 ppm2 8.415
 
! ############### hot_gnoesyNhsqc_051903.1123 NOT folded
assi (attr store1 < 7.967 and attr store1 > 7.867 ) 
     ((attr store1 < 7.506 and attr store1 > 7.446 ) and bondedto
      (attr store1 < 121.922  and attr store1 > 121.122 ))
6 0.1 0.1 peak 1123 volume 50.55833 ppm1 7.476 ppm2 7.917
 
! ############### hot_gnoesyNhsqc_051903.1124 NOT folded
assi (attr store1 < 7.527 and attr store1 > 7.427 ) 
     ((attr store1 < 7.505 and attr store1 > 7.445 ) and bondedto
      (attr store1 < 121.912  and attr store1 > 121.112 ))
6 0.1 0.1 peak 1124 volume 249.93690 ppm1 7.475 ppm2 7.477
 
! ############### hot_gnoesyNhsqc_051903.1125 NOT folded
assi (attr store1 < 7.803 and attr store1 > 7.703 ) 
     ((attr store1 < 7.504 and attr store1 > 7.444 ) and bondedto
      (attr store1 < 121.915  and attr store1 > 121.115 ))
6 0.1 0.1 peak 1125 volume 38.35567 ppm1 7.474 ppm2 7.753
 
! ############### hot_gnoesyNhsqc_051903.1126 NOT folded
assi (attr store1 < 8.196 and attr store1 > 8.096 ) 
     ((attr store1 < 8.307 and attr store1 > 8.247 ) and bondedto
      (attr store1 < 121.563  and attr store1 > 120.763 ))
6 0.1 0.1 peak 1126 volume 78.40760 ppm1 8.277 ppm2 8.146
 
! ############### hot_gnoesyNhsqc_051903.1127 NOT folded
assi (attr store1 < 8.016 and attr store1 > 7.916 ) 
     ((attr store1 < 8.305 and attr store1 > 8.245 ) and bondedto
      (attr store1 < 121.568  and attr store1 > 120.768 ))
6 0.1 0.1 peak 1127 volume 7.28426 ppm1 8.275 ppm2 7.966
 
! ############### hot_gnoesyNhsqc_051903.1128 NOT folded
assi (attr store1 < 8.326 and attr store1 > 8.226 ) 
     ((attr store1 < 8.121 and attr store1 > 8.061 ) and bondedto
      (attr store1 < 121.6  and attr store1 > 120.8 ))
6 0.1 0.1 peak 1128 volume 8.19410 ppm1 8.091 ppm2 8.276
 
! ############### hot_gnoesyNhsqc_051903.1129 NOT folded
assi (attr store1 < 8.73 and attr store1 > 8.63 ) 
     ((attr store1 < 8.718 and attr store1 > 8.658 ) and bondedto
      (attr store1 < 121.445  and attr store1 > 120.645 ))
6 0.1 0.1 peak 1129 volume 8.56295 ppm1 8.688 ppm2 8.680
 
! ############### hot_gnoesyNhsqc_051903.1130 NOT folded
assi (attr store1 < 8.333 and attr store1 > 8.233 ) 
     ((attr store1 < 8.669 and attr store1 > 8.609 ) and bondedto
      (attr store1 < 121.527  and attr store1 > 120.727 ))
6 0.1 0.1 peak 1130 volume 5.82083 ppm1 8.639 ppm2 8.283
 
! ############### hot_gnoesyNhsqc_051903.1131 NOT folded
assi (attr store1 < 8.453 and attr store1 > 8.353 ) 
     ((attr store1 < 8.423 and attr store1 > 8.363 ) and bondedto
      (attr store1 < 121.423  and attr store1 > 120.623 ))
6 0.1 0.1 peak 1131 volume 19.68497 ppm1 8.393 ppm2 8.403
 
! ############### hot_gnoesyNhsqc_051903.1132 NOT folded
assi (attr store1 < 8.325 and attr store1 > 8.225 ) 
     ((attr store1 < 8.306 and attr store1 > 8.246 ) and bondedto
      (attr store1 < 121.549  and attr store1 > 120.749 ))
6 0.1 0.1 peak 1132 volume 3743.34204 ppm1 8.276 ppm2 8.275
 
! ############### hot_gnoesyNhsqc_051903.1133 NOT folded
assi (attr store1 < 8.155 and attr store1 > 8.055 ) 
     ((attr store1 < 8.157 and attr store1 > 8.097 ) and bondedto
      (attr store1 < 121.16  and attr store1 > 120.36 ))
6 0.1 0.1 peak 1133 volume 28.71595 ppm1 8.127 ppm2 8.105
 
! ############### hot_gnoesyNhsqc_051903.1134 NOT folded
assi (attr store1 < 7.843 and attr store1 > 7.743 ) 
     ((attr store1 < 8.214 and attr store1 > 8.154 ) and bondedto
      (attr store1 < 120.889  and attr store1 > 120.089 ))
6 0.1 0.1 peak 1134 volume 5.44774 ppm1 8.184 ppm2 7.793
 
! ############### hot_gnoesyNhsqc_051903.1135 NOT folded
assi (attr store1 < 8.79 and attr store1 > 8.69 ) 
     ((attr store1 < 8.062 and attr store1 > 8.002 ) and bondedto
      (attr store1 < 121.017  and attr store1 > 120.217 ))
6 0.1 0.1 peak 1135 volume 55.13535 ppm1 8.032 ppm2 8.740
 
! ############### hot_gnoesyNhsqc_051903.1136 NOT folded
assi (attr store1 < 8.482 and attr store1 > 8.382 ) 
     ((attr store1 < 8.059 and attr store1 > 7.999 ) and bondedto
      (attr store1 < 120.988  and attr store1 > 120.188 ))
6 0.1 0.1 peak 1136 volume 10.94885 ppm1 8.029 ppm2 8.432
 
! ############### hot_gnoesyNhsqc_051903.1137 NOT folded
assi (attr store1 < 8.08 and attr store1 > 7.98 ) 
     ((attr store1 < 8.061 and attr store1 > 8.001 ) and bondedto
      (attr store1 < 121.036  and attr store1 > 120.236 ))
6 0.1 0.1 peak 1137 volume 267.58063 ppm1 8.031 ppm2 8.030
 
! ############### hot_gnoesyNhsqc_051903.1138 NOT folded
assi (attr store1 < 7.865 and attr store1 > 7.765 ) 
     ((attr store1 < 8.062 and attr store1 > 8.002 ) and bondedto
      (attr store1 < 121.004  and attr store1 > 120.204 ))
6 0.1 0.1 peak 1138 volume 64.07422 ppm1 8.032 ppm2 7.815
 
! ############### hot_gnoesyNhsqc_051903.1139 NOT folded
assi (attr store1 < 8.427 and attr store1 > 8.327 ) 
     ((attr store1 < 7.897 and attr store1 > 7.837 ) and bondedto
      (attr store1 < 120.883  and attr store1 > 120.083 ))
6 0.1 0.1 peak 1139 volume 32.62814 ppm1 7.867 ppm2 8.377
 
! ############### hot_gnoesyNhsqc_051903.1140 NOT folded
assi (attr store1 < 7.244 and attr store1 > 7.144 ) 
     ((attr store1 < 7.893 and attr store1 > 7.833 ) and bondedto
      (attr store1 < 120.906  and attr store1 > 120.106 ))
6 0.1 0.1 peak 1140 volume 5.58643 ppm1 7.863 ppm2 7.194
 
! ############### hot_gnoesyNhsqc_051903.1141 NOT folded
assi (attr store1 < 6.945 and attr store1 > 6.845 ) 
     ((attr store1 < 7.892 and attr store1 > 7.832 ) and bondedto
      (attr store1 < 120.902  and attr store1 > 120.102 ))
6 0.1 0.1 peak 1141 volume 7.89070 ppm1 7.862 ppm2 6.895
 
! ############### hot_gnoesyNhsqc_051903.1142 NOT folded
assi (attr store1 < 6.833 and attr store1 > 6.733 ) 
     ((attr store1 < 7.894 and attr store1 > 7.834 ) and bondedto
      (attr store1 < 120.899  and attr store1 > 120.099 ))
6 0.1 0.1 peak 1142 volume 7.92250 ppm1 7.864 ppm2 6.783
 
! ############### hot_gnoesyNhsqc_051903.1143 NOT folded
assi (attr store1 < 8.482 and attr store1 > 8.382 ) 
     ((attr store1 < 8.47 and attr store1 > 8.41 ) and bondedto
      (attr store1 < 120.695  and attr store1 > 119.895 ))
6 0.1 0.1 peak 1143 volume 18.79380 ppm1 8.440 ppm2 8.432
 
! ############### hot_gnoesyNhsqc_051903.1144 NOT folded
assi (attr store1 < 8.336 and attr store1 > 8.236 ) 
     ((attr store1 < 8.307 and attr store1 > 8.247 ) and bondedto
      (attr store1 < 120.712  and attr store1 > 119.912 ))
6 0.1 0.1 peak 1144 volume 103.09277 ppm1 8.277 ppm2 8.286
 
! ############### hot_gnoesyNhsqc_051903.1145 NOT folded
assi (attr store1 < 7.836 and attr store1 > 7.736 ) 
     ((attr store1 < 8.165 and attr store1 > 8.105 ) and bondedto
      (attr store1 < 120.752  and attr store1 > 119.952 ))
6 0.1 0.1 peak 1145 volume 8.56704 ppm1 8.135 ppm2 7.786
 
! ############### hot_gnoesyNhsqc_051903.1146 NOT folded
assi (attr store1 < 8.022 and attr store1 > 7.922 ) 
     ((attr store1 < 7.996 and attr store1 > 7.936 ) and bondedto
      (attr store1 < 120.779  and attr store1 > 119.979 ))
6 0.1 0.1 peak 1146 volume 28.55314 ppm1 7.966 ppm2 7.972
 
! ############### hot_gnoesyNhsqc_051903.1147 NOT folded
assi (attr store1 < 8.579 and attr store1 > 8.479 ) 
     ((attr store1 < 7.888 and attr store1 > 7.828 ) and bondedto
      (attr store1 < 120.853  and attr store1 > 120.053 ))
6 0.1 0.1 peak 1147 volume 28.91342 ppm1 7.858 ppm2 8.529
 
! ############### hot_gnoesyNhsqc_051903.1148 NOT folded
assi (attr store1 < 7.911 and attr store1 > 7.811 ) 
     ((attr store1 < 7.894 and attr store1 > 7.834 ) and bondedto
      (attr store1 < 120.849  and attr store1 > 120.049 ))
6 0.1 0.1 peak 1148 volume 241.55077 ppm1 7.864 ppm2 7.861
 
! ############### hot_gnoesyNhsqc_051903.1149 NOT folded
assi (attr store1 < 8.194 and attr store1 > 8.094 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.795  and attr store1 > 119.995 ))
6 0.1 0.1 peak 1149 volume 125.55359 ppm1 7.775 ppm2 8.144
 
! ############### hot_gnoesyNhsqc_051903.1150 NOT folded
assi (attr store1 < 7.827 and attr store1 > 7.727 ) 
     ((attr store1 < 7.805 and attr store1 > 7.745 ) and bondedto
      (attr store1 < 120.791  and attr store1 > 119.991 ))
6 0.1 0.1 peak 1150 volume 1600.85645 ppm1 7.775 ppm2 7.777
 
! ############### hot_gnoesyNhsqc_051903.1151 NOT folded
assi (attr store1 < 7.676 and attr store1 > 7.576 ) 
     ((attr store1 < 7.807 and attr store1 > 7.747 ) and bondedto
      (attr store1 < 120.816  and attr store1 > 120.016 ))
6 0.1 0.1 peak 1151 volume 21.89105 ppm1 7.777 ppm2 7.626
 
! ############### hot_gnoesyNhsqc_051903.1152 NOT folded
assi (attr store1 < 9.381 and attr store1 > 9.281 ) 
     ((attr store1 < 7.562 and attr store1 > 7.502 ) and bondedto
      (attr store1 < 120.749  and attr store1 > 119.949 ))
6 0.1 0.1 peak 1152 volume 12.45279 ppm1 7.532 ppm2 9.331
 
! ############### hot_gnoesyNhsqc_051903.1153 NOT folded
assi (attr store1 < 8.499 and attr store1 > 8.399 ) 
     ((attr store1 < 7.562 and attr store1 > 7.502 ) and bondedto
      (attr store1 < 120.755  and attr store1 > 119.955 ))
6 0.1 0.1 peak 1153 volume 38.30226 ppm1 7.532 ppm2 8.449
 
! ############### hot_gnoesyNhsqc_051903.1154 NOT folded
assi (attr store1 < 7.58 and attr store1 > 7.48 ) 
     ((attr store1 < 7.563 and attr store1 > 7.503 ) and bondedto
      (attr store1 < 120.775  and attr store1 > 119.975 ))
6 0.1 0.1 peak 1154 volume 119.96764 ppm1 7.533 ppm2 7.530
 
! ############### hot_gnoesyNhsqc_051903.1155 NOT folded
assi (attr store1 < 7.239 and attr store1 > 7.139 ) 
     ((attr store1 < 7.561 and attr store1 > 7.501 ) and bondedto
      (attr store1 < 120.759  and attr store1 > 119.959 ))
6 0.1 0.1 peak 1155 volume 45.77920 ppm1 7.531 ppm2 7.189
 
! ############### hot_gnoesyNhsqc_051903.1156 NOT folded
assi (attr store1 < 7.053 and attr store1 > 6.953 ) 
     ((attr store1 < 7.563 and attr store1 > 7.503 ) and bondedto
      (attr store1 < 120.739  and attr store1 > 119.939 ))
6 0.1 0.1 peak 1156 volume 12.03639 ppm1 7.533 ppm2 7.003
 
! ############### hot_gnoesyNhsqc_051903.1157 NOT folded
assi (attr store1 < 8.376 and attr store1 > 8.276 ) 
     ((attr store1 < 8.657 and attr store1 > 8.597 ) and bondedto
      (attr store1 < 120.52  and attr store1 > 119.72 ))
6 0.1 0.1 peak 1157 volume 6.75049 ppm1 8.627 ppm2 8.326
 
! ############### hot_gnoesyNhsqc_051903.1158 NOT folded
assi (attr store1 < 8.028 and attr store1 > 7.928 ) 
     ((attr store1 < 8.653 and attr store1 > 8.593 ) and bondedto
      (attr store1 < 120.537  and attr store1 > 119.737 ))
6 0.1 0.1 peak 1158 volume 25.47986 ppm1 8.623 ppm2 7.978
 
! ############### hot_gnoesyNhsqc_051903.1160 NOT folded
assi (attr store1 < 8.671 and attr store1 > 8.571 ) 
     ((attr store1 < 8.65 and attr store1 > 8.59 ) and bondedto
      (attr store1 < 120.542  and attr store1 > 119.742 ))
6 0.1 0.1 peak 1160 volume 106.82045 ppm1 8.620 ppm2 8.621
 
! ############### hot_gnoesyNhsqc_051903.1161 NOT folded
assi (attr store1 < 8.201 and attr store1 > 8.101 ) 
     ((attr store1 < 8.646 and attr store1 > 8.586 ) and bondedto
      (attr store1 < 120.52  and attr store1 > 119.72 ))
6 0.1 0.1 peak 1161 volume 8.65710 ppm1 8.616 ppm2 8.151
 
! ############### hot_gnoesyNhsqc_051903.1162 NOT folded
assi (attr store1 < 7.158 and attr store1 > 7.058 ) 
     ((attr store1 < 8.648 and attr store1 > 8.588 ) and bondedto
      (attr store1 < 120.549  and attr store1 > 119.749 ))
6 0.1 0.1 peak 1162 volume 8.74033 ppm1 8.618 ppm2 7.108
 
! ############### hot_gnoesyNhsqc_051903.1163 NOT folded
assi (attr store1 < 8.793 and attr store1 > 8.693 ) 
     ((attr store1 < 8.358 and attr store1 > 8.298 ) and bondedto
      (attr store1 < 120.535  and attr store1 > 119.735 ))
6 0.1 0.1 peak 1163 volume 6.20399 ppm1 8.328 ppm2 8.743
 
! ############### hot_gnoesyNhsqc_051903.1164 NOT folded
assi (attr store1 < 8.622 and attr store1 > 8.522 ) 
     ((attr store1 < 8.362 and attr store1 > 8.302 ) and bondedto
      (attr store1 < 120.492  and attr store1 > 119.692 ))
6 0.1 0.1 peak 1164 volume 9.19051 ppm1 8.332 ppm2 8.572
 
! ############### hot_gnoesyNhsqc_051903.1165 NOT folded
assi (attr store1 < 8.375 and attr store1 > 8.275 ) 
     ((attr store1 < 8.358 and attr store1 > 8.298 ) and bondedto
      (attr store1 < 120.514  and attr store1 > 119.714 ))
6 0.1 0.1 peak 1165 volume 187.18144 ppm1 8.328 ppm2 8.325
 
! ############### hot_gnoesyNhsqc_051903.1166 NOT folded
assi (attr store1 < 8.22 and attr store1 > 8.12 ) 
     ((attr store1 < 8.359 and attr store1 > 8.299 ) and bondedto
      (attr store1 < 120.524  and attr store1 > 119.724 ))
6 0.1 0.1 peak 1166 volume 42.49231 ppm1 8.329 ppm2 8.170
 
! ############### hot_gnoesyNhsqc_051903.1167 NOT folded
assi (attr store1 < 8.029 and attr store1 > 7.929 ) 
     ((attr store1 < 8.357 and attr store1 > 8.297 ) and bondedto
      (attr store1 < 120.54  and attr store1 > 119.74 ))
6 0.1 0.1 peak 1167 volume 41.30154 ppm1 8.327 ppm2 7.979
 
! ############### hot_gnoesyNhsqc_051903.1168 NOT folded
assi (attr store1 < 7.166 and attr store1 > 7.066 ) 
     ((attr store1 < 8.358 and attr store1 > 8.298 ) and bondedto
      (attr store1 < 120.532  and attr store1 > 119.732 ))
6 0.1 0.1 peak 1168 volume 17.42502 ppm1 8.328 ppm2 7.116
 
! ############### hot_gnoesyNhsqc_051903.1169 NOT folded
assi (attr store1 < 8.79 and attr store1 > 8.69 ) 
     ((attr store1 < 8.77 and attr store1 > 8.71 ) and bondedto
      (attr store1 < 120.26  and attr store1 > 119.46 ))
6 0.1 0.1 peak 1169 volume 308.40063 ppm1 8.740 ppm2 8.740
 
! ############### hot_gnoesyNhsqc_051903.1170 NOT folded
assi (attr store1 < 8.053 and attr store1 > 7.953 ) 
     ((attr store1 < 8.769 and attr store1 > 8.709 ) and bondedto
      (attr store1 < 120.251  and attr store1 > 119.451 ))
6 0.1 0.1 peak 1170 volume 94.96539 ppm1 8.739 ppm2 8.003
 
! ############### hot_gnoesyNhsqc_051903.1171 NOT folded
assi (attr store1 < 6.98 and attr store1 > 6.88 ) 
     ((attr store1 < 8.768 and attr store1 > 8.708 ) and bondedto
      (attr store1 < 120.257  and attr store1 > 119.457 ))
6 0.1 0.1 peak 1171 volume 7.71340 ppm1 8.738 ppm2 6.930
 
! ############### hot_gnoesyNhsqc_051903.1172 NOT folded
assi (attr store1 < 8.483 and attr store1 > 8.383 ) 
     ((attr store1 < 8.768 and attr store1 > 8.708 ) and bondedto
      (attr store1 < 120.279  and attr store1 > 119.479 ))
6 0.1 0.1 peak 1172 volume 8.30449 ppm1 8.738 ppm2 8.433
 
! ############### hot_gnoesyNhsqc_051903.1173 NOT folded
assi (attr store1 < 8.36 and attr store1 > 8.26 ) 
     ((attr store1 < 8.174 and attr store1 > 8.114 ) and bondedto
      (attr store1 < 120.347  and attr store1 > 119.547 ))
6 0.1 0.1 peak 1173 volume 52.30368 ppm1 8.144 ppm2 8.310
 
! ############### hot_gnoesyNhsqc_051903.1174 NOT folded
assi (attr store1 < 8.191 and attr store1 > 8.091 ) 
     ((attr store1 < 8.173 and attr store1 > 8.113 ) and bondedto
      (attr store1 < 120.338  and attr store1 > 119.538 ))
6 0.1 0.1 peak 1174 volume 653.05396 ppm1 8.143 ppm2 8.141
 
! ############### hot_gnoesyNhsqc_051903.1175 NOT folded
assi (attr store1 < 8.0 and attr store1 > 7.9 ) 
     ((attr store1 < 7.983 and attr store1 > 7.923 ) and bondedto
      (attr store1 < 120.311  and attr store1 > 119.511 ))
6 0.1 0.1 peak 1175 volume 55.17577 ppm1 7.953 ppm2 7.950
 
! ############### hot_gnoesyNhsqc_051903.1176 NOT folded
assi (attr store1 < 7.44 and attr store1 > 7.34 ) 
     ((attr store1 < 7.427 and attr store1 > 7.367 ) and bondedto
      (attr store1 < 120.27  and attr store1 > 119.47 ))
6 0.1 0.1 peak 1176 volume 7.34479 ppm1 7.397 ppm2 7.390
 
! ############### hot_gnoesyNhsqc_051903.1177 NOT folded
assi (attr store1 < 8.76 and attr store1 > 8.66 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 120.093  and attr store1 > 119.293 ))
6 0.1 0.1 peak 1177 volume 10.42707 ppm1 7.729 ppm2 8.710
 
! ############### hot_gnoesyNhsqc_051903.1178 NOT folded
assi (attr store1 < 8.681 and attr store1 > 8.581 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 120.119  and attr store1 > 119.319 ))
6 0.1 0.1 peak 1178 volume 12.50726 ppm1 7.729 ppm2 8.631
 
! ############### hot_gnoesyNhsqc_051903.1179 NOT folded
assi (attr store1 < 7.993 and attr store1 > 7.893 ) 
     ((attr store1 < 7.76 and attr store1 > 7.7 ) and bondedto
      (attr store1 < 120.102  and attr store1 > 119.302 ))
6 0.1 0.1 peak 1179 volume 72.85547 ppm1 7.730 ppm2 7.943
 
! ############### hot_gnoesyNhsqc_051903.1180 NOT folded
assi (attr store1 < 7.781 and attr store1 > 7.681 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 120.102  and attr store1 > 119.302 ))
6 0.1 0.1 peak 1180 volume 214.85692 ppm1 7.729 ppm2 7.731
 
! ############### hot_gnoesyNhsqc_051903.1181 NOT folded
assi (attr store1 < 8.32 and attr store1 > 8.22 ) 
     ((attr store1 < 8.302 and attr store1 > 8.242 ) and bondedto
      (attr store1 < 119.716  and attr store1 > 118.916 ))
6 0.1 0.1 peak 1181 volume 170.39587 ppm1 8.272 ppm2 8.270
 
! ############### hot_gnoesyNhsqc_051903.1182 NOT folded
assi (attr store1 < 7.811 and attr store1 > 7.711 ) 
     ((attr store1 < 8.291 and attr store1 > 8.231 ) and bondedto
      (attr store1 < 119.711  and attr store1 > 118.911 ))
6 0.1 0.1 peak 1182 volume 6.44208 ppm1 8.261 ppm2 7.761
 
! ############### hot_gnoesyNhsqc_051903.1183 NOT folded
assi (attr store1 < 8.24 and attr store1 > 8.14 ) 
     ((attr store1 < 8.222 and attr store1 > 8.162 ) and bondedto
      (attr store1 < 119.855  and attr store1 > 119.055 ))
6 0.1 0.1 peak 1183 volume 573.03259 ppm1 8.192 ppm2 8.190
 
! ############### hot_gnoesyNhsqc_051903.1184 NOT folded
assi (attr store1 < 7.828 and attr store1 > 7.728 ) 
     ((attr store1 < 8.221 and attr store1 > 8.161 ) and bondedto
      (attr store1 < 119.851  and attr store1 > 119.051 ))
6 0.1 0.1 peak 1184 volume 54.58338 ppm1 8.191 ppm2 7.778
 
! ############### hot_gnoesyNhsqc_051903.1185 NOT folded
assi (attr store1 < 7.953 and attr store1 > 7.853 ) 
     ((attr store1 < 8.22 and attr store1 > 8.16 ) and bondedto
      (attr store1 < 119.825  and attr store1 > 119.025 ))
6 0.1 0.1 peak 1185 volume 49.68180 ppm1 8.190 ppm2 7.903
 
! ############### hot_gnoesyNhsqc_051903.1186 NOT folded
assi (attr store1 < 7.655 and attr store1 > 7.555 ) 
     ((attr store1 < 8.22 and attr store1 > 8.16 ) and bondedto
      (attr store1 < 119.829  and attr store1 > 119.029 ))
6 0.1 0.1 peak 1186 volume 14.39961 ppm1 8.190 ppm2 7.605
 
! ############### hot_gnoesyNhsqc_051903.1187 NOT folded
assi (attr store1 < 6.857 and attr store1 > 6.757 ) 
     ((attr store1 < 8.221 and attr store1 > 8.161 ) and bondedto
      (attr store1 < 119.819  and attr store1 > 119.019 ))
6 0.1 0.1 peak 1187 volume 5.38345 ppm1 8.191 ppm2 6.807
 
! ############### hot_gnoesyNhsqc_051903.1188 NOT folded
assi (attr store1 < 7.004 and attr store1 > 6.904 ) 
     ((attr store1 < 8.0 and attr store1 > 7.94 ) and bondedto
      (attr store1 < 119.777  and attr store1 > 118.977 ))
6 0.1 0.1 peak 1188 volume 7.25905 ppm1 7.970 ppm2 6.954
 
! ############### hot_gnoesyNhsqc_051903.1189 NOT folded
assi (attr store1 < 7.789 and attr store1 > 7.689 ) 
     ((attr store1 < 7.998 and attr store1 > 7.938 ) and bondedto
      (attr store1 < 119.764  and attr store1 > 118.964 ))
6 0.1 0.1 peak 1189 volume 46.54741 ppm1 7.968 ppm2 7.739
 
! ############### hot_gnoesyNhsqc_051903.1190 NOT folded
assi (attr store1 < 8.67 and attr store1 > 8.57 ) 
     ((attr store1 < 7.945 and attr store1 > 7.885 ) and bondedto
      (attr store1 < 119.844  and attr store1 > 119.044 ))
6 0.1 0.1 peak 1190 volume 45.51995 ppm1 7.915 ppm2 8.620
 
! ############### hot_gnoesyNhsqc_051903.1191 NOT folded
assi (attr store1 < 7.787 and attr store1 > 7.687 ) 
     ((attr store1 < 7.946 and attr store1 > 7.886 ) and bondedto
      (attr store1 < 119.829  and attr store1 > 119.029 ))
6 0.1 0.1 peak 1191 volume 53.05271 ppm1 7.916 ppm2 7.737
 
! ############### hot_gnoesyNhsqc_051903.1192 NOT folded
assi (attr store1 < 7.0 and attr store1 > 6.9 ) 
     ((attr store1 < 7.945 and attr store1 > 7.885 ) and bondedto
      (attr store1 < 119.882  and attr store1 > 119.082 ))
6 0.1 0.1 peak 1192 volume 11.69007 ppm1 7.915 ppm2 6.950
 
! ############### hot_gnoesyNhsqc_051903.1193 NOT folded
assi (attr store1 < 8.001 and attr store1 > 7.901 ) 
     ((attr store1 < 8.339 and attr store1 > 8.279 ) and bondedto
      (attr store1 < 119.503  and attr store1 > 118.703 ))
6 0.1 0.1 peak 1193 volume 15.98742 ppm1 8.309 ppm2 7.951
 
! ############### hot_gnoesyNhsqc_051903.1194 NOT folded
assi (attr store1 < 8.959 and attr store1 > 8.859 ) 
     ((attr store1 < 8.301 and attr store1 > 8.241 ) and bondedto
      (attr store1 < 119.632  and attr store1 > 118.832 ))
6 0.1 0.1 peak 1194 volume 36.60581 ppm1 8.271 ppm2 8.909
 
! ############### hot_gnoesyNhsqc_051903.1195 NOT folded
assi (attr store1 < 8.739 and attr store1 > 8.639 ) 
     ((attr store1 < 8.301 and attr store1 > 8.241 ) and bondedto
      (attr store1 < 119.603  and attr store1 > 118.803 ))
6 0.1 0.1 peak 1195 volume 10.21560 ppm1 8.271 ppm2 8.689
 
! ############### hot_gnoesyNhsqc_051903.1196 NOT folded
assi (attr store1 < 7.575 and attr store1 > 7.475 ) 
     ((attr store1 < 8.3 and attr store1 > 8.24 ) and bondedto
      (attr store1 < 119.645  and attr store1 > 118.845 ))
6 0.1 0.1 peak 1196 volume 57.76314 ppm1 8.270 ppm2 7.525
 
! ############### hot_gnoesyNhsqc_051903.1197 NOT folded
assi (attr store1 < 8.012 and attr store1 > 7.912 ) 
     ((attr store1 < 8.291 and attr store1 > 8.231 ) and bondedto
      (attr store1 < 119.543  and attr store1 > 118.743 ))
6 0.1 0.1 peak 1197 volume 14.44331 ppm1 8.261 ppm2 7.962
 
! ############### hot_gnoesyNhsqc_051903.1198 NOT folded
assi (attr store1 < 8.79 and attr store1 > 8.69 ) 
     ((attr store1 < 7.998 and attr store1 > 7.938 ) and bondedto
      (attr store1 < 119.685  and attr store1 > 118.885 ))
6 0.1 0.1 peak 1198 volume 39.56717 ppm1 7.968 ppm2 8.740
 
! ############### hot_gnoesyNhsqc_051903.1199 NOT folded
assi (attr store1 < 8.491 and attr store1 > 8.391 ) 
     ((attr store1 < 7.978 and attr store1 > 7.918 ) and bondedto
      (attr store1 < 119.57  and attr store1 > 118.77 ))
6 0.1 0.1 peak 1199 volume 6.46161 ppm1 7.948 ppm2 8.441
 
! ############### hot_gnoesyNhsqc_051903.1200 NOT folded
assi (attr store1 < 8.341 and attr store1 > 8.241 ) 
     ((attr store1 < 7.979 and attr store1 > 7.919 ) and bondedto
      (attr store1 < 119.508  and attr store1 > 118.708 ))
6 0.1 0.1 peak 1200 volume 25.58971 ppm1 7.949 ppm2 8.291
 
! ############### hot_gnoesyNhsqc_051903.1201 NOT folded
assi (attr store1 < 8.221 and attr store1 > 8.121 ) 
     ((attr store1 < 7.979 and attr store1 > 7.919 ) and bondedto
      (attr store1 < 119.47  and attr store1 > 118.67 ))
6 0.1 0.1 peak 1201 volume 39.32883 ppm1 7.949 ppm2 8.171
 
! ############### hot_gnoesyNhsqc_051903.1202 NOT folded
assi (attr store1 < 8.148 and attr store1 > 8.048 ) 
     ((attr store1 < 7.98 and attr store1 > 7.92 ) and bondedto
      (attr store1 < 119.503  and attr store1 > 118.703 ))
6 0.1 0.1 peak 1202 volume 88.69444 ppm1 7.950 ppm2 8.098
 
! ############### hot_gnoesyNhsqc_051903.1203 NOT folded
assi (attr store1 < 8.002 and attr store1 > 7.902 ) 
     ((attr store1 < 7.618 and attr store1 > 7.558 ) and bondedto
      (attr store1 < 119.498  and attr store1 > 118.698 ))
6 0.1 0.1 peak 1203 volume 10.96620 ppm1 7.588 ppm2 7.952
 
! ############### hot_gnoesyNhsqc_051903.1204 NOT folded
assi (attr store1 < 8.001 and attr store1 > 7.901 ) 
     ((attr store1 < 9.921 and attr store1 > 9.861 ) and bondedto
      (attr store1 < 119.409  and attr store1 > 118.609 ))
6 0.1 0.1 peak 1204 volume 8.05579 ppm1 9.891 ppm2 7.951
 
! ############### hot_gnoesyNhsqc_051903.1205 NOT folded
assi (attr store1 < 8.004 and attr store1 > 7.904 ) 
     ((attr store1 < 8.579 and attr store1 > 8.519 ) and bondedto
      (attr store1 < 119.428  and attr store1 > 118.628 ))
6 0.1 0.1 peak 1205 volume 11.05110 ppm1 8.549 ppm2 7.954
 
! ############### hot_gnoesyNhsqc_051903.1206 NOT folded
assi (attr store1 < 8.733 and attr store1 > 8.633 ) 
     ((attr store1 < 8.46 and attr store1 > 8.4 ) and bondedto
      (attr store1 < 119.394  and attr store1 > 118.594 ))
6 0.1 0.1 peak 1206 volume 34.89261 ppm1 8.430 ppm2 8.683
 
! ############### hot_gnoesyNhsqc_051903.1207 NOT folded
assi (attr store1 < 8.479 and attr store1 > 8.379 ) 
     ((attr store1 < 8.458 and attr store1 > 8.398 ) and bondedto
      (attr store1 < 119.395  and attr store1 > 118.595 ))
6 0.1 0.1 peak 1207 volume 368.51196 ppm1 8.428 ppm2 8.429
 
! ############### hot_gnoesyNhsqc_051903.1208 NOT folded
assi (attr store1 < 8.062 and attr store1 > 7.962 ) 
     ((attr store1 < 8.459 and attr store1 > 8.399 ) and bondedto
      (attr store1 < 119.381  and attr store1 > 118.581 ))
6 0.1 0.1 peak 1208 volume 16.37697 ppm1 8.429 ppm2 8.012
 
! ############### hot_gnoesyNhsqc_051903.1209 NOT folded
assi (attr store1 < 7.867 and attr store1 > 7.767 ) 
     ((attr store1 < 8.459 and attr store1 > 8.399 ) and bondedto
      (attr store1 < 119.401  and attr store1 > 118.601 ))
6 0.1 0.1 peak 1209 volume 59.48291 ppm1 8.429 ppm2 7.817
 
! ############### hot_gnoesyNhsqc_051903.1210 NOT folded
assi (attr store1 < 8.135 and attr store1 > 8.035 ) 
     ((attr store1 < 8.113 and attr store1 > 8.053 ) and bondedto
      (attr store1 < 119.407  and attr store1 > 118.607 ))
6 0.1 0.1 peak 1210 volume 230.25533 ppm1 8.083 ppm2 8.085
 
! ############### hot_gnoesyNhsqc_051903.1211 NOT folded
assi (attr store1 < 8.576 and attr store1 > 8.476 ) 
     ((attr store1 < 8.083 and attr store1 > 8.023 ) and bondedto
      (attr store1 < 119.354  and attr store1 > 118.554 ))
6 0.1 0.1 peak 1211 volume 6.18062 ppm1 8.053 ppm2 8.526
 
! ############### hot_gnoesyNhsqc_051903.1212 NOT folded
assi (attr store1 < 8.388 and attr store1 > 8.288 ) 
     ((attr store1 < 8.084 and attr store1 > 8.024 ) and bondedto
      (attr store1 < 119.306  and attr store1 > 118.506 ))
6 0.1 0.1 peak 1212 volume 10.61355 ppm1 8.054 ppm2 8.338
 
! ############### hot_gnoesyNhsqc_051903.1213 NOT folded
assi (attr store1 < 6.936 and attr store1 > 6.836 ) 
     ((attr store1 < 8.079 and attr store1 > 8.019 ) and bondedto
      (attr store1 < 119.345  and attr store1 > 118.545 ))
6 0.1 0.1 peak 1213 volume 9.49085 ppm1 8.049 ppm2 6.886
 
! ############### hot_gnoesyNhsqc_051903.1214 NOT folded
assi (attr store1 < 6.814 and attr store1 > 6.714 ) 
     ((attr store1 < 8.077 and attr store1 > 8.017 ) and bondedto
      (attr store1 < 119.331  and attr store1 > 118.531 ))
6 0.1 0.1 peak 1214 volume 14.18766 ppm1 8.047 ppm2 6.764
 
! ############### hot_gnoesyNhsqc_051903.1215 NOT folded
assi (attr store1 < 6.696 and attr store1 > 6.596 ) 
     ((attr store1 < 8.076 and attr store1 > 8.016 ) and bondedto
      (attr store1 < 119.3  and attr store1 > 118.5 ))
6 0.1 0.1 peak 1215 volume 8.03502 ppm1 8.046 ppm2 6.646
 
! ############### hot_gnoesyNhsqc_051903.1217 NOT folded
assi (attr store1 < 8.0 and attr store1 > 7.9 ) 
     ((attr store1 < 7.979 and attr store1 > 7.919 ) and bondedto
      (attr store1 < 119.46  and attr store1 > 118.66 ))
6 0.1 0.1 peak 1217 volume 5730.35400 ppm1 7.949 ppm2 7.950
 
! ############### hot_gnoesyNhsqc_051903.1218 NOT folded
assi (attr store1 < 8.753 and attr store1 > 8.653 ) 
     ((attr store1 < 7.638 and attr store1 > 7.578 ) and bondedto
      (attr store1 < 119.256  and attr store1 > 118.456 ))
6 0.1 0.1 peak 1218 volume 7.43464 ppm1 7.608 ppm2 8.703
 
! ############### hot_gnoesyNhsqc_051903.1219 NOT folded
assi (attr store1 < 7.66 and attr store1 > 7.56 ) 
     ((attr store1 < 7.642 and attr store1 > 7.582 ) and bondedto
      (attr store1 < 119.307  and attr store1 > 118.507 ))
6 0.1 0.1 peak 1219 volume 282.13809 ppm1 7.612 ppm2 7.610
 
! ############### hot_gnoesyNhsqc_051903.1220 NOT folded
assi (attr store1 < 6.92 and attr store1 > 6.82 ) 
     ((attr store1 < 7.637 and attr store1 > 7.577 ) and bondedto
      (attr store1 < 119.325  and attr store1 > 118.525 ))
6 0.1 0.1 peak 1220 volume 7.33737 ppm1 7.607 ppm2 6.870
 
! ############### hot_gnoesyNhsqc_051903.1221 NOT folded
assi (attr store1 < 9.202 and attr store1 > 9.102 ) 
     ((attr store1 < 7.43 and attr store1 > 7.37 ) and bondedto
      (attr store1 < 119.402  and attr store1 > 118.602 ))
6 0.1 0.1 peak 1221 volume 6.02667 ppm1 7.400 ppm2 9.152
 
! ############### hot_gnoesyNhsqc_051903.1222 NOT folded
assi (attr store1 < 7.657 and attr store1 > 7.557 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 119.401  and attr store1 > 118.601 ))
6 0.1 0.1 peak 1222 volume 10.14810 ppm1 7.399 ppm2 7.607
 
! ############### hot_gnoesyNhsqc_051903.1223 NOT folded
assi (attr store1 < 8.755 and attr store1 > 8.655 ) 
     ((attr store1 < 7.425 and attr store1 > 7.365 ) and bondedto
      (attr store1 < 119.431  and attr store1 > 118.631 ))
6 0.1 0.1 peak 1223 volume 28.81054 ppm1 7.395 ppm2 8.705
 
! ############### hot_gnoesyNhsqc_051903.1224 NOT folded
assi (attr store1 < 8.097 and attr store1 > 7.997 ) 
     ((attr store1 < 7.425 and attr store1 > 7.365 ) and bondedto
      (attr store1 < 119.44  and attr store1 > 118.64 ))
6 0.1 0.1 peak 1224 volume 25.95508 ppm1 7.395 ppm2 8.047
 
! ############### hot_gnoesyNhsqc_051903.1225 NOT folded
assi (attr store1 < 7.441 and attr store1 > 7.341 ) 
     ((attr store1 < 7.424 and attr store1 > 7.364 ) and bondedto
      (attr store1 < 119.438  and attr store1 > 118.638 ))
6 0.1 0.1 peak 1225 volume 133.83101 ppm1 7.394 ppm2 7.391
 
! ############### hot_gnoesyNhsqc_051903.1226 NOT folded
assi (attr store1 < 8.794 and attr store1 > 8.694 ) 
     ((attr store1 < 8.771 and attr store1 > 8.711 ) and bondedto
      (attr store1 < 119.101  and attr store1 > 118.301 ))
6 0.1 0.1 peak 1226 volume 99.63934 ppm1 8.741 ppm2 8.744
 
! ############### hot_gnoesyNhsqc_051903.1227 NOT folded
assi (attr store1 < 8.471 and attr store1 > 8.371 ) 
     ((attr store1 < 8.775 and attr store1 > 8.715 ) and bondedto
      (attr store1 < 119.187  and attr store1 > 118.387 ))
6 0.1 0.1 peak 1227 volume 5.79870 ppm1 8.745 ppm2 8.421
 
! ############### hot_gnoesyNhsqc_051903.1228 NOT folded
assi (attr store1 < 8.325 and attr store1 > 8.225 ) 
     ((attr store1 < 8.774 and attr store1 > 8.714 ) and bondedto
      (attr store1 < 119.127  and attr store1 > 118.327 ))
6 0.1 0.1 peak 1228 volume 9.08321 ppm1 8.744 ppm2 8.275
 
! ############### hot_gnoesyNhsqc_051903.1229 NOT folded
assi (attr store1 < 8.042 and attr store1 > 7.942 ) 
     ((attr store1 < 8.774 and attr store1 > 8.714 ) and bondedto
      (attr store1 < 119.148  and attr store1 > 118.348 ))
6 0.1 0.1 peak 1229 volume 21.64104 ppm1 8.744 ppm2 7.992
 
! ############### hot_gnoesyNhsqc_051903.1231 NOT folded
assi (attr store1 < 7.547 and attr store1 > 7.447 ) 
     ((attr store1 < 8.771 and attr store1 > 8.711 ) and bondedto
      (attr store1 < 119.104  and attr store1 > 118.304 ))
6 0.1 0.1 peak 1231 volume 5.74421 ppm1 8.741 ppm2 7.497
 
! ############### hot_gnoesyNhsqc_051903.1235 NOT folded
assi (attr store1 < 7.605 and attr store1 > 7.505 ) 
     ((attr store1 < 8.004 and attr store1 > 7.944 ) and bondedto
      (attr store1 < 119.071  and attr store1 > 118.271 ))
6 0.1 0.1 peak 1235 volume 5.19239 ppm1 7.974 ppm2 7.555
 
! ############### hot_gnoesyNhsqc_051903.1236 NOT folded
assi (attr store1 < 7.794 and attr store1 > 7.694 ) 
     ((attr store1 < 7.757 and attr store1 > 7.697 ) and bondedto
      (attr store1 < 119.029  and attr store1 > 118.229 ))
6 0.1 0.1 peak 1236 volume 18.89392 ppm1 7.727 ppm2 7.744
 
! ############### hot_gnoesyNhsqc_051903.1237 NOT folded
assi (attr store1 < 9.207 and attr store1 > 9.107 ) 
     ((attr store1 < 7.634 and attr store1 > 7.574 ) and bondedto
      (attr store1 < 119.161  and attr store1 > 118.361 ))
6 0.1 0.1 peak 1237 volume 29.36115 ppm1 7.604 ppm2 9.157
 
! ############### hot_gnoesyNhsqc_051903.1238 NOT folded
assi (attr store1 < 7.404 and attr store1 > 7.304 ) 
     ((attr store1 < 8.458 and attr store1 > 8.398 ) and bondedto
      (attr store1 < 118.787  and attr store1 > 117.987 ))
6 0.1 0.1 peak 1238 volume 8.66113 ppm1 8.428 ppm2 7.354
 
! ############### hot_gnoesyNhsqc_051903.1239 NOT folded
assi (attr store1 < 6.996 and attr store1 > 6.896 ) 
     ((attr store1 < 8.456 and attr store1 > 8.396 ) and bondedto
      (attr store1 < 118.884  and attr store1 > 118.084 ))
6 0.1 0.1 peak 1239 volume 6.62380 ppm1 8.426 ppm2 6.946
 
! ############### hot_gnoesyNhsqc_051903.1240 NOT folded
assi (attr store1 < 8.8 and attr store1 > 8.7 ) 
     ((attr store1 < 8.454 and attr store1 > 8.394 ) and bondedto
      (attr store1 < 118.776  and attr store1 > 117.976 ))
6 0.1 0.1 peak 1240 volume 25.00771 ppm1 8.424 ppm2 8.750
 
! ############### hot_gnoesyNhsqc_051903.1241 NOT folded
assi (attr store1 < 7.893 and attr store1 > 7.793 ) 
     ((attr store1 < 8.251 and attr store1 > 8.191 ) and bondedto
      (attr store1 < 118.865  and attr store1 > 118.065 ))
6 0.1 0.1 peak 1241 volume 10.45102 ppm1 8.221 ppm2 7.843
 
! ############### hot_gnoesyNhsqc_051903.1242 NOT folded
assi (attr store1 < 8.499 and attr store1 > 8.399 ) 
     ((attr store1 < 7.884 and attr store1 > 7.824 ) and bondedto
      (attr store1 < 118.826  and attr store1 > 118.026 ))
6 0.1 0.1 peak 1242 volume 113.13354 ppm1 7.854 ppm2 8.449
 
! ############### hot_gnoesyNhsqc_051903.1243 NOT folded
assi (attr store1 < 8.092 and attr store1 > 7.992 ) 
     ((attr store1 < 7.884 and attr store1 > 7.824 ) and bondedto
      (attr store1 < 118.843  and attr store1 > 118.043 ))
6 0.1 0.1 peak 1243 volume 84.39026 ppm1 7.854 ppm2 8.042
 
! ############### hot_gnoesyNhsqc_051903.1244 NOT folded
assi (attr store1 < 7.906 and attr store1 > 7.806 ) 
     ((attr store1 < 7.886 and attr store1 > 7.826 ) and bondedto
      (attr store1 < 118.826  and attr store1 > 118.026 ))
6 0.1 0.1 peak 1244 volume 2784.01758 ppm1 7.856 ppm2 7.856
 
! ############### hot_gnoesyNhsqc_051903.1245 NOT folded
assi (attr store1 < 7.75 and attr store1 > 7.65 ) 
     ((attr store1 < 7.883 and attr store1 > 7.823 ) and bondedto
      (attr store1 < 118.832  and attr store1 > 118.032 ))
6 0.1 0.1 peak 1245 volume 31.03380 ppm1 7.853 ppm2 7.700
 
! ############### hot_gnoesyNhsqc_051903.1246 NOT folded
assi (attr store1 < 7.301 and attr store1 > 7.201 ) 
     ((attr store1 < 7.886 and attr store1 > 7.826 ) and bondedto
      (attr store1 < 118.832  and attr store1 > 118.032 ))
6 0.1 0.1 peak 1246 volume 14.48107 ppm1 7.856 ppm2 7.251
 
! ############### hot_gnoesyNhsqc_051903.1247 NOT folded
assi (attr store1 < 7.167 and attr store1 > 7.067 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 118.818  and attr store1 > 118.018 ))
6 0.1 0.1 peak 1247 volume 22.12956 ppm1 7.855 ppm2 7.117
 
! ############### hot_gnoesyNhsqc_051903.1248 NOT folded
assi (attr store1 < 7.037 and attr store1 > 6.937 ) 
     ((attr store1 < 7.885 and attr store1 > 7.825 ) and bondedto
      (attr store1 < 118.855  and attr store1 > 118.055 ))
6 0.1 0.1 peak 1248 volume 13.87815 ppm1 7.855 ppm2 6.987
 
! ############### hot_gnoesyNhsqc_051903.1249 NOT folded
assi (attr store1 < 7.66 and attr store1 > 7.56 ) 
     ((attr store1 < 7.882 and attr store1 > 7.822 ) and bondedto
      (attr store1 < 118.894  and attr store1 > 118.094 ))
6 0.1 0.1 peak 1249 volume 10.75803 ppm1 7.852 ppm2 7.610
 
! ############### hot_gnoesyNhsqc_051903.1250 NOT folded
assi (attr store1 < 8.771 and attr store1 > 8.671 ) 
     ((attr store1 < 7.845 and attr store1 > 7.785 ) and bondedto
      (attr store1 < 118.866  and attr store1 > 118.066 ))
6 0.1 0.1 peak 1250 volume 14.36898 ppm1 7.815 ppm2 8.721
 
! ############### hot_gnoesyNhsqc_051903.1251 NOT folded
assi (attr store1 < 8.08 and attr store1 > 7.98 ) 
     ((attr store1 < 7.857 and attr store1 > 7.797 ) and bondedto
      (attr store1 < 118.872  and attr store1 > 118.072 ))
6 0.1 0.1 peak 1251 volume 62.55437 ppm1 7.827 ppm2 8.030
 
! ############### hot_gnoesyNhsqc_051903.1252 NOT folded
assi (attr store1 < 8.33 and attr store1 > 8.23 ) 
     ((attr store1 < 8.452 and attr store1 > 8.392 ) and bondedto
      (attr store1 < 118.772  and attr store1 > 117.972 ))
6 0.1 0.1 peak 1252 volume 27.70793 ppm1 8.422 ppm2 8.280
 
! ############### hot_gnoesyNhsqc_051903.1253 NOT folded
assi (attr store1 < 8.364 and attr store1 > 8.264 ) 
     ((attr store1 < 8.255 and attr store1 > 8.195 ) and bondedto
      (attr store1 < 118.668  and attr store1 > 117.868 ))
6 0.1 0.1 peak 1253 volume 6.00640 ppm1 8.225 ppm2 8.314
 
! ############### hot_gnoesyNhsqc_051903.1254 NOT folded
assi (attr store1 < 8.234 and attr store1 > 8.134 ) 
     ((attr store1 < 8.223 and attr store1 > 8.163 ) and bondedto
      (attr store1 < 118.672  and attr store1 > 117.872 ))
6 0.1 0.1 peak 1254 volume 10.86427 ppm1 8.193 ppm2 8.184
 
! ############### hot_gnoesyNhsqc_051903.1255 NOT folded
assi (attr store1 < 8.048 and attr store1 > 7.948 ) 
     ((attr store1 < 8.212 and attr store1 > 8.152 ) and bondedto
      (attr store1 < 118.726  and attr store1 > 117.926 ))
6 0.1 0.1 peak 1255 volume 5.88516 ppm1 8.182 ppm2 7.998
 
! ############### hot_gnoesyNhsqc_051903.1256 NOT folded
assi (attr store1 < 8.801 and attr store1 > 8.701 ) 
     ((attr store1 < 8.077 and attr store1 > 8.017 ) and bondedto
      (attr store1 < 118.59  and attr store1 > 117.79 ))
6 0.1 0.1 peak 1256 volume 26.64951 ppm1 8.047 ppm2 8.751
 
! ############### hot_gnoesyNhsqc_051903.1257 NOT folded
assi (attr store1 < 8.094 and attr store1 > 7.994 ) 
     ((attr store1 < 8.075 and attr store1 > 8.015 ) and bondedto
      (attr store1 < 118.62  and attr store1 > 117.82 ))
6 0.1 0.1 peak 1257 volume 137.13374 ppm1 8.045 ppm2 8.044
 
! ############### hot_gnoesyNhsqc_051903.1258 NOT folded
assi (attr store1 < 7.441 and attr store1 > 7.341 ) 
     ((attr store1 < 8.078 and attr store1 > 8.018 ) and bondedto
      (attr store1 < 118.604  and attr store1 > 117.804 ))
6 0.1 0.1 peak 1258 volume 27.81133 ppm1 8.048 ppm2 7.391
 
! ############### hot_gnoesyNhsqc_051903.1259 NOT folded
assi (attr store1 < 8.673 and attr store1 > 8.573 ) 
     ((attr store1 < 8.016 and attr store1 > 7.956 ) and bondedto
      (attr store1 < 118.694  and attr store1 > 117.894 ))
6 0.1 0.1 peak 1259 volume 36.69188 ppm1 7.986 ppm2 8.623
 
! ############### hot_gnoesyNhsqc_051903.1260 NOT folded
assi (attr store1 < 8.361 and attr store1 > 8.261 ) 
     ((attr store1 < 8.018 and attr store1 > 7.958 ) and bondedto
      (attr store1 < 118.684  and attr store1 > 117.884 ))
6 0.1 0.1 peak 1260 volume 13.46122 ppm1 7.988 ppm2 8.311
 
! ############### hot_gnoesyNhsqc_051903.1261 NOT folded
assi (attr store1 < 8.205 and attr store1 > 8.105 ) 
     ((attr store1 < 8.017 and attr store1 > 7.957 ) and bondedto
      (attr store1 < 118.667  and attr store1 > 117.867 ))
6 0.1 0.1 peak 1261 volume 40.62846 ppm1 7.987 ppm2 8.155
 
! ############### hot_gnoesyNhsqc_051903.1262 NOT folded
assi (attr store1 < 8.041 and attr store1 > 7.941 ) 
     ((attr store1 < 8.018 and attr store1 > 7.958 ) and bondedto
      (attr store1 < 118.736  and attr store1 > 117.936 ))
6 0.1 0.1 peak 1262 volume 158.61438 ppm1 7.988 ppm2 7.991
 
! ############### hot_gnoesyNhsqc_051903.1263 NOT folded
assi (attr store1 < 8.493 and attr store1 > 8.393 ) 
     ((attr store1 < 7.393 and attr store1 > 7.333 ) and bondedto
      (attr store1 < 118.444  and attr store1 > 117.644 ))
6 0.1 0.1 peak 1263 volume 5.59542 ppm1 7.363 ppm2 8.443
 
! ############### hot_gnoesyNhsqc_051903.1264 NOT folded
assi (attr store1 < 6.39 and attr store1 > 6.29 ) 
     ((attr store1 < 7.388 and attr store1 > 7.328 ) and bondedto
      (attr store1 < 118.46  and attr store1 > 117.66 ))
6 0.1 0.1 peak 1264 volume 14.20383 ppm1 7.358 ppm2 6.340
 
! ############### hot_gnoesyNhsqc_051903.1265 NOT folded
assi (attr store1 < 7.396 and attr store1 > 7.296 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.464  and attr store1 > 117.664 ))
6 0.1 0.1 peak 1265 volume 192.10597 ppm1 7.356 ppm2 7.346
 
! ############### hot_gnoesyNhsqc_051903.1266 NOT folded
assi (attr store1 < 7.025 and attr store1 > 6.925 ) 
     ((attr store1 < 7.384 and attr store1 > 7.324 ) and bondedto
      (attr store1 < 118.452  and attr store1 > 117.652 ))
6 0.1 0.1 peak 1266 volume 16.39775 ppm1 7.354 ppm2 6.975
 
! ############### hot_gnoesyNhsqc_051903.1267 NOT folded
assi (attr store1 < 6.97 and attr store1 > 6.87 ) 
     ((attr store1 < 7.385 and attr store1 > 7.325 ) and bondedto
      (attr store1 < 118.462  and attr store1 > 117.662 ))
6 0.1 0.1 peak 1267 volume 15.04298 ppm1 7.355 ppm2 6.920
 
! ############### hot_gnoesyNhsqc_051903.1268 NOT folded
assi (attr store1 < 6.633 and attr store1 > 6.533 ) 
     ((attr store1 < 7.386 and attr store1 > 7.326 ) and bondedto
      (attr store1 < 118.461  and attr store1 > 117.661 ))
6 0.1 0.1 peak 1268 volume 9.49273 ppm1 7.356 ppm2 6.583
 
! ############### hot_gnoesyNhsqc_051903.1269 NOT folded
assi (attr store1 < 8.368 and attr store1 > 8.268 ) 
     ((attr store1 < 8.337 and attr store1 > 8.277 ) and bondedto
      (attr store1 < 118.189  and attr store1 > 117.389 ))
6 0.1 0.1 peak 1269 volume 9.07635 ppm1 8.307 ppm2 8.318
 
! ############### hot_gnoesyNhsqc_051903.1270 NOT folded
assi (attr store1 < 8.307 and attr store1 > 8.207 ) 
     ((attr store1 < 8.296 and attr store1 > 8.236 ) and bondedto
      (attr store1 < 118.292  and attr store1 > 117.492 ))
6 0.1 0.1 peak 1270 volume 8.82385 ppm1 8.266 ppm2 8.257
 
! ############### hot_gnoesyNhsqc_051903.1271 NOT folded
assi (attr store1 < 7.968 and attr store1 > 7.868 ) 
     ((attr store1 < 7.949 and attr store1 > 7.889 ) and bondedto
      (attr store1 < 118.183  and attr store1 > 117.383 ))
6 0.1 0.1 peak 1271 volume 480.16953 ppm1 7.919 ppm2 7.918
 
! ############### hot_gnoesyNhsqc_051903.1272 NOT folded
assi (attr store1 < 7.527 and attr store1 > 7.427 ) 
     ((attr store1 < 7.948 and attr store1 > 7.888 ) and bondedto
      (attr store1 < 118.206  and attr store1 > 117.406 ))
6 0.1 0.1 peak 1272 volume 55.29226 ppm1 7.918 ppm2 7.477
 
! ############### hot_gnoesyNhsqc_051903.1273 NOT folded
assi (attr store1 < 8.626 and attr store1 > 8.526 ) 
     ((attr store1 < 7.76 and attr store1 > 7.7 ) and bondedto
      (attr store1 < 118.234  and attr store1 > 117.434 ))
6 0.1 0.1 peak 1273 volume 9.16529 ppm1 7.730 ppm2 8.576
 
! ############### hot_gnoesyNhsqc_051903.1274 NOT folded
assi (attr store1 < 7.906 and attr store1 > 7.806 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 118.254  and attr store1 > 117.454 ))
6 0.1 0.1 peak 1274 volume 55.78298 ppm1 7.729 ppm2 7.856
 
! ############### hot_gnoesyNhsqc_051903.1275 NOT folded
assi (attr store1 < 7.786 and attr store1 > 7.686 ) 
     ((attr store1 < 7.759 and attr store1 > 7.699 ) and bondedto
      (attr store1 < 118.228  and attr store1 > 117.428 ))
6 0.1 0.1 peak 1275 volume 102.94089 ppm1 7.729 ppm2 7.736
 
! ############### hot_gnoesyNhsqc_051903.1276 NOT folded
assi (attr store1 < 7.659 and attr store1 > 7.559 ) 
     ((attr store1 < 7.641 and attr store1 > 7.581 ) and bondedto
      (attr store1 < 118.211  and attr store1 > 117.411 ))
6 0.1 0.1 peak 1276 volume 31.69292 ppm1 7.611 ppm2 7.609
 
! ############### hot_gnoesyNhsqc_051903.1277 NOT folded
assi (attr store1 < 9.382 and attr store1 > 9.282 ) 
     ((attr store1 < 7.219 and attr store1 > 7.159 ) and bondedto
      (attr store1 < 118.239  and attr store1 > 117.439 ))
6 0.1 0.1 peak 1277 volume 35.13623 ppm1 7.189 ppm2 9.332
 
! ############### hot_gnoesyNhsqc_051903.1278 NOT folded
assi (attr store1 < 8.5 and attr store1 > 8.4 ) 
     ((attr store1 < 7.219 and attr store1 > 7.159 ) and bondedto
      (attr store1 < 118.263  and attr store1 > 117.463 ))
6 0.1 0.1 peak 1278 volume 10.29254 ppm1 7.189 ppm2 8.450
 
! ############### hot_gnoesyNhsqc_051903.1279 NOT folded
assi (attr store1 < 7.241 and attr store1 > 7.141 ) 
     ((attr store1 < 7.219 and attr store1 > 7.159 ) and bondedto
      (attr store1 < 118.24  and attr store1 > 117.44 ))
6 0.1 0.1 peak 1279 volume 123.76212 ppm1 7.189 ppm2 7.191
 
! ############### hot_gnoesyNhsqc_051903.1280 NOT folded
assi (attr store1 < 7.578 and attr store1 > 7.478 ) 
     ((attr store1 < 7.218 and attr store1 > 7.158 ) and bondedto
      (attr store1 < 118.235  and attr store1 > 117.435 ))
6 0.1 0.1 peak 1280 volume 41.05317 ppm1 7.188 ppm2 7.528
 
! ############### hot_gnoesyNhsqc_051903.1281 NOT folded
assi (attr store1 < 8.582 and attr store1 > 8.482 ) 
     ((attr store1 < 7.914 and attr store1 > 7.854 ) and bondedto
      (attr store1 < 117.879  and attr store1 > 117.079 ))
6 0.1 0.1 peak 1281 volume 14.40495 ppm1 7.884 ppm2 8.532
 
! ############### hot_gnoesyNhsqc_051903.1282 NOT folded
assi (attr store1 < 6.815 and attr store1 > 6.715 ) 
     ((attr store1 < 7.912 and attr store1 > 7.852 ) and bondedto
      (attr store1 < 117.883  and attr store1 > 117.083 ))
6 0.1 0.1 peak 1282 volume 6.48368 ppm1 7.882 ppm2 6.765
 
! ############### hot_gnoesyNhsqc_051903.1283 NOT folded
assi (attr store1 < 6.915 and attr store1 > 6.815 ) 
     ((attr store1 < 8.726 and attr store1 > 8.666 ) and bondedto
      (attr store1 < 117.627  and attr store1 > 116.827 ))
6 0.1 0.1 peak 1283 volume 12.38533 ppm1 8.696 ppm2 6.865
 
! ############### hot_gnoesyNhsqc_051903.1284 NOT folded
assi (attr store1 < 7.794 and attr store1 > 7.694 ) 
     ((attr store1 < 7.837 and attr store1 > 7.777 ) and bondedto
      (attr store1 < 117.81  and attr store1 > 117.01 ))
6 0.1 0.1 peak 1284 volume 19.19505 ppm1 7.807 ppm2 7.744
 
! ############### hot_gnoesyNhsqc_051903.1285 NOT folded
assi (attr store1 < 9.206 and attr store1 > 9.106 ) 
     ((attr store1 < 8.727 and attr store1 > 8.667 ) and bondedto
      (attr store1 < 117.601  and attr store1 > 116.801 ))
6 0.1 0.1 peak 1285 volume 18.83661 ppm1 8.697 ppm2 9.156
 
! ############### hot_gnoesyNhsqc_051903.1286 NOT folded
assi (attr store1 < 8.747 and attr store1 > 8.647 ) 
     ((attr store1 < 8.727 and attr store1 > 8.667 ) and bondedto
      (attr store1 < 117.49  and attr store1 > 116.69 ))
6 0.1 0.1 peak 1286 volume 93.69965 ppm1 8.697 ppm2 8.697
 
! ############### hot_gnoesyNhsqc_051903.1287 NOT folded
assi (attr store1 < 7.445 and attr store1 > 7.345 ) 
     ((attr store1 < 8.726 and attr store1 > 8.666 ) and bondedto
      (attr store1 < 117.599  and attr store1 > 116.799 ))
6 0.1 0.1 peak 1287 volume 23.88303 ppm1 8.696 ppm2 7.395
 
! ############### hot_gnoesyNhsqc_051903.1288 NOT folded
assi (attr store1 < 8.487 and attr store1 > 8.387 ) 
     ((attr store1 < 8.463 and attr store1 > 8.403 ) and bondedto
      (attr store1 < 117.555  and attr store1 > 116.755 ))
6 0.1 0.1 peak 1288 volume 9.35346 ppm1 8.433 ppm2 8.437
 
! ############### hot_gnoesyNhsqc_051903.1289 NOT folded
assi (attr store1 < 8.239 and attr store1 > 8.139 ) 
     ((attr store1 < 8.187 and attr store1 > 8.127 ) and bondedto
      (attr store1 < 117.268  and attr store1 > 116.468 ))
6 0.1 0.1 peak 1289 volume 5.33840 ppm1 8.157 ppm2 8.189
 
! ############### hot_gnoesyNhsqc_051903.1290 NOT folded
assi (attr store1 < 8.068 and attr store1 > 7.968 ) 
     ((attr store1 < 8.073 and attr store1 > 8.013 ) and bondedto
      (attr store1 < 117.319  and attr store1 > 116.519 ))
6 0.1 0.1 peak 1290 volume 10.74148 ppm1 8.043 ppm2 8.018
 
! ############### hot_gnoesyNhsqc_051903.1291 NOT folded
assi (attr store1 < 7.968 and attr store1 > 7.868 ) 
     ((attr store1 < 7.952 and attr store1 > 7.892 ) and bondedto
      (attr store1 < 117.318  and attr store1 > 116.518 ))
6 0.1 0.1 peak 1291 volume 63.26337 ppm1 7.922 ppm2 7.918
 
! ############### hot_gnoesyNhsqc_051903.1292 NOT folded
assi (attr store1 < 8.092 and attr store1 > 7.992 ) 
     ((attr store1 < 7.939 and attr store1 > 7.879 ) and bondedto
      (attr store1 < 117.244  and attr store1 > 116.444 ))
6 0.1 0.1 peak 1292 volume 5.94169 ppm1 7.909 ppm2 8.042
 
! ############### hot_gnoesyNhsqc_051903.1293 NOT folded
assi (attr store1 < 7.384 and attr store1 > 7.284 ) 
     ((attr store1 < 7.341 and attr store1 > 7.281 ) and bondedto
      (attr store1 < 117.26  and attr store1 > 116.46 ))
6 0.1 0.1 peak 1293 volume 7.07632 ppm1 7.311 ppm2 7.334
 
! ############### hot_gnoesyNhsqc_051903.1294 NOT folded
assi (attr store1 < 8.323 and attr store1 > 8.223 ) 
     ((attr store1 < 8.712 and attr store1 > 8.652 ) and bondedto
      (attr store1 < 117.04  and attr store1 > 116.24 ))
6 0.1 0.1 peak 1294 volume 8.73390 ppm1 8.682 ppm2 8.273
 
! ############### hot_gnoesyNhsqc_051903.1295 NOT folded
assi (attr store1 < 8.038 and attr store1 > 7.938 ) 
     ((attr store1 < 8.714 and attr store1 > 8.654 ) and bondedto
      (attr store1 < 117.069  and attr store1 > 116.269 ))
6 0.1 0.1 peak 1295 volume 19.11541 ppm1 8.684 ppm2 7.988
 
! ############### hot_gnoesyNhsqc_051903.1296 NOT folded
assi (attr store1 < 7.577 and attr store1 > 7.477 ) 
     ((attr store1 < 8.714 and attr store1 > 8.654 ) and bondedto
      (attr store1 < 117.075  and attr store1 > 116.275 ))
6 0.1 0.1 peak 1296 volume 22.22506 ppm1 8.684 ppm2 7.527
 
! ############### hot_gnoesyNhsqc_051903.1297 NOT folded
assi (attr store1 < 8.081 and attr store1 > 7.981 ) 
     ((attr store1 < 8.564 and attr store1 > 8.504 ) and bondedto
      (attr store1 < 117.049  and attr store1 > 116.249 ))
6 0.1 0.1 peak 1297 volume 6.47799 ppm1 8.534 ppm2 8.031
 
! ############### hot_gnoesyNhsqc_051903.1298 NOT folded
assi (attr store1 < 8.579 and attr store1 > 8.479 ) 
     ((attr store1 < 8.558 and attr store1 > 8.498 ) and bondedto
      (attr store1 < 117.094  and attr store1 > 116.294 ))
6 0.1 0.1 peak 1298 volume 90.06752 ppm1 8.528 ppm2 8.529
 
! ############### hot_gnoesyNhsqc_051903.1299 NOT folded
assi (attr store1 < 7.917 and attr store1 > 7.817 ) 
     ((attr store1 < 8.558 and attr store1 > 8.498 ) and bondedto
      (attr store1 < 117.097  and attr store1 > 116.297 ))
6 0.1 0.1 peak 1299 volume 41.96779 ppm1 8.528 ppm2 7.867
 
! ############### hot_gnoesyNhsqc_051903.1300 NOT folded
assi (attr store1 < 8.37 and attr store1 > 8.27 ) 
     ((attr store1 < 8.457 and attr store1 > 8.397 ) and bondedto
      (attr store1 < 116.782  and attr store1 > 115.982 ))
6 0.1 0.1 peak 1300 volume 9.55533 ppm1 8.427 ppm2 8.320
 
! ############### hot_gnoesyNhsqc_051903.1301 NOT folded
assi (attr store1 < 7.866 and attr store1 > 7.766 ) 
     ((attr store1 < 8.352 and attr store1 > 8.292 ) and bondedto
      (attr store1 < 116.778  and attr store1 > 115.978 ))
6 0.1 0.1 peak 1301 volume 10.75825 ppm1 8.322 ppm2 7.816
 
! ############### hot_gnoesyNhsqc_051903.1302 NOT folded
assi (attr store1 < 8.724 and attr store1 > 8.624 ) 
     ((attr store1 < 8.349 and attr store1 > 8.289 ) and bondedto
      (attr store1 < 116.8  and attr store1 > 116.0 ))
6 0.1 0.1 peak 1302 volume 17.98146 ppm1 8.319 ppm2 8.674
 
! ############### hot_gnoesyNhsqc_051903.1303 NOT folded
assi (attr store1 < 8.368 and attr store1 > 8.268 ) 
     ((attr store1 < 8.35 and attr store1 > 8.29 ) and bondedto
      (attr store1 < 116.798  and attr store1 > 115.998 ))
6 0.1 0.1 peak 1303 volume 342.26862 ppm1 8.320 ppm2 8.318
 
! ############### hot_gnoesyNhsqc_051903.1304 NOT folded
assi (attr store1 < 8.197 and attr store1 > 8.097 ) 
     ((attr store1 < 8.349 and attr store1 > 8.289 ) and bondedto
      (attr store1 < 116.798  and attr store1 > 115.998 ))
6 0.1 0.1 peak 1304 volume 44.15865 ppm1 8.319 ppm2 8.147
 
! ############### hot_gnoesyNhsqc_051903.1305 NOT folded
assi (attr store1 < 8.24 and attr store1 > 8.14 ) 
     ((attr store1 < 8.214 and attr store1 > 8.154 ) and bondedto
      (attr store1 < 116.708  and attr store1 > 115.908 ))
6 0.1 0.1 peak 1305 volume 5.20567 ppm1 8.184 ppm2 8.190
 
! ############### hot_gnoesyNhsqc_051903.1306 NOT folded
assi (attr store1 < 7.965 and attr store1 > 7.865 ) 
     ((attr store1 < 6.96 and attr store1 > 6.9 ) and bondedto
      (attr store1 < 116.812  and attr store1 > 116.012 ))
6 0.1 0.1 peak 1306 volume 5.26279 ppm1 6.930 ppm2 7.915
 
! ############### hot_gnoesyNhsqc_051903.1307 NOT folded
assi (attr store1 < 8.328 and attr store1 > 8.228 ) 
     ((attr store1 < 7.781 and attr store1 > 7.721 ) and bondedto
      (attr store1 < 116.463  and attr store1 > 115.663 ))
6 0.1 0.1 peak 1307 volume 27.59506 ppm1 7.751 ppm2 8.278
 
! ############### hot_gnoesyNhsqc_051903.1308 NOT folded
assi (attr store1 < 8.04 and attr store1 > 7.94 ) 
     ((attr store1 < 7.782 and attr store1 > 7.722 ) and bondedto
      (attr store1 < 116.484  and attr store1 > 115.684 ))
6 0.1 0.1 peak 1308 volume 5.66611 ppm1 7.752 ppm2 7.990
 
! ############### hot_gnoesyNhsqc_051903.1310 NOT folded
assi (attr store1 < 7.798 and attr store1 > 7.698 ) 
     ((attr store1 < 7.781 and attr store1 > 7.721 ) and bondedto
      (attr store1 < 116.443  and attr store1 > 115.643 ))
6 0.1 0.1 peak 1310 volume 92.70945 ppm1 7.751 ppm2 7.748
 
! ############### hot_gnoesyNhsqc_051903.1312 NOT folded
assi (attr store1 < 7.003 and attr store1 > 6.903 ) 
     ((attr store1 < 7.781 and attr store1 > 7.721 ) and bondedto
      (attr store1 < 116.287  and attr store1 > 115.487 ))
6 0.1 0.1 peak 1312 volume 5.34268 ppm1 7.751 ppm2 6.953
 
! ############### hot_gnoesyNhsqc_051903.1313 NOT folded
assi (attr store1 < 7.796 and attr store1 > 7.696 ) 
     ((attr store1 < 7.671 and attr store1 > 7.611 ) and bondedto
      (attr store1 < 116.387  and attr store1 > 115.587 ))
6 0.1 0.1 peak 1313 volume 5.23762 ppm1 7.641 ppm2 7.746
 
! ############### hot_gnoesyNhsqc_051903.1314 NOT folded
assi (attr store1 < 8.498 and attr store1 > 8.398 ) 
     ((attr store1 < 7.318 and attr store1 > 7.258 ) and bondedto
      (attr store1 < 116.311  and attr store1 > 115.511 ))
6 0.1 0.1 peak 1314 volume 9.77681 ppm1 7.288 ppm2 8.448
 
! ############### hot_gnoesyNhsqc_051903.1315 NOT folded
assi (attr store1 < 7.345 and attr store1 > 7.245 ) 
     ((attr store1 < 7.316 and attr store1 > 7.256 ) and bondedto
      (attr store1 < 116.3  and attr store1 > 115.5 ))
6 0.1 0.1 peak 1315 volume 231.76985 ppm1 7.286 ppm2 7.295
 
! ############### hot_gnoesyNhsqc_051903.1316 NOT folded
assi (attr store1 < 7.036 and attr store1 > 6.936 ) 
     ((attr store1 < 7.315 and attr store1 > 7.255 ) and bondedto
      (attr store1 < 116.285  and attr store1 > 115.485 ))
6 0.1 0.1 peak 1316 volume 47.72452 ppm1 7.285 ppm2 6.986
 
! ############### hot_gnoesyNhsqc_051903.1317 NOT folded
assi (attr store1 < 6.388 and attr store1 > 6.288 ) 
     ((attr store1 < 7.315 and attr store1 > 7.255 ) and bondedto
      (attr store1 < 116.299  and attr store1 > 115.499 ))
6 0.1 0.1 peak 1317 volume 9.57273 ppm1 7.285 ppm2 6.338
 
! ############### hot_gnoesyNhsqc_051903.1318 NOT folded
assi (attr store1 < 6.974 and attr store1 > 6.874 ) 
     ((attr store1 < 7.95 and attr store1 > 7.89 ) and bondedto
      (attr store1 < 116.037  and attr store1 > 115.237 ))
6 0.1 0.1 peak 1318 volume 504.33853 ppm1 7.920 ppm2 6.924
 
! ############### hot_gnoesyNhsqc_051903.1319 NOT folded
assi (attr store1 < 8.664 and attr store1 > 8.564 ) 
     ((attr store1 < 7.884 and attr store1 > 7.824 ) and bondedto
      (attr store1 < 116.108  and attr store1 > 115.308 ))
6 0.1 0.1 peak 1319 volume 61.32191 ppm1 7.854 ppm2 8.614
 
! ############### hot_gnoesyNhsqc_051903.1320 NOT folded
assi (attr store1 < 7.908 and attr store1 > 7.808 ) 
     ((attr store1 < 7.884 and attr store1 > 7.824 ) and bondedto
      (attr store1 < 116.113  and attr store1 > 115.313 ))
6 0.1 0.1 peak 1320 volume 271.75150 ppm1 7.854 ppm2 7.858
 
! ############### hot_gnoesyNhsqc_051903.1321 NOT folded
assi (attr store1 < 7.531 and attr store1 > 7.431 ) 
     ((attr store1 < 7.883 and attr store1 > 7.823 ) and bondedto
      (attr store1 < 116.128  and attr store1 > 115.328 ))
6 0.1 0.1 peak 1321 volume 8.52004 ppm1 7.853 ppm2 7.481
 
! ############### hot_gnoesyNhsqc_051903.1322 NOT folded
assi (attr store1 < 6.821 and attr store1 > 6.721 ) 
     ((attr store1 < 7.887 and attr store1 > 7.827 ) and bondedto
      (attr store1 < 116.099  and attr store1 > 115.299 ))
6 0.1 0.1 peak 1322 volume 5.32436 ppm1 7.857 ppm2 6.771
 
! ############### hot_gnoesyNhsqc_051903.1323 NOT folded
assi (attr store1 < 6.983 and attr store1 > 6.883 ) 
     ((attr store1 < 7.815 and attr store1 > 7.755 ) and bondedto
      (attr store1 < 116.102  and attr store1 > 115.302 ))
6 0.1 0.1 peak 1323 volume 5.43316 ppm1 7.785 ppm2 6.933
 
! ############### hot_gnoesyNhsqc_051903.1324 NOT folded
assi (attr store1 < 8.789 and attr store1 > 8.689 ) 
     ((attr store1 < 6.954 and attr store1 > 6.894 ) and bondedto
      (attr store1 < 116.037  and attr store1 > 115.237 ))
6 0.1 0.1 peak 1324 volume 6.35945 ppm1 6.924 ppm2 8.739
 
! ############### hot_gnoesyNhsqc_051903.1325 NOT folded
assi (attr store1 < 7.969 and attr store1 > 7.869 ) 
     ((attr store1 < 6.954 and attr store1 > 6.894 ) and bondedto
      (attr store1 < 116.042  and attr store1 > 115.242 ))
6 0.1 0.1 peak 1325 volume 566.86157 ppm1 6.924 ppm2 7.919
 
! ############### hot_gnoesyNhsqc_051903.1326 NOT folded
assi (attr store1 < 6.974 and attr store1 > 6.874 ) 
     ((attr store1 < 6.954 and attr store1 > 6.894 ) and bondedto
      (attr store1 < 116.023  and attr store1 > 115.223 ))
6 0.1 0.1 peak 1326 volume 734.33502 ppm1 6.924 ppm2 6.924
 
! ############### hot_gnoesyNhsqc_051903.1327 NOT folded
assi (attr store1 < 9.581 and attr store1 > 9.481 ) 
     ((attr store1 < 9.562 and attr store1 > 9.502 ) and bondedto
      (attr store1 < 115.91  and attr store1 > 115.11 ))
6 0.1 0.1 peak 1327 volume 41.05680 ppm1 9.532 ppm2 9.531
 
! ############### hot_gnoesyNhsqc_051903.1328 NOT folded
assi (attr store1 < 6.666 and attr store1 > 6.566 ) 
     ((attr store1 < 9.558 and attr store1 > 9.498 ) and bondedto
      (attr store1 < 115.927  and attr store1 > 115.127 ))
6 0.1 0.1 peak 1328 volume 10.17087 ppm1 9.528 ppm2 6.616
 
! ############### hot_gnoesyNhsqc_051903.1329 NOT folded
assi (attr store1 < 6.978 and attr store1 > 6.878 ) 
     ((attr store1 < 8.125 and attr store1 > 8.065 ) and bondedto
      (attr store1 < 115.949  and attr store1 > 115.149 ))
6 0.1 0.1 peak 1329 volume 5.55017 ppm1 8.095 ppm2 6.928
 
! ############### hot_gnoesyNhsqc_051903.1330 NOT folded
assi (attr store1 < 8.775 and attr store1 > 8.675 ) 
     ((attr store1 < 7.951 and attr store1 > 7.891 ) and bondedto
      (attr store1 < 115.993  and attr store1 > 115.193 ))
6 0.1 0.1 peak 1330 volume 8.87145 ppm1 7.921 ppm2 8.725
 
! ############### hot_gnoesyNhsqc_051903.1331 NOT folded
assi (attr store1 < 7.968 and attr store1 > 7.868 ) 
     ((attr store1 < 7.951 and attr store1 > 7.891 ) and bondedto
      (attr store1 < 115.952  and attr store1 > 115.152 ))
6 0.1 0.1 peak 1331 volume 665.54974 ppm1 7.921 ppm2 7.918
 
! ############### hot_gnoesyNhsqc_051903.1332 NOT folded
assi (attr store1 < 6.638 and attr store1 > 6.538 ) 
     ((attr store1 < 6.732 and attr store1 > 6.672 ) and bondedto
      (attr store1 < 115.594  and attr store1 > 114.794 ))
6 0.1 0.1 peak 1332 volume 6.23044 ppm1 6.702 ppm2 6.588
 
! ############### hot_gnoesyNhsqc_051903.1333 NOT folded
assi (attr store1 < 7.394 and attr store1 > 7.294 ) 
     ((attr store1 < 6.612 and attr store1 > 6.552 ) and bondedto
      (attr store1 < 115.609  and attr store1 > 114.809 ))
6 0.1 0.1 peak 1333 volume 6.92457 ppm1 6.582 ppm2 7.344
 
! ############### hot_gnoesyNhsqc_051903.1334 NOT folded
assi (attr store1 < 6.632 and attr store1 > 6.532 ) 
     ((attr store1 < 6.61 and attr store1 > 6.55 ) and bondedto
      (attr store1 < 115.579  and attr store1 > 114.779 ))
6 0.1 0.1 peak 1334 volume 64.85121 ppm1 6.580 ppm2 6.582
 
! ############### hot_gnoesyNhsqc_051903.1335 NOT folded
assi (attr store1 < 6.637 and attr store1 > 6.537 ) 
     ((attr store1 < 6.497 and attr store1 > 6.437 ) and bondedto
      (attr store1 < 115.612  and attr store1 > 114.812 ))
6 0.1 0.1 peak 1335 volume 8.22176 ppm1 6.467 ppm2 6.587
 
! ############### hot_gnoesyNhsqc_051903.1336 NOT folded
assi (attr store1 < 9.382 and attr store1 > 9.282 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.37  and attr store1 > 114.57 ))
6 0.1 0.1 peak 1336 volume 302.81662 ppm1 9.332 ppm2 9.332
 
! ############### hot_gnoesyNhsqc_051903.1337 NOT folded
assi (attr store1 < 8.501 and attr store1 > 8.401 ) 
     ((attr store1 < 9.361 and attr store1 > 9.301 ) and bondedto
      (attr store1 < 115.394  and attr store1 > 114.594 ))
6 0.1 0.1 peak 1337 volume 6.56381 ppm1 9.331 ppm2 8.451
 
! ############### hot_gnoesyNhsqc_051903.1338 NOT folded
assi (attr store1 < 7.582 and attr store1 > 7.482 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.354  and attr store1 > 114.554 ))
6 0.1 0.1 peak 1338 volume 9.88282 ppm1 9.332 ppm2 7.532
 
! ############### hot_gnoesyNhsqc_051903.1339 NOT folded
assi (attr store1 < 7.241 and attr store1 > 7.141 ) 
     ((attr store1 < 9.362 and attr store1 > 9.302 ) and bondedto
      (attr store1 < 115.376  and attr store1 > 114.576 ))
6 0.1 0.1 peak 1339 volume 39.03809 ppm1 9.332 ppm2 7.191
 
! ############### hot_gnoesyNhsqc_051903.1340 NOT folded
assi (attr store1 < 8.364 and attr store1 > 8.264 ) 
     ((attr store1 < 8.333 and attr store1 > 8.273 ) and bondedto
      (attr store1 < 115.494  and attr store1 > 114.694 ))
6 0.1 0.1 peak 1340 volume 6.01818 ppm1 8.303 ppm2 8.314
 
! ############### hot_gnoesyNhsqc_051903.1341 NOT folded
assi (attr store1 < 7.79 and attr store1 > 7.69 ) 
     ((attr store1 < 7.767 and attr store1 > 7.707 ) and bondedto
      (attr store1 < 115.391  and attr store1 > 114.591 ))
6 0.1 0.1 peak 1341 volume 8.32417 ppm1 7.737 ppm2 7.740
 
! ############### hot_gnoesyNhsqc_051903.1342 NOT folded
assi (attr store1 < 8.406 and attr store1 > 8.306 ) 
     ((attr store1 < 8.203 and attr store1 > 8.143 ) and bondedto
      (attr store1 < 115.206  and attr store1 > 114.406 ))
6 0.1 0.1 peak 1342 volume 19.08649 ppm1 8.173 ppm2 8.356
 
! ############### hot_gnoesyNhsqc_051903.1343 NOT folded
assi (attr store1 < 8.224 and attr store1 > 8.124 ) 
     ((attr store1 < 8.202 and attr store1 > 8.142 ) and bondedto
      (attr store1 < 115.219  and attr store1 > 114.419 ))
6 0.1 0.1 peak 1343 volume 344.08118 ppm1 8.172 ppm2 8.174
 
! ############### hot_gnoesyNhsqc_051903.1344 NOT folded
assi (attr store1 < 7.826 and attr store1 > 7.726 ) 
     ((attr store1 < 7.916 and attr store1 > 7.856 ) and bondedto
      (attr store1 < 115.003  and attr store1 > 114.203 ))
6 0.1 0.1 peak 1344 volume 6.96339 ppm1 7.886 ppm2 7.776
 
! ############### hot_gnoesyNhsqc_051903.1345 NOT folded
assi (attr store1 < 7.918 and attr store1 > 7.818 ) 
     ((attr store1 < 7.824 and attr store1 > 7.764 ) and bondedto
      (attr store1 < 115.006  and attr store1 > 114.206 ))
6 0.1 0.1 peak 1345 volume 6.80076 ppm1 7.794 ppm2 7.868
 
! ############### hot_gnoesyNhsqc_051903.1346 NOT folded
assi (attr store1 < 7.822 and attr store1 > 7.722 ) 
     ((attr store1 < 7.785 and attr store1 > 7.725 ) and bondedto
      (attr store1 < 114.919  and attr store1 > 114.119 ))
6 0.1 0.1 peak 1346 volume 10.59305 ppm1 7.755 ppm2 7.772
 
! ############### hot_gnoesyNhsqc_051903.1347 NOT folded
assi (attr store1 < 8.1 and attr store1 > 8.0 ) 
     ((attr store1 < 8.077 and attr store1 > 8.017 ) and bondedto
      (attr store1 < 114.719  and attr store1 > 113.919 ))
6 0.1 0.1 peak 1347 volume 5.76710 ppm1 8.047 ppm2 8.050
 
! ############### hot_gnoesyNhsqc_051903.1348 NOT folded
assi (attr store1 < 8.049 and attr store1 > 7.949 ) 
     ((attr store1 < 8.016 and attr store1 > 7.956 ) and bondedto
      (attr store1 < 114.808  and attr store1 > 114.008 ))
6 0.1 0.1 peak 1348 volume 7.36043 ppm1 7.986 ppm2 7.999
 
! ############### hot_gnoesyNhsqc_051903.1349 NOT folded
assi (attr store1 < 7.402 and attr store1 > 7.302 ) 
     ((attr store1 < 7.501 and attr store1 > 7.441 ) and bondedto
      (attr store1 < 114.635  and attr store1 > 113.835 ))
6 0.1 0.1 peak 1349 volume 9.60137 ppm1 7.471 ppm2 7.352
 
! ############### hot_gnoesyNhsqc_051903.1350 NOT folded
assi (attr store1 < 7.403 and attr store1 > 7.303 ) 
     ((attr store1 < 7.384 and attr store1 > 7.324 ) and bondedto
      (attr store1 < 114.634  and attr store1 > 113.834 ))
6 0.1 0.1 peak 1350 volume 125.72496 ppm1 7.354 ppm2 7.353
 
! ############### hot_gnoesyNhsqc_051903.1351 NOT folded
assi (attr store1 < 7.4 and attr store1 > 7.3 ) 
     ((attr store1 < 7.266 and attr store1 > 7.206 ) and bondedto
      (attr store1 < 114.624  and attr store1 > 113.824 ))
6 0.1 0.1 peak 1351 volume 13.70534 ppm1 7.236 ppm2 7.350
 
! ############### hot_gnoesyNhsqc_051903.1352 NOT folded
assi (attr store1 < 7.224 and attr store1 > 7.124 ) 
     ((attr store1 < 7.217 and attr store1 > 7.157 ) and bondedto
      (attr store1 < 114.659  and attr store1 > 113.859 ))
6 0.1 0.1 peak 1352 volume 6.51474 ppm1 7.187 ppm2 7.174
 
! ############### hot_gnoesyNhsqc_051903.1353 NOT folded
assi (attr store1 < 7.915 and attr store1 > 7.815 ) 
     ((attr store1 < 7.888 and attr store1 > 7.828 ) and bondedto
      (attr store1 < 114.509  and attr store1 > 113.709 ))
6 0.1 0.1 peak 1353 volume 12.84957 ppm1 7.858 ppm2 7.865
 
! ############### hot_gnoesyNhsqc_051903.1354 NOT folded
assi (attr store1 < 7.404 and attr store1 > 7.304 ) 
     ((attr store1 < 7.212 and attr store1 > 7.152 ) and bondedto
      (attr store1 < 114.599  and attr store1 > 113.799 ))
6 0.1 0.1 peak 1354 volume 6.61308 ppm1 7.182 ppm2 7.354
 
! ############### hot_gnoesyNhsqc_051903.1355 NOT folded
assi (attr store1 < 6.855 and attr store1 > 6.755 ) 
     ((attr store1 < 6.855 and attr store1 > 6.795 ) and bondedto
      (attr store1 < 114.496  and attr store1 > 113.696 ))
6 0.1 0.1 peak 1355 volume 12.09444 ppm1 6.825 ppm2 6.805
 
! ############### hot_gnoesyNhsqc_051903.1356 NOT folded
assi (attr store1 < 8.961 and attr store1 > 8.861 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.167  and attr store1 > 113.367 ))
6 0.1 0.1 peak 1356 volume 163.32413 ppm1 8.913 ppm2 8.911
 
! ############### hot_gnoesyNhsqc_051903.1357 NOT folded
assi (attr store1 < 8.32 and attr store1 > 8.22 ) 
     ((attr store1 < 8.943 and attr store1 > 8.883 ) and bondedto
      (attr store1 < 114.177  and attr store1 > 113.377 ))
6 0.1 0.1 peak 1357 volume 42.42617 ppm1 8.913 ppm2 8.270
 
! ############### hot_gnoesyNhsqc_051903.1358 NOT folded
assi (attr store1 < 7.794 and attr store1 > 7.694 ) 
     ((attr store1 < 8.942 and attr store1 > 8.882 ) and bondedto
      (attr store1 < 114.17  and attr store1 > 113.37 ))
6 0.1 0.1 peak 1358 volume 7.68376 ppm1 8.912 ppm2 7.744
 
! ############### hot_gnoesyNhsqc_051903.1359 NOT folded
assi (attr store1 < 7.576 and attr store1 > 7.476 ) 
     ((attr store1 < 8.944 and attr store1 > 8.884 ) and bondedto
      (attr store1 < 114.179  and attr store1 > 113.379 ))
6 0.1 0.1 peak 1359 volume 12.55338 ppm1 8.914 ppm2 7.526
 
! ############### hot_gnoesyNhsqc_051903.1360 NOT folded
assi (attr store1 < 7.926 and attr store1 > 7.826 ) 
     ((attr store1 < 6.963 and attr store1 > 6.903 ) and bondedto
      (attr store1 < 114.201  and attr store1 > 113.401 ))
6 0.1 0.1 peak 1360 volume 7.21168 ppm1 6.933 ppm2 7.876
 
! ############### hot_gnoesyNhsqc_051903.1361 NOT folded
assi (attr store1 < 7.032 and attr store1 > 6.932 ) 
     ((attr store1 < 8.944 and attr store1 > 8.884 ) and bondedto
      (attr store1 < 114.131  and attr store1 > 113.331 ))
6 0.1 0.1 peak 1361 volume 6.38794 ppm1 8.914 ppm2 6.982
 
! ############### hot_gnoesyNhsqc_051903.1362 NOT folded
assi (attr store1 < 8.232 and attr store1 > 8.132 ) 
     ((attr store1 < 8.2 and attr store1 > 8.14 ) and bondedto
      (attr store1 < 113.936  and attr store1 > 113.136 ))
6 0.1 0.1 peak 1362 volume 6.13782 ppm1 8.170 ppm2 8.182
 
! ############### hot_gnoesyNhsqc_051903.1363 NOT folded
assi (attr store1 < 8.242 and attr store1 > 8.142 ) 
     ((attr store1 < 8.181 and attr store1 > 8.121 ) and bondedto
      (attr store1 < 114.013  and attr store1 > 113.213 ))
6 0.1 0.1 peak 1363 volume 5.80522 ppm1 8.151 ppm2 8.192
 
! ############### hot_gnoesyNhsqc_051903.1364 NOT folded
assi (attr store1 < 6.94 and attr store1 > 6.84 ) 
     ((attr store1 < 8.013 and attr store1 > 7.953 ) and bondedto
      (attr store1 < 113.725  and attr store1 > 112.925 ))
6 0.1 0.1 peak 1364 volume 14.16932 ppm1 7.983 ppm2 6.890
 
! ############### hot_gnoesyNhsqc_051903.1365 NOT folded
assi (attr store1 < 8.383 and attr store1 > 8.283 ) 
     ((attr store1 < 8.011 and attr store1 > 7.951 ) and bondedto
      (attr store1 < 113.776  and attr store1 > 112.976 ))
6 0.1 0.1 peak 1365 volume 65.80227 ppm1 7.981 ppm2 8.333
 
! ############### hot_gnoesyNhsqc_051903.1366 NOT folded
assi (attr store1 < 8.032 and attr store1 > 7.932 ) 
     ((attr store1 < 8.012 and attr store1 > 7.952 ) and bondedto
      (attr store1 < 113.779  and attr store1 > 112.979 ))
6 0.1 0.1 peak 1366 volume 139.28372 ppm1 7.982 ppm2 7.982
 
! ############### hot_gnoesyNhsqc_051903.1367 NOT folded
assi (attr store1 < 8.499 and attr store1 > 8.399 ) 
     ((attr store1 < 7.02 and attr store1 > 6.96 ) and bondedto
      (attr store1 < 113.769  and attr store1 > 112.969 ))
6 0.1 0.1 peak 1367 volume 43.09057 ppm1 6.990 ppm2 8.449
 
! ############### hot_gnoesyNhsqc_051903.1368 NOT folded
assi (attr store1 < 7.582 and attr store1 > 7.482 ) 
     ((attr store1 < 7.019 and attr store1 > 6.959 ) and bondedto
      (attr store1 < 113.732  and attr store1 > 112.932 ))
6 0.1 0.1 peak 1368 volume 12.93985 ppm1 6.989 ppm2 7.532
 
! ############### hot_gnoesyNhsqc_051903.1369 NOT folded
assi (attr store1 < 7.342 and attr store1 > 7.242 ) 
     ((attr store1 < 7.02 and attr store1 > 6.96 ) and bondedto
      (attr store1 < 113.773  and attr store1 > 112.973 ))
6 0.1 0.1 peak 1369 volume 56.10031 ppm1 6.990 ppm2 7.292
 
! ############### hot_gnoesyNhsqc_051903.1370 NOT folded
assi (attr store1 < 6.633 and attr store1 > 6.533 ) 
     ((attr store1 < 7.016 and attr store1 > 6.956 ) and bondedto
      (attr store1 < 113.718  and attr store1 > 112.918 ))
6 0.1 0.1 peak 1370 volume 5.31412 ppm1 6.986 ppm2 6.583
 
! ############### hot_gnoesyNhsqc_051903.1371 NOT folded
assi (attr store1 < 7.8 and attr store1 > 7.7 ) 
     ((attr store1 < 8.003 and attr store1 > 7.943 ) and bondedto
      (attr store1 < 113.528  and attr store1 > 112.728 ))
6 0.1 0.1 peak 1371 volume 8.48333 ppm1 7.973 ppm2 7.750
 
! ############### hot_gnoesyNhsqc_051903.1372 NOT folded
assi (attr store1 < 8.966 and attr store1 > 8.866 ) 
     ((attr store1 < 7.775 and attr store1 > 7.715 ) and bondedto
      (attr store1 < 113.508  and attr store1 > 112.708 ))
6 0.1 0.1 peak 1372 volume 5.71457 ppm1 7.745 ppm2 8.916
 
! ############### hot_gnoesyNhsqc_051903.1373 NOT folded
assi (attr store1 < 7.036 and attr store1 > 6.936 ) 
     ((attr store1 < 7.775 and attr store1 > 7.715 ) and bondedto
      (attr store1 < 113.582  and attr store1 > 112.782 ))
6 0.1 0.1 peak 1373 volume 331.77121 ppm1 7.745 ppm2 6.986
 
! ############### hot_gnoesyNhsqc_051903.1374 NOT folded
assi (attr store1 < 7.03 and attr store1 > 6.93 ) 
     ((attr store1 < 7.329 and attr store1 > 7.269 ) and bondedto
      (attr store1 < 113.58  and attr store1 > 112.78 ))
6 0.1 0.1 peak 1374 volume 5.49838 ppm1 7.299 ppm2 6.980
 
! ############### hot_gnoesyNhsqc_051903.1375 NOT folded
assi (attr store1 < 7.027 and attr store1 > 6.927 ) 
     ((attr store1 < 7.234 and attr store1 > 7.174 ) and bondedto
      (attr store1 < 113.625  and attr store1 > 112.825 ))
6 0.1 0.1 peak 1375 volume 6.54362 ppm1 7.204 ppm2 6.977
 
! ############### hot_gnoesyNhsqc_051903.1376 NOT folded
assi (attr store1 < 7.8 and attr store1 > 7.7 ) 
     ((attr store1 < 7.174 and attr store1 > 7.114 ) and bondedto
      (attr store1 < 113.576  and attr store1 > 112.776 ))
6 0.1 0.1 peak 1376 volume 5.56136 ppm1 7.144 ppm2 7.750
 
! ############### hot_gnoesyNhsqc_051903.1377 NOT folded
assi (attr store1 < 8.972 and attr store1 > 8.872 ) 
     ((attr store1 < 7.016 and attr store1 > 6.956 ) and bondedto
      (attr store1 < 113.579  and attr store1 > 112.779 ))
6 0.1 0.1 peak 1377 volume 5.57066 ppm1 6.986 ppm2 8.922
 
! ############### hot_gnoesyNhsqc_051903.1378 NOT folded
assi (attr store1 < 7.795 and attr store1 > 7.695 ) 
     ((attr store1 < 7.017 and attr store1 > 6.957 ) and bondedto
      (attr store1 < 113.584  and attr store1 > 112.784 ))
6 0.1 0.1 peak 1378 volume 317.07526 ppm1 6.987 ppm2 7.745
 
! ############### hot_gnoesyNhsqc_051903.1379 NOT folded
assi (attr store1 < 7.036 and attr store1 > 6.936 ) 
     ((attr store1 < 7.018 and attr store1 > 6.958 ) and bondedto
      (attr store1 < 113.627  and attr store1 > 112.827 ))
6 0.1 0.1 peak 1379 volume 587.40448 ppm1 6.988 ppm2 6.986
 
! ############### hot_gnoesyNhsqc_051903.1380 NOT folded
assi (attr store1 < 8.37 and attr store1 > 8.27 ) 
     ((attr store1 < 8.318 and attr store1 > 8.258 ) and bondedto
      (attr store1 < 113.366  and attr store1 > 112.566 ))
6 0.1 0.1 peak 1380 volume 5.55996 ppm1 8.288 ppm2 8.320
 
! ############### hot_gnoesyNhsqc_051903.1381 NOT folded
assi (attr store1 < 6.995 and attr store1 > 6.895 ) 
     ((attr store1 < 7.882 and attr store1 > 7.822 ) and bondedto
      (attr store1 < 113.282  and attr store1 > 112.482 ))
6 0.1 0.1 peak 1381 volume 138.49658 ppm1 7.852 ppm2 6.945
 
! ############### hot_gnoesyNhsqc_051903.1382 NOT folded
assi (attr store1 < 8.509 and attr store1 > 8.409 ) 
     ((attr store1 < 7.785 and attr store1 > 7.725 ) and bondedto
      (attr store1 < 113.276  and attr store1 > 112.476 ))
6 0.1 0.1 peak 1382 volume 9.26183 ppm1 7.755 ppm2 8.459
 
! ############### hot_gnoesyNhsqc_051903.1383 NOT folded
assi (attr store1 < 7.798 and attr store1 > 7.698 ) 
     ((attr store1 < 7.781 and attr store1 > 7.721 ) and bondedto
      (attr store1 < 113.346  and attr store1 > 112.546 ))
6 0.1 0.1 peak 1383 volume 426.97836 ppm1 7.751 ppm2 7.748
 
! ############### hot_gnoesyNhsqc_051903.1384 NOT folded
assi (attr store1 < 7.531 and attr store1 > 7.431 ) 
     ((attr store1 < 7.784 and attr store1 > 7.724 ) and bondedto
      (attr store1 < 113.252  and attr store1 > 112.452 ))
6 0.1 0.1 peak 1384 volume 38.13548 ppm1 7.754 ppm2 7.481
 
! ############### hot_gnoesyNhsqc_051903.1385 NOT folded
assi (attr store1 < 8.236 and attr store1 > 8.136 ) 
     ((attr store1 < 7.631 and attr store1 > 7.571 ) and bondedto
      (attr store1 < 113.308  and attr store1 > 112.508 ))
6 0.1 0.1 peak 1385 volume 9.05321 ppm1 7.601 ppm2 8.186
 
! ############### hot_gnoesyNhsqc_051903.1386 NOT folded
assi (attr store1 < 7.654 and attr store1 > 7.554 ) 
     ((attr store1 < 7.632 and attr store1 > 7.572 ) and bondedto
      (attr store1 < 113.274  and attr store1 > 112.474 ))
6 0.1 0.1 peak 1386 volume 1162.33130 ppm1 7.602 ppm2 7.604
 
! ############### hot_gnoesyNhsqc_051903.1387 NOT folded
assi (attr store1 < 6.862 and attr store1 > 6.762 ) 
     ((attr store1 < 7.632 and attr store1 > 7.572 ) and bondedto
      (attr store1 < 113.288  and attr store1 > 112.488 ))
6 0.1 0.1 peak 1387 volume 828.11847 ppm1 7.602 ppm2 6.812
 
! ############### hot_gnoesyNhsqc_051903.1388 NOT folded
assi (attr store1 < 7.907 and attr store1 > 7.807 ) 
     ((attr store1 < 6.977 and attr store1 > 6.917 ) and bondedto
      (attr store1 < 113.28  and attr store1 > 112.48 ))
6 0.1 0.1 peak 1388 volume 141.46544 ppm1 6.947 ppm2 7.857
 
! ############### hot_gnoesyNhsqc_051903.1389 NOT folded
assi (attr store1 < 8.236 and attr store1 > 8.136 ) 
     ((attr store1 < 6.845 and attr store1 > 6.785 ) and bondedto
      (attr store1 < 113.225  and attr store1 > 112.425 ))
6 0.1 0.1 peak 1389 volume 6.24394 ppm1 6.815 ppm2 8.186
 
! ############### hot_gnoesyNhsqc_051903.1390 NOT folded
assi (attr store1 < 7.87 and attr store1 > 7.77 ) 
     ((attr store1 < 6.849 and attr store1 > 6.789 ) and bondedto
      (attr store1 < 113.247  and attr store1 > 112.447 ))
6 0.1 0.1 peak 1390 volume 9.02571 ppm1 6.819 ppm2 7.820
 
! ############### hot_gnoesyNhsqc_051903.1391 NOT folded
assi (attr store1 < 7.655 and attr store1 > 7.555 ) 
     ((attr store1 < 6.844 and attr store1 > 6.784 ) and bondedto
      (attr store1 < 113.285  and attr store1 > 112.485 ))
6 0.1 0.1 peak 1391 volume 775.75262 ppm1 6.814 ppm2 7.605
 
! ############### hot_gnoesyNhsqc_051903.1392 NOT folded
assi (attr store1 < 7.479 and attr store1 > 7.379 ) 
     ((attr store1 < 6.769 and attr store1 > 6.709 ) and bondedto
      (attr store1 < 113.392  and attr store1 > 112.592 ))
6 0.1 0.1 peak 1392 volume 10.63704 ppm1 6.739 ppm2 7.429
 
! ############### hot_gnoesyNhsqc_051903.1393 NOT folded
assi (attr store1 < 7.907 and attr store1 > 7.807 ) 
     ((attr store1 < 7.884 and attr store1 > 7.824 ) and bondedto
      (attr store1 < 113.111  and attr store1 > 112.311 ))
6 0.1 0.1 peak 1393 volume 142.19591 ppm1 7.854 ppm2 7.857
 
! ############### hot_gnoesyNhsqc_051903.1394 NOT folded
assi (attr store1 < 7.452 and attr store1 > 7.352 ) 
     ((attr store1 < 7.442 and attr store1 > 7.382 ) and bondedto
      (attr store1 < 113.181  and attr store1 > 112.381 ))
6 0.1 0.1 peak 1394 volume 10.20896 ppm1 7.412 ppm2 7.402
 
! ############### hot_gnoesyNhsqc_051903.1395 NOT folded
assi (attr store1 < 6.865 and attr store1 > 6.765 ) 
     ((attr store1 < 7.255 and attr store1 > 7.195 ) and bondedto
      (attr store1 < 113.051  and attr store1 > 112.251 ))
6 0.1 0.1 peak 1395 volume 5.35112 ppm1 7.225 ppm2 6.815
 
! ############### hot_gnoesyNhsqc_051903.1396 NOT folded
assi (attr store1 < 7.578 and attr store1 > 7.478 ) 
     ((attr store1 < 7.561 and attr store1 > 7.501 ) and bondedto
      (attr store1 < 112.803  and attr store1 > 112.003 ))
6 0.1 0.1 peak 1396 volume 2522.51807 ppm1 7.531 ppm2 7.528
 
! ############### hot_gnoesyNhsqc_051903.1397 NOT folded
assi (attr store1 < 6.876 and attr store1 > 6.776 ) 
     ((attr store1 < 7.561 and attr store1 > 7.501 ) and bondedto
      (attr store1 < 112.828  and attr store1 > 112.028 ))
6 0.1 0.1 peak 1397 volume 1046.43042 ppm1 7.531 ppm2 6.826
 
! ############### hot_gnoesyNhsqc_051903.1398 NOT folded
assi (attr store1 < 7.581 and attr store1 > 7.481 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.83  and attr store1 > 112.03 ))
6 0.1 0.1 peak 1398 volume 1038.01257 ppm1 6.829 ppm2 7.531
 
! ############### hot_gnoesyNhsqc_051903.1399 NOT folded
assi (attr store1 < 7.566 and attr store1 > 7.466 ) 
     ((attr store1 < 7.859 and attr store1 > 7.799 ) and bondedto
      (attr store1 < 112.684  and attr store1 > 111.884 ))
6 0.1 0.1 peak 1399 volume 6.32659 ppm1 7.829 ppm2 7.516
 
! ############### hot_gnoesyNhsqc_051903.1400 NOT folded
assi (attr store1 < 6.387 and attr store1 > 6.287 ) 
     ((attr store1 < 6.908 and attr store1 > 6.848 ) and bondedto
      (attr store1 < 112.674  and attr store1 > 111.874 ))
6 0.1 0.1 peak 1400 volume 29.22453 ppm1 6.878 ppm2 6.337
 
! ############### hot_gnoesyNhsqc_051903.1401 NOT folded
assi (attr store1 < 6.876 and attr store1 > 6.776 ) 
     ((attr store1 < 6.858 and attr store1 > 6.798 ) and bondedto
      (attr store1 < 112.731  and attr store1 > 111.931 ))
6 0.1 0.1 peak 1401 volume 2723.94800 ppm1 6.828 ppm2 6.826
 
! ############### hot_gnoesyNhsqc_051903.1402 NOT folded
assi (attr store1 < 7.376 and attr store1 > 7.276 ) 
     ((attr store1 < 6.372 and attr store1 > 6.312 ) and bondedto
      (attr store1 < 112.56  and attr store1 > 111.76 ))
6 0.1 0.1 peak 1402 volume 5.53055 ppm1 6.342 ppm2 7.326
 
! ############### hot_gnoesyNhsqc_051903.1403 NOT folded
assi (attr store1 < 6.926 and attr store1 > 6.826 ) 
     ((attr store1 < 6.371 and attr store1 > 6.311 ) and bondedto
      (attr store1 < 112.671  and attr store1 > 111.871 ))
6 0.1 0.1 peak 1403 volume 23.89958 ppm1 6.341 ppm2 6.876
 
! ############### hot_gnoesyNhsqc_051903.1404 NOT folded
assi (attr store1 < 6.393 and attr store1 > 6.293 ) 
     ((attr store1 < 6.371 and attr store1 > 6.311 ) and bondedto
      (attr store1 < 112.534  and attr store1 > 111.734 ))
6 0.1 0.1 peak 1404 volume 22.03838 ppm1 6.341 ppm2 6.343
 
! ############### hot_gnoesyNhsqc_051903.1405 NOT folded
assi (attr store1 < 6.862 and attr store1 > 6.762 ) 
     ((attr store1 < 8.018 and attr store1 > 7.958 ) and bondedto
      (attr store1 < 112.381  and attr store1 > 111.581 ))
6 0.1 0.1 peak 1405 volume 5.47883 ppm1 7.988 ppm2 6.812
 
! ############### hot_gnoesyNhsqc_051903.1406 NOT folded
assi (attr store1 < 6.863 and attr store1 > 6.763 ) 
     ((attr store1 < 7.937 and attr store1 > 7.877 ) and bondedto
      (attr store1 < 112.461  and attr store1 > 111.661 ))
6 0.1 0.1 peak 1406 volume 5.65682 ppm1 7.907 ppm2 6.813
 
! ############### hot_gnoesyNhsqc_051903.1407 NOT folded
assi (attr store1 < 7.904 and attr store1 > 7.804 ) 
     ((attr store1 < 7.658 and attr store1 > 7.598 ) and bondedto
      (attr store1 < 112.428  and attr store1 > 111.628 ))
6 0.1 0.1 peak 1407 volume 6.10682 ppm1 7.628 ppm2 7.854
 
! ############### hot_gnoesyNhsqc_051903.1408 NOT folded
assi (attr store1 < 7.682 and attr store1 > 7.582 ) 
     ((attr store1 < 7.661 and attr store1 > 7.601 ) and bondedto
      (attr store1 < 112.437  and attr store1 > 111.637 ))
6 0.1 0.1 peak 1408 volume 712.55835 ppm1 7.631 ppm2 7.632
 
! ############### hot_gnoesyNhsqc_051903.1409 NOT folded
assi (attr store1 < 6.875 and attr store1 > 6.775 ) 
     ((attr store1 < 7.659 and attr store1 > 7.599 ) and bondedto
      (attr store1 < 112.448  and attr store1 > 111.648 ))
6 0.1 0.1 peak 1409 volume 601.44653 ppm1 7.629 ppm2 6.825
 
! ############### hot_gnoesyNhsqc_051903.1410 NOT folded
assi (attr store1 < 7.963 and attr store1 > 7.863 ) 
     ((attr store1 < 7.542 and attr store1 > 7.482 ) and bondedto
      (attr store1 < 112.37  and attr store1 > 111.57 ))
6 0.1 0.1 peak 1410 volume 9.76016 ppm1 7.512 ppm2 7.913
 
! ############### hot_gnoesyNhsqc_051903.1411 NOT folded
assi (attr store1 < 6.957 and attr store1 > 6.857 ) 
     ((attr store1 < 7.542 and attr store1 > 7.482 ) and bondedto
      (attr store1 < 112.392  and attr store1 > 111.592 ))
6 0.1 0.1 peak 1411 volume 781.56476 ppm1 7.512 ppm2 6.907
 
! ############### hot_gnoesyNhsqc_051903.1412 NOT folded
assi (attr store1 < 7.902 and attr store1 > 7.802 ) 
     ((attr store1 < 7.504 and attr store1 > 7.444 ) and bondedto
      (attr store1 < 112.341  and attr store1 > 111.541 ))
6 0.1 0.1 peak 1412 volume 8.32491 ppm1 7.474 ppm2 7.852
 
! ############### hot_gnoesyNhsqc_051903.1413 NOT folded
assi (attr store1 < 7.524 and attr store1 > 7.424 ) 
     ((attr store1 < 7.504 and attr store1 > 7.444 ) and bondedto
      (attr store1 < 112.381  and attr store1 > 111.581 ))
6 0.1 0.1 peak 1413 volume 812.28650 ppm1 7.474 ppm2 7.474
 
! ############### hot_gnoesyNhsqc_051903.1414 NOT folded
assi (attr store1 < 6.814 and attr store1 > 6.714 ) 
     ((attr store1 < 7.501 and attr store1 > 7.441 ) and bondedto
      (attr store1 < 112.387  and attr store1 > 111.587 ))
6 0.1 0.1 peak 1414 volume 668.19727 ppm1 7.471 ppm2 6.764
 
! ############### hot_gnoesyNhsqc_051903.1415 NOT folded
assi (attr store1 < 6.894 and attr store1 > 6.794 ) 
     ((attr store1 < 7.253 and attr store1 > 7.193 ) and bondedto
      (attr store1 < 112.419  and attr store1 > 111.619 ))
6 0.1 0.1 peak 1415 volume 8.39858 ppm1 7.223 ppm2 6.844
 
! ############### hot_gnoesyNhsqc_051903.1416 NOT folded
assi (attr store1 < 7.553 and attr store1 > 7.453 ) 
     ((attr store1 < 7.234 and attr store1 > 7.174 ) and bondedto
      (attr store1 < 112.439  and attr store1 > 111.639 ))
6 0.1 0.1 peak 1416 volume 7.02570 ppm1 7.204 ppm2 7.503
 
! ############### hot_gnoesyNhsqc_051903.1417 NOT folded
assi (attr store1 < 6.869 and attr store1 > 6.769 ) 
     ((attr store1 < 7.211 and attr store1 > 7.151 ) and bondedto
      (attr store1 < 112.438  and attr store1 > 111.638 ))
6 0.1 0.1 peak 1417 volume 8.96585 ppm1 7.181 ppm2 6.819
 
! ############### hot_gnoesyNhsqc_051903.1418 NOT folded
assi (attr store1 < 7.531 and attr store1 > 7.431 ) 
     ((attr store1 < 7.159 and attr store1 > 7.099 ) and bondedto
      (attr store1 < 112.425  and attr store1 > 111.625 ))
6 0.1 0.1 peak 1418 volume 6.31301 ppm1 7.129 ppm2 7.481
 
! ############### hot_gnoesyNhsqc_051903.1419 NOT folded
assi (attr store1 < 6.88 and attr store1 > 6.78 ) 
     ((attr store1 < 7.157 and attr store1 > 7.097 ) and bondedto
      (attr store1 < 112.432  and attr store1 > 111.632 ))
6 0.1 0.1 peak 1419 volume 9.92596 ppm1 7.127 ppm2 6.830
 
! ############### hot_gnoesyNhsqc_051903.1420 NOT folded
assi (attr store1 < 6.908 and attr store1 > 6.808 ) 
     ((attr store1 < 7.123 and attr store1 > 7.063 ) and bondedto
      (attr store1 < 112.44  and attr store1 > 111.64 ))
6 0.1 0.1 peak 1420 volume 10.41080 ppm1 7.093 ppm2 6.858
 
! ############### hot_gnoesyNhsqc_051903.1421 NOT folded
assi (attr store1 < 7.553 and attr store1 > 7.453 ) 
     ((attr store1 < 7.107 and attr store1 > 7.047 ) and bondedto
      (attr store1 < 112.438  and attr store1 > 111.638 ))
6 0.1 0.1 peak 1421 volume 7.90632 ppm1 7.077 ppm2 7.503
 
! ############### hot_gnoesyNhsqc_051903.1422 NOT folded
assi (attr store1 < 7.563 and attr store1 > 7.463 ) 
     ((attr store1 < 6.941 and attr store1 > 6.881 ) and bondedto
      (attr store1 < 112.391  and attr store1 > 111.591 ))
6 0.1 0.1 peak 1422 volume 743.32019 ppm1 6.911 ppm2 7.513
 
! ############### hot_gnoesyNhsqc_051903.1423 NOT folded
assi (attr store1 < 7.103 and attr store1 > 7.003 ) 
     ((attr store1 < 6.94 and attr store1 > 6.88 ) and bondedto
      (attr store1 < 112.412  and attr store1 > 111.612 ))
6 0.1 0.1 peak 1423 volume 13.65130 ppm1 6.910 ppm2 7.053
 
! ############### hot_gnoesyNhsqc_051903.1424 NOT folded
assi (attr store1 < 6.957 and attr store1 > 6.857 ) 
     ((attr store1 < 6.94 and attr store1 > 6.88 ) and bondedto
      (attr store1 < 112.377  and attr store1 > 111.577 ))
6 0.1 0.1 peak 1424 volume 1231.09387 ppm1 6.910 ppm2 6.907
 
! ############### hot_gnoesyNhsqc_051903.1425 NOT folded
assi (attr store1 < 7.68 and attr store1 > 7.58 ) 
     ((attr store1 < 6.858 and attr store1 > 6.798 ) and bondedto
      (attr store1 < 112.458  and attr store1 > 111.658 ))
6 0.1 0.1 peak 1425 volume 599.91931 ppm1 6.828 ppm2 7.630
 
! ############### hot_gnoesyNhsqc_051903.1426 NOT folded
assi (attr store1 < 7.221 and attr store1 > 7.121 ) 
     ((attr store1 < 6.86 and attr store1 > 6.8 ) and bondedto
      (attr store1 < 112.4  and attr store1 > 111.6 ))
6 0.1 0.1 peak 1426 volume 10.37224 ppm1 6.830 ppm2 7.171
 
! ############### hot_gnoesyNhsqc_051903.1427 NOT folded
assi (attr store1 < 7.119 and attr store1 > 7.019 ) 
     ((attr store1 < 6.858 and attr store1 > 6.798 ) and bondedto
      (attr store1 < 112.467  and attr store1 > 111.667 ))
6 0.1 0.1 peak 1427 volume 11.98835 ppm1 6.828 ppm2 7.069
 
! ############### hot_gnoesyNhsqc_051903.1428 NOT folded
assi (attr store1 < 6.735 and attr store1 > 6.635 ) 
     ((attr store1 < 6.857 and attr store1 > 6.797 ) and bondedto
      (attr store1 < 112.436  and attr store1 > 111.636 ))
6 0.1 0.1 peak 1428 volume 38.71739 ppm1 6.827 ppm2 6.685
 
! ############### hot_gnoesyNhsqc_051903.1429 NOT folded
assi (attr store1 < 6.642 and attr store1 > 6.542 ) 
     ((attr store1 < 6.857 and attr store1 > 6.797 ) and bondedto
      (attr store1 < 112.39  and attr store1 > 111.59 ))
6 0.1 0.1 peak 1429 volume 11.15539 ppm1 6.827 ppm2 6.592
 
! ############### hot_gnoesyNhsqc_051903.1430 NOT folded
assi (attr store1 < 8.19 and attr store1 > 8.09 ) 
     ((attr store1 < 6.852 and attr store1 > 6.792 ) and bondedto
      (attr store1 < 112.4  and attr store1 > 111.6 ))
6 0.1 0.1 peak 1430 volume 5.24869 ppm1 6.822 ppm2 8.140
 
! ############### hot_gnoesyNhsqc_051903.1431 NOT folded
assi (attr store1 < 7.903 and attr store1 > 7.803 ) 
     ((attr store1 < 6.796 and attr store1 > 6.736 ) and bondedto
      (attr store1 < 112.349  and attr store1 > 111.549 ))
6 0.1 0.1 peak 1431 volume 7.20508 ppm1 6.766 ppm2 7.853
 
! ############### hot_gnoesyNhsqc_051903.1432 NOT folded
assi (attr store1 < 7.522 and attr store1 > 7.422 ) 
     ((attr store1 < 6.793 and attr store1 > 6.733 ) and bondedto
      (attr store1 < 112.386  and attr store1 > 111.586 ))
6 0.1 0.1 peak 1432 volume 641.63660 ppm1 6.763 ppm2 7.472
 
! ############### hot_gnoesyNhsqc_051903.1433 NOT folded
assi (attr store1 < 6.814 and attr store1 > 6.714 ) 
     ((attr store1 < 6.793 and attr store1 > 6.733 ) and bondedto
      (attr store1 < 112.369  and attr store1 > 111.569 ))
6 0.1 0.1 peak 1433 volume 802.47821 ppm1 6.763 ppm2 6.764
 
! ############### hot_gnoesyNhsqc_051903.1434 NOT folded
assi (attr store1 < 6.879 and attr store1 > 6.779 ) 
     ((attr store1 < 6.562 and attr store1 > 6.502 ) and bondedto
      (attr store1 < 112.315  and attr store1 > 111.515 ))
6 0.1 0.1 peak 1434 volume 5.18393 ppm1 6.532 ppm2 6.829
 
! ############### hot_gnoesyNhsqc_051903.1435 NOT folded
assi (attr store1 < 7.976 and attr store1 > 7.876 ) 
     ((attr store1 < 7.954 and attr store1 > 7.894 ) and bondedto
      (attr store1 < 112.109  and attr store1 > 111.309 ))
6 0.1 0.1 peak 1435 volume 7.68152 ppm1 7.924 ppm2 7.926
 
! ############### hot_gnoesyNhsqc_051903.1436 NOT folded
assi (attr store1 < 7.447 and attr store1 > 7.347 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.171  and attr store1 > 111.371 ))
6 0.1 0.1 peak 1436 volume 1505.64917 ppm1 7.399 ppm2 7.397
 
! ############### hot_gnoesyNhsqc_051903.1437 NOT folded
assi (attr store1 < 7.307 and attr store1 > 7.207 ) 
     ((attr store1 < 7.428 and attr store1 > 7.368 ) and bondedto
      (attr store1 < 112.205  and attr store1 > 111.405 ))
6 0.1 0.1 peak 1437 volume 20.66505 ppm1 7.398 ppm2 7.257
 
! ############### hot_gnoesyNhsqc_051903.1438 NOT folded
assi (attr store1 < 7.214 and attr store1 > 7.114 ) 
     ((attr store1 < 7.428 and attr store1 > 7.368 ) and bondedto
      (attr store1 < 112.19  and attr store1 > 111.39 ))
6 0.1 0.1 peak 1438 volume 7.50098 ppm1 7.398 ppm2 7.164
 
! ############### hot_gnoesyNhsqc_051903.1439 NOT folded
assi (attr store1 < 7.125 and attr store1 > 7.025 ) 
     ((attr store1 < 7.427 and attr store1 > 7.367 ) and bondedto
      (attr store1 < 112.258  and attr store1 > 111.458 ))
6 0.1 0.1 peak 1439 volume 5.71477 ppm1 7.397 ppm2 7.075
 
! ############### hot_gnoesyNhsqc_051903.1440 NOT folded
assi (attr store1 < 7.029 and attr store1 > 6.929 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.211  and attr store1 > 111.411 ))
6 0.1 0.1 peak 1440 volume 12.90273 ppm1 7.399 ppm2 6.979
 
! ############### hot_gnoesyNhsqc_051903.1441 NOT folded
assi (attr store1 < 6.878 and attr store1 > 6.778 ) 
     ((attr store1 < 7.429 and attr store1 > 7.369 ) and bondedto
      (attr store1 < 112.184  and attr store1 > 111.384 ))
6 0.1 0.1 peak 1441 volume 882.57404 ppm1 7.399 ppm2 6.828
 
! ############### hot_gnoesyNhsqc_051903.1442 NOT folded
assi (attr store1 < 7.449 and attr store1 > 7.349 ) 
     ((attr store1 < 7.158 and attr store1 > 7.098 ) and bondedto
      (attr store1 < 112.188  and attr store1 > 111.388 ))
6 0.1 0.1 peak 1442 volume 5.11704 ppm1 7.128 ppm2 7.399
 
! ############### hot_gnoesyNhsqc_051903.1443 NOT folded
assi (attr store1 < 7.446 and attr store1 > 7.346 ) 
     ((attr store1 < 6.86 and attr store1 > 6.8 ) and bondedto
      (attr store1 < 112.183  and attr store1 > 111.383 ))
6 0.1 0.1 peak 1443 volume 913.78137 ppm1 6.830 ppm2 7.396
 
! ############### hot_gnoesyNhsqc_051903.1444 NOT folded
assi (attr store1 < 7.306 and attr store1 > 7.206 ) 
     ((attr store1 < 6.859 and attr store1 > 6.799 ) and bondedto
      (attr store1 < 112.226  and attr store1 > 111.426 ))
6 0.1 0.1 peak 1444 volume 17.53030 ppm1 6.829 ppm2 7.256
 
! ############### hot_gnoesyNhsqc_051903.1445 NOT folded
assi (attr store1 < 8.404 and attr store1 > 8.304 ) 
     ((attr store1 < 8.306 and attr store1 > 8.246 ) and bondedto
      (attr store1 < 111.862  and attr store1 > 111.062 ))
6 0.1 0.1 peak 1445 volume 6.07539 ppm1 8.276 ppm2 8.354
 
! ############### hot_gnoesyNhsqc_051903.1446 NOT folded
assi (attr store1 < 7.796 and attr store1 > 7.696 ) 
     ((attr store1 < 7.779 and attr store1 > 7.719 ) and bondedto
      (attr store1 < 111.883  and attr store1 > 111.083 ))
6 0.1 0.1 peak 1446 volume 9.20628 ppm1 7.749 ppm2 7.746
 
! ############### hot_gnoesyNhsqc_051903.1447 NOT folded
assi (attr store1 < 8.225 and attr store1 > 8.125 ) 
     ((attr store1 < 8.5 and attr store1 > 8.44 ) and bondedto
      (attr store1 < 110.716  and attr store1 > 109.916 ))
6 0.1 0.1 peak 1447 volume 7.43125 ppm1 8.470 ppm2 8.175
 
! ############### hot_gnoesyNhsqc_051903.1448 NOT folded
assi (attr store1 < 8.493 and attr store1 > 8.393 ) 
     ((attr store1 < 8.347 and attr store1 > 8.287 ) and bondedto
      (attr store1 < 110.786  and attr store1 > 109.986 ))
6 0.1 0.1 peak 1448 volume 5.90491 ppm1 8.317 ppm2 8.443
 
! ############### hot_gnoesyNhsqc_051903.1449 NOT folded
assi (attr store1 < 8.517 and attr store1 > 8.417 ) 
     ((attr store1 < 8.499 and attr store1 > 8.439 ) and bondedto
      (attr store1 < 110.65  and attr store1 > 109.85 ))
6 0.1 0.1 peak 1449 volume 181.21529 ppm1 8.469 ppm2 8.467
 
! ############### hot_gnoesyNhsqc_051903.1450 NOT folded
assi (attr store1 < 7.992 and attr store1 > 7.892 ) 
     ((attr store1 < 7.965 and attr store1 > 7.905 ) and bondedto
      (attr store1 < 110.535  and attr store1 > 109.735 ))
6 0.1 0.1 peak 1450 volume 6.13026 ppm1 7.935 ppm2 7.942
 
! ############### hot_gnoesyNhsqc_051903.1451 NOT folded
assi (attr store1 < 7.566 and attr store1 > 7.466 ) 
     ((attr store1 < 7.545 and attr store1 > 7.485 ) and bondedto
      (attr store1 < 110.513  and attr store1 > 109.713 ))
6 0.1 0.1 peak 1451 volume 11.38531 ppm1 7.515 ppm2 7.516
 
! ############### hot_gnoesyNhsqc_051903.1452 NOT folded
assi (attr store1 < 7.438 and attr store1 > 7.338 ) 
     ((attr store1 < 7.426 and attr store1 > 7.366 ) and bondedto
      (attr store1 < 110.538  and attr store1 > 109.738 ))
6 0.1 0.1 peak 1452 volume 8.41747 ppm1 7.396 ppm2 7.388
 
! ############### hot_gnoesyNhsqc_051903.1453 NOT folded
assi (attr store1 < 6.867 and attr store1 > 6.767 ) 
     ((attr store1 < 6.849 and attr store1 > 6.789 ) and bondedto
      (attr store1 < 110.201  and attr store1 > 109.401 ))
6 0.1 0.1 peak 1453 volume 15.24496 ppm1 6.819 ppm2 6.817
 
! ############### hot_gnoesyNhsqc_051903.1454 NOT folded
assi (attr store1 < 8.492 and attr store1 > 8.392 ) 
     ((attr store1 < 8.494 and attr store1 > 8.434 ) and bondedto
      (attr store1 < 109.966  and attr store1 > 109.166 ))
6 0.1 0.1 peak 1454 volume 5.47565 ppm1 8.464 ppm2 8.442
 
! ############### hot_gnoesyNhsqc_051903.1455 NOT folded
assi (attr store1 < 8.388 and attr store1 > 8.288 ) 
     ((attr store1 < 8.363 and attr store1 > 8.303 ) and bondedto
      (attr store1 < 109.857  and attr store1 > 109.057 ))
6 0.1 0.1 peak 1455 volume 97.92380 ppm1 8.333 ppm2 8.338
 
! ############### hot_gnoesyNhsqc_051903.1456 NOT folded
assi (attr store1 < 8.037 and attr store1 > 7.937 ) 
     ((attr store1 < 8.363 and attr store1 > 8.303 ) and bondedto
      (attr store1 < 109.87  and attr store1 > 109.07 ))
6 0.1 0.1 peak 1456 volume 26.34464 ppm1 8.333 ppm2 7.987
 
! ############### hot_gnoesyNhsqc_051903.1457 NOT folded
assi (attr store1 < 8.057 and attr store1 > 7.957 ) 
     ((attr store1 < 7.987 and attr store1 > 7.927 ) and bondedto
      (attr store1 < 109.789  and attr store1 > 108.989 ))
6 0.1 0.1 peak 1457 volume 5.09708 ppm1 7.957 ppm2 8.007
 
! ############### hot_gnoesyNhsqc_051903.1458 NOT folded
assi (attr store1 < 7.566 and attr store1 > 7.466 ) 
     ((attr store1 < 7.548 and attr store1 > 7.488 ) and bondedto
      (attr store1 < 109.642  and attr store1 > 108.842 ))
6 0.1 0.1 peak 1458 volume 7.97339 ppm1 7.518 ppm2 7.516
 
! ############### hot_gnoesyNhsqc_051903.1459 NOT folded
assi (attr store1 < 6.862 and attr store1 > 6.762 ) 
     ((attr store1 < 6.847 and attr store1 > 6.787 ) and bondedto
      (attr store1 < 109.149  and attr store1 > 108.349 ))
6 0.1 0.1 peak 1459 volume 9.60510 ppm1 6.817 ppm2 6.812
 
! ############### hot_gnoesyNhsqc_051903.1460 NOT folded
assi (attr store1 < 8.645 and attr store1 > 8.545 ) 
     ((attr store1 < 7.952 and attr store1 > 7.892 ) and bondedto
      (attr store1 < 116.114  and attr store1 > 115.314 ))
6 0.1 0.1 peak 1460 volume 7.18622 ppm1 7.922 ppm2 8.595
 
! ############### hot_gnoesyNhsqc_051903.1465 NOT folded
assi (attr store1 < 8.491 and attr store1 > 8.391 ) 
     ((attr store1 < 6.854 and attr store1 > 6.794 ) and bondedto
      (attr store1 < 112.875  and attr store1 > 112.075 ))
6 0.1 0.1 peak 1465 volume 3.33659 ppm1 6.824 ppm2 8.441
 
! ############### hot_gnoesyNhsqc_051903.1466 NOT folded
assi (attr store1 < 8.673 and attr store1 > 8.573 ) 
     ((attr store1 < 6.854 and attr store1 > 6.794 ) and bondedto
      (attr store1 < 112.875  and attr store1 > 112.075 ))
6 0.1 0.1 peak 1466 volume 3.07708 ppm1 6.824 ppm2 8.623
 
! ############### hot_gnoesyNhsqc_051903.1467 NOT folded
assi (attr store1 < 8.233 and attr store1 > 8.133 ) 
     ((attr store1 < 6.848 and attr store1 > 6.788 ) and bondedto
      (attr store1 < 112.875  and attr store1 > 112.075 ))
6 0.1 0.1 peak 1467 volume 4.12688 ppm1 6.818 ppm2 8.183
 
! ############### hot_gnoesyNhsqc_051903.1468 NOT folded
assi (attr store1 < 4.043 and attr store1 > 3.943 ) 
     ((attr store1 < 7.658 and attr store1 > 7.598 ) and bondedto
      (attr store1 < 112.412  and attr store1 > 111.612 ))
6 0.1 0.1 peak 1468 volume 4.70392 ppm1 7.628 ppm2 3.993
 
! ############### hot_gnoesyNhsqc_051903.1469 NOT folded
assi (attr store1 < 1.483 and attr store1 > 1.383 ) 
     ((attr store1 < 7.663 and attr store1 > 7.603 ) and bondedto
      (attr store1 < 112.412  and attr store1 > 111.612 ))
6 0.1 0.1 peak 1469 volume 4.25600 ppm1 7.633 ppm2 1.433
 
! ############### hot_gnoesyNhsqc_051903.1470 folded
! ############### hot_gnoesyNhsqc_051903.1471 NOT folded
assi (attr store1 < 4.587 and attr store1 > 4.487 ) 
     ((attr store1 < 6.853 and attr store1 > 6.793 ) and bondedto
      (attr store1 < 112.412  and attr store1 > 111.612 ))
6 0.1 0.1 peak 1471 volume 3.47762 ppm1 6.823 ppm2 4.537
 
! ############### hot_gnoesyNhsqc_051903.1473 NOT folded
assi (attr store1 < 7.242 and attr store1 > 7.142 ) 
     ((attr store1 < 8.622 and attr store1 > 8.562 ) and bondedto
      (attr store1 < 128.145  and attr store1 > 127.345 ))
6 0.1 0.1 peak 1473 volume 3.48270 ppm1 8.592 ppm2 7.192
 
! ############### hot_gnoesyNhsqc_051903.1474 NOT folded
assi (attr store1 < 7.0 and attr store1 > 6.9 ) 
     ((attr store1 < 7.767 and attr store1 > 7.707 ) and bondedto
      (attr store1 < 120.279  and attr store1 > 119.479 ))
6 0.1 0.1 peak 1474 volume 3.65235 ppm1 7.737 ppm2 6.950
 
! ############### hot_gnoesyNhsqc_051903.1475 folded
! ############### hot_gnoesyNhsqc_051903.1476 NOT folded
assi (attr store1 < 0.814 and attr store1 > 0.714 ) 
     ((attr store1 < 8.642 and attr store1 > 8.582 ) and bondedto
      (attr store1 < 124.212  and attr store1 > 123.412 ))
6 0.1 0.1 peak 1476 volume 5.04341 ppm1 8.612 ppm2 0.764
 
! ############### hot_gnoesyNhsqc_051903.1477 NOT folded
assi (attr store1 < 6.47 and attr store1 > 6.37 ) 
     ((attr store1 < 7.894 and attr store1 > 7.834 ) and bondedto
      (attr store1 < 120.741  and attr store1 > 119.941 ))
6 0.1 0.1 peak 1477 volume 4.31264 ppm1 7.864 ppm2 6.420
 
! ############### hot_gnoesyNhsqc_051903.1484 NOT folded
assi (attr store1 < 1.056 and attr store1 > 0.956 ) 
     ((attr store1 < 9.359 and attr store1 > 9.299 ) and bondedto
      (attr store1 < 132.772  and attr store1 > 131.972 ))
6 0.1 0.1 peak 1484 volume 18.32133 ppm1 9.329 ppm2 1.006
 
! ############### hot_gnoesyNhsqc_051903.1487 NOT folded
assi (attr store1 < 7.159 and attr store1 > 7.059 ) 
     ((attr store1 < 8.455 and attr store1 > 8.395 ) and bondedto
      (attr store1 < 118.89  and attr store1 > 118.09 ))
6 0.1 0.1 peak 1487 volume 4.76965 ppm1 8.425 ppm2 7.109
 
! ############### hot_gnoesyNhsqc_051903.1488 NOT folded
assi (attr store1 < 7.174 and attr store1 > 7.074 ) 
     ((attr store1 < 8.65 and attr store1 > 8.59 ) and bondedto
      (attr store1 < 124.212  and attr store1 > 123.412 ))
6 0.1 0.1 peak 1488 volume 4.94415 ppm1 8.620 ppm2 7.124
 
! ############### hot_gnoesyNhsqc_051903.1489 NOT folded
assi (attr store1 < 7.797 and attr store1 > 7.697 ) 
     ((attr store1 < 8.779 and attr store1 > 8.719 ) and bondedto
      (attr store1 < 121.898  and attr store1 > 121.098 ))
6 0.1 0.1 peak 1489 volume 4.05394 ppm1 8.749 ppm2 7.747
 
! ############### hot_gnoesyNhsqc_051903.1490 NOT folded
assi (attr store1 < 6.975 and attr store1 > 6.875 ) 
     ((attr store1 < 8.782 and attr store1 > 8.722 ) and bondedto
      (attr store1 < 121.898  and attr store1 > 121.098 ))
6 0.1 0.1 peak 1490 volume 4.48671 ppm1 8.752 ppm2 6.925
 
! ############### hot_gnoesyNhsqc_051903.1491 NOT folded
assi (attr store1 < 7.14 and attr store1 > 7.04 ) 
     ((attr store1 < 8.781 and attr store1 > 8.721 ) and bondedto
      (attr store1 < 121.898  and attr store1 > 121.098 ))
6 0.1 0.1 peak 1491 volume 4.06605 ppm1 8.751 ppm2 7.090
 
! ############### hot_gnoesyNhsqc_051903.1492 NOT folded
assi (attr store1 < 7.321 and attr store1 > 7.221 ) 
     ((attr store1 < 8.786 and attr store1 > 8.726 ) and bondedto
      (attr store1 < 121.898  and attr store1 > 121.098 ))
6 0.1 0.1 peak 1492 volume 4.97108 ppm1 8.756 ppm2 7.271
 
! ############ hot_mothernoesy_072403.192 assigned
assi (resid 32 and name HA)
     (resid 32 and name HB#)
6 0.1 0.1 peak 192 volume -4.98650 ppm1 4.178 ppm2 1.569
 
! ############ hot_mothernoesy_072403.194 assigned
assi (resid 32 and name HA)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 194 volume -12.76160 ppm1 4.174 ppm2 0.615
 
! ############ hot_mothernoesy_072403.196 assigned
assi (resid 32 and name HA)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 196 volume -4.54530 ppm1 4.163 ppm2 0.157
 
! ############ hot_mothernoesy_072403.269 assigned
assi (resid 16 and name HD#)
     (resid 16 and name HE#)
6 0.1 0.1 peak 269 volume 6.68780 ppm1 1.362 ppm2 2.334
 
! ############ hot_mothernoesy_072403.272 assigned
assi (resid 16 and name HD#)
     (resid 16 and name HE#)
6 0.1 0.1 peak 272 volume 5.77910 ppm1 1.261 ppm2 2.336
 
! ############ hot_mothernoesy_072403.273 assigned
assi (resid 16 and name HD#)
     (resid 16 and name HB#)
6 0.1 0.1 peak 273 volume 7.57780 ppm1 1.257 ppm2 1.833
 
! ############ hot_mothernoesy_072403.274 assigned
assi (resid 16 and name HD#)
     (resid 16 and name HD#)
6 0.1 0.1 peak 274 volume 36.38170 ppm1 1.257 ppm2 1.366
 
! ############ hot_mothernoesy_072403.276 assigned
assi (resid 16 and name HD#)
     (resid 16 and name HG#)
6 0.1 0.1 peak 276 volume 6.47490 ppm1 1.259 ppm2 0.762
 
! ############ hot_mothernoesy_072403.402 assigned
assi (resid 32 and name HG)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 402 volume 6.74480 ppm1 1.241 ppm2 0.158
 
! ############ hot_mothernoesy_072403.410 assigned
assi (resid 32 and name HG)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 410 volume 9.26380 ppm1 1.237 ppm2 0.611
 
! ############ hot_mothernoesy_072403.411 assigned
assi (resid 32 and name HG)
     (resid 32 and name HA)
6 0.1 0.1 peak 411 volume 3.33400 ppm1 1.231 ppm2 4.169
 
! ############ hot_mothernoesy_072403.435 assigned
assi (resid 16 and name HG#)
     (resid 16 and name HA)
6 0.1 0.1 peak 435 volume 3.64090 ppm1 0.756 ppm2 3.848
 
! ############ hot_mothernoesy_072403.436 assigned
assi (resid 16 and name HG#)
     (resid 16 and name HE#)
6 0.1 0.1 peak 436 volume 3.54360 ppm1 0.756 ppm2 2.336
 
! ############ hot_mothernoesy_072403.453 assigned
assi (resid 57 and name HG)
     (resid 57 and name HA)
6 0.1 0.1 peak 453 volume 7.10980 ppm1 0.900 ppm2 3.890
 
! ############ hot_mothernoesy_072403.454 assigned
assi (resid 57 and name HG)
     (resid 57 and name HB#)
6 0.1 0.1 peak 454 volume 14.24430 ppm1 0.904 ppm2 1.826
 
! ############ hot_mothernoesy_072403.475 assigned
assi (resid 68 and name HD#)
     (resid 67 and name HA)
6 0.1 0.1 peak 475 volume -18.94600 ppm1 3.612 ppm2 4.660
 
! ############ hot_mothernoesy_072403.476 assigned
assi (resid 68 and name HD#)
     (resid 68 and name HD#)
6 0.1 0.1 peak 476 volume -47.18930 ppm1 3.612 ppm2 3.908
 
! ############ hot_mothernoesy_072403.478 assigned
assi (resid 68 and name HD#)
     (resid 68 and name HB#)
6 0.1 0.1 peak 478 volume -4.52460 ppm1 3.615 ppm2 2.322
 
! ############ hot_mothernoesy_072403.479 assigned
assi (resid 68 and name HD#)
     (resid 68 and name HG#)
6 0.1 0.1 peak 479 volume -18.83580 ppm1 3.612 ppm2 2.058
 
! ############ hot_mothernoesy_072403.484 assigned
assi (resid 68 and name HD#)
     (resid 67 and name HD1#)
6 0.1 0.1 peak 484 volume -8.77660 ppm1 3.612 ppm2 0.912
 
! ############ hot_mothernoesy_072403.488 assigned
assi (resid 68 and name HD#)
     (resid 67 and name HD1#)
6 0.1 0.1 peak 488 volume -8.37590 ppm1 3.908 ppm2 0.913
 
! ############ hot_mothernoesy_072403.491 assigned
assi (resid 68 and name HD#)
     (resid 68 and name HB#)
6 0.1 0.1 peak 491 volume -7.59390 ppm1 3.613 ppm2 1.907
 
! ############ hot_mothernoesy_072403.522 assigned
assi (resid 67 and name HD2#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 522 volume 5.26750 ppm1 0.992 ppm2 0.615
 
! ############ hot_mothernoesy_072403.523 assigned
assi (resid 67 and name HD2#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 523 volume 4.76950 ppm1 0.987 ppm2 0.156
 
! ############ hot_mothernoesy_072403.549 assigned
assi (resid 26 and name HG2#)
     (resid 26 and name HA)
6 0.1 0.1 peak 549 volume 12.32240 ppm1 1.389 ppm2 3.500
 
! ############ hot_mothernoesy_072403.550 assigned
assi (resid 26 and name HG2#)
     (resid 26 and name HB)
6 0.1 0.1 peak 550 volume 11.67160 ppm1 1.388 ppm2 2.280
 
! ############ hot_mothernoesy_072403.552 assigned
assi (resid 26 and name HG2#)
     (resid 26 and name HG1#)
6 0.1 0.1 peak 552 volume 59.96430 ppm1 1.388 ppm2 0.971
 
! ############ hot_mothernoesy_072403.553 assigned
assi (resid 26 and name HG2#)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 553 volume 18.08970 ppm1 1.388 ppm2 0.729
 
! ############ hot_mothernoesy_072403.563 assigned
assi (resid 32 and name HD2#)
     (resid 64 and name HA)
6 0.1 0.1 peak 563 volume 4.03090 ppm1 0.158 ppm2 4.289
 
! ############ hot_mothernoesy_072403.564 assigned
assi (resid 32 and name HD2#)
     (resid 32 and name HA)
6 0.1 0.1 peak 564 volume 6.19070 ppm1 0.156 ppm2 4.173
 
! ############ hot_mothernoesy_072403.565 assigned
assi (resid 32 and name HD2#)
     (resid 29 and name HA)
6 0.1 0.1 peak 565 volume 3.40070 ppm1 0.158 ppm2 3.577
 
! ############ hot_mothernoesy_072403.567 assigned
assi (resid 32 and name HD2#)
     (resid 32 and name HB#)
6 0.1 0.1 peak 567 volume 17.40130 ppm1 0.158 ppm2 1.575
 
! ############ hot_mothernoesy_072403.569 assigned
assi (resid 32 and name HD2#)
     (resid 32 and name HG)
6 0.1 0.1 peak 569 volume 14.69860 ppm1 0.158 ppm2 1.235
 
! ############ hot_mothernoesy_072403.572 assigned
assi (resid 32 and name HD2#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 572 volume 36.53590 ppm1 0.158 ppm2 0.609
 
! ############ hot_mothernoesy_072403.579 assigned
assi (resid 21 and name HD1#)
     (resid 21 and name HB#)
6 0.1 0.1 peak 579 volume 22.05340 ppm1 0.988 ppm2 2.039
 
! ############ hot_mothernoesy_072403.654 assigned
assi (resid 67 and name HD1#)
     (resid 67 and name HA)
6 0.1 0.1 peak 654 volume 28.06950 ppm1 0.913 ppm2 4.662
 
! ############ hot_mothernoesy_072403.655 assigned
assi (resid 67 and name HD1#)
     (resid 68 and name HD#)
6 0.1 0.1 peak 655 volume 9.75430 ppm1 0.914 ppm2 3.909
 
! ############ hot_mothernoesy_072403.660 assigned
assi (resid 67 and name HD1#)
     (resid 68 and name HD#)
6 0.1 0.1 peak 660 volume 9.88590 ppm1 0.912 ppm2 3.612
 
! ############ hot_mothernoesy_072403.664 assigned
assi (resid 67 and name HD1#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 664 volume 15.36730 ppm1 0.913 ppm2 0.611
 
! ############ hot_mothernoesy_072403.665 assigned
assi (resid 67 and name HD1#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 665 volume 5.93640 ppm1 0.911 ppm2 0.160
 
! ############ hot_mothernoesy_072403.692 assigned
assi (resid 36 and name HG2#)
     (resid 36 and name HA)
6 0.1 0.1 peak 692 volume 14.55920 ppm1 1.013 ppm2 4.252
 
! ############ hot_mothernoesy_072403.694 assigned
assi (resid 36 and name HG2#)
     (resid 36 and name HB)
6 0.1 0.1 peak 694 volume 14.82360 ppm1 1.013 ppm2 2.339
 
! ############ hot_mothernoesy_072403.707 assigned
assi (resid 65 and name HD1#)
     (resid 65 and name HG)
6 0.1 0.1 peak 707 volume 24.54080 ppm1 0.904 ppm2 1.658
 
! ############ hot_mothernoesy_072403.713 assigned
assi (resid 26 and name HG1#)
     (resid 26 and name HG2#)
6 0.1 0.1 peak 713 volume 30.74980 ppm1 0.941 ppm2 1.389
 
! ############ hot_mothernoesy_072403.715 assigned
assi (resid 65 and name HD1#)
     (resid 65 and name HA)
6 0.1 0.1 peak 715 volume 37.94710 ppm1 0.903 ppm2 4.279
 
! ############ hot_mothernoesy_072403.717 assigned
assi (resid 65 and name HD1#)
     (resid 65 and name HB#)
6 0.1 0.1 peak 717 volume 51.83160 ppm1 0.903 ppm2 1.814
 
! ############ hot_mothernoesy_072403.721 assigned
assi (resid 41 and name HG2#)
     (resid 41 and name HA)
6 0.1 0.1 peak 721 volume 10.47250 ppm1 0.729 ppm2 3.531
 
! ############ hot_mothernoesy_072403.722 assigned
assi (resid 41 and name HG2#)
     (resid 44 and name HG#)
6 0.1 0.1 peak 722 volume 3.89780 ppm1 0.730 ppm2 2.292
 
! ############ hot_mothernoesy_072403.725 assigned
assi (resid 41 and name HG2#)
     (resid 22 and name HB#)
6 0.1 0.1 peak 725 volume 9.20560 ppm1 0.729 ppm2 1.678
 
! ############ hot_mothernoesy_072403.726 assigned
assi (resid 41 and name HG2#)
     (resid 26 and name HG2#)
6 0.1 0.1 peak 726 volume 15.61520 ppm1 0.729 ppm2 1.390
 
! ############ hot_mothernoesy_072403.727 assigned
assi (resid 41 and name HG2#)
     (resid 41 and name HG1#)
6 0.1 0.1 peak 727 volume 46.33990 ppm1 0.729 ppm2 0.977
 
! ############ hot_mothernoesy_072403.733 assigned
assi (resid 32 and name HD1#)
     (resid 32 and name HA)
6 0.1 0.1 peak 733 volume 22.89160 ppm1 0.611 ppm2 4.174
 
! ############ hot_mothernoesy_072403.735 assigned
assi (resid 32 and name HD1#)
     (resid 63 and name HB#)
6 0.1 0.1 peak 735 volume 8.43920 ppm1 0.610 ppm2 1.729
 
! ############ hot_mothernoesy_072403.736 assigned
assi (resid 32 and name HD1#)
     (resid 32 and name HB#)
6 0.1 0.1 peak 736 volume 18.74750 ppm1 0.611 ppm2 1.575
 
! ############ hot_mothernoesy_072403.738 assigned
assi (resid 32 and name HD1#)
     (resid 32 and name HG)
6 0.1 0.1 peak 738 volume 20.32770 ppm1 0.611 ppm2 1.235
 
! ############ hot_mothernoesy_072403.739 assigned
assi (resid 32 and name HD1#)
     (resid 67 and name HD2#)
6 0.1 0.1 peak 739 volume 18.15530 ppm1 0.611 ppm2 0.984
 
! ############ hot_mothernoesy_072403.740 assigned
assi (resid 32 and name HD1#)
     (resid 67 and name HD1#)
6 0.1 0.1 peak 740 volume 19.07880 ppm1 0.612 ppm2 0.916
 
! ############ hot_mothernoesy_072403.743 assigned
assi (resid 32 and name HD1#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 743 volume 38.81700 ppm1 0.611 ppm2 0.157
 
! ############ hot_mothernoesy_072403.745 assigned
assi (resid 32 and name HD1#)
     (resid 71 and name HB#)
6 0.1 0.1 peak 745 volume 3.38040 ppm1 0.610 ppm2 3.881
 
! ############ hot_mothernoesy_072403.748 assigned
assi (resid 17 and name HG2#)
     (resid 17 and name HA)
6 0.1 0.1 peak 748 volume 31.53070 ppm1 1.139 ppm2 3.914
 
! ############ hot_mothernoesy_072403.750 assigned
assi (resid 17 and name HG2#)
     (resid 17 and name HB)
6 0.1 0.1 peak 750 volume 34.26510 ppm1 1.140 ppm2 2.305
 
! ############ hot_mothernoesy_072403.757 assigned
assi (resid 51 and name HG2#)
     (resid 51 and name HB)
6 0.1 0.1 peak 757 volume 38.19670 ppm1 1.330 ppm2 4.404
 
! ############ hot_mothernoesy_072403.758 assigned
assi (resid 51 and name HG2#)
     (resid 51 and name HA)
6 0.1 0.1 peak 758 volume 20.31320 ppm1 1.330 ppm2 4.119
 
! ############ hot_mothernoesy_072403.759 assigned
assi (resid 51 and name HG2#)
     (resid 55 and name HG#)
6 0.1 0.1 peak 759 volume 10.34410 ppm1 1.330 ppm2 2.393
 
! ############ hot_mothernoesy_072403.760 assigned
assi (resid 51 and name HG2#)
     (resid 55 and name HG#)
6 0.1 0.1 peak 760 volume 8.81690 ppm1 1.330 ppm2 2.166
 
! ############ hot_mothernoesy_072403.782 assigned
assi (resid 17 and name HG1#)
     (resid 17 and name HA)
6 0.1 0.1 peak 782 volume 18.53970 ppm1 1.008 ppm2 3.911
 
! ############ hot_mothernoesy_072403.783 assigned
assi (resid 17 and name HG1#)
     (resid 17 and name HB)
6 0.1 0.1 peak 783 volume 29.46370 ppm1 1.008 ppm2 2.307
 
! ############ hot_mothernoesy_072403.806 assigned
assi (resid 51 and name HB)
     (resid 51 and name HG2#)
6 0.1 0.1 peak 806 volume 27.22410 ppm1 4.407 ppm2 1.330
 
! ############ hot_mothernoesy_072403.808 assigned
assi (resid 36 and name HG1#)
     (resid 36 and name HA)
6 0.1 0.1 peak 808 volume 7.32320 ppm1 1.029 ppm2 4.235
 
! ############ hot_mothernoesy_072403.814 assigned
assi (resid 36 and name HG1#)
     (resid 36 and name HB)
6 0.1 0.1 peak 814 volume 17.35510 ppm1 1.023 ppm2 2.333
 
! ############ hot_mothernoesy_072403.815 assigned
assi (resid 36 and name HG1#)
     (resid 35 and name HG#)
6 0.1 0.1 peak 815 volume 11.31930 ppm1 1.026 ppm2 1.878
 
! ############ hot_mothernoesy_072403.848 assigned
assi (resid 26 and name HA)
     (resid 26 and name HG2#)
6 0.1 0.1 peak 848 volume 9.16640 ppm1 3.495 ppm2 1.384
 
! ############ hot_mothernoesy_072403.849 assigned
assi (resid 26 and name HA)
     (resid 26 and name HG1#)
6 0.1 0.1 peak 849 volume 14.13060 ppm1 3.497 ppm2 0.994
 
! ############ hot_mothernoesy_072403.862 assigned
assi (resid 51 and name HA)
     (resid 51 and name HG2#)
6 0.1 0.1 peak 862 volume 8.79790 ppm1 4.116 ppm2 1.330
 
! ############ hot_mothernoesy_072403.900 assigned
assi (resid 51 and name HA)
     (resid 51 and name HB)
6 0.1 0.1 peak 900 volume 4.46200 ppm1 4.115 ppm2 4.404
 
! ############ hot_mothernoesy_072403.903 assigned
assi (resid 19 and name HA)
     (resid 19 and name HB)
6 0.1 0.1 peak 903 volume 3.26990 ppm1 4.065 ppm2 2.498
 
! ############ hot_mothernoesy_072403.904 assigned
assi (resid 19 and name HA)
     (resid 22 and name HB#)
6 0.1 0.1 peak 904 volume 10.78410 ppm1 4.072 ppm2 1.674
 
! ############ hot_mothernoesy_072403.905 assigned
assi (resid 19 and name HA)
     (resid 19 and name HG1#)
6 0.1 0.1 peak 905 volume 20.33170 ppm1 4.072 ppm2 1.536
 
! ############ hot_mothernoesy_072403.910 assigned
assi (resid 17 and name HA)
     (resid 17 and name HB)
6 0.1 0.1 peak 910 volume 6.09890 ppm1 3.908 ppm2 2.307
 
! ############ hot_mothernoesy_072403.911 assigned
assi (resid 17 and name HA)
     (resid 17 and name HG1#)
6 0.1 0.1 peak 911 volume 15.92140 ppm1 3.908 ppm2 1.008
 
! ############ hot_mothernoesy_072403.912 assigned
assi (resid 17 and name HA)
     (resid 17 and name HG2#)
6 0.1 0.1 peak 912 volume 20.21120 ppm1 3.905 ppm2 1.140
 
! ############ hot_mothernoesy_072403.914 assigned
assi (resid 42 and name HB#)
     (resid 42 and name HA)
6 0.1 0.1 peak 914 volume 20.39410 ppm1 1.465 ppm2 2.923
 
! ############ hot_mothernoesy_072403.932 assigned
assi (resid 27 and name HB#)
     (resid 24 and name HB#)
6 0.1 0.1 peak 932 volume 7.32340 ppm1 1.349 ppm2 3.157
 
! ############ hot_mothernoesy_072403.936 assigned
assi (resid 37 and name HG2#)
     (resid 37 and name HA)
6 0.1 0.1 peak 936 volume 19.31920 ppm1 1.045 ppm2 4.494
 
! ############ hot_mothernoesy_072403.940 assigned
assi (resid 37 and name HG2#)
     (resid 37 and name HB)
6 0.1 0.1 peak 940 volume 26.26130 ppm1 1.046 ppm2 1.941
 
! ############ hot_mothernoesy_072403.943 assigned
assi (resid 37 and name HG2#)
     (resid 37 and name HD1#)
6 0.1 0.1 peak 943 volume 47.64860 ppm1 1.045 ppm2 0.877
 
! ############ hot_mothernoesy_072403.949 assigned
assi (resid 41 and name HA)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 949 volume 12.10880 ppm1 3.533 ppm2 0.728
 
! ############ hot_mothernoesy_072403.954 assigned
assi (resid 41 and name HA)
     (resid 41 and name HG1#)
6 0.1 0.1 peak 954 volume 19.49320 ppm1 3.533 ppm2 0.975
 
! ############ hot_mothernoesy_072403.961 assigned
assi (resid 21 and name HB#)
     (resid 21 and name HA)
6 0.1 0.1 peak 961 volume -4.18200 ppm1 2.044 ppm2 4.008
 
! ############ hot_mothernoesy_072403.963 assigned
assi (resid 21 and name HB#)
     (resid 21 and name HB#)
6 0.1 0.1 peak 963 volume -11.08390 ppm1 2.043 ppm2 1.798
 
! ############ hot_mothernoesy_072403.965 assigned
assi (resid 21 and name HB#)
     (resid 21 and name HD1#)
6 0.1 0.1 peak 965 volume -11.86980 ppm1 2.041 ppm2 0.988
 
! ############ hot_mothernoesy_072403.970 assigned
assi (resid 21 and name HB#)
     (resid 21 and name HB#)
6 0.1 0.1 peak 970 volume -10.76280 ppm1 1.801 ppm2 2.038
 
! ############ hot_mothernoesy_072403.976 assigned
assi (resid 23 and name HB#)
     (resid 20 and name HA)
6 0.1 0.1 peak 976 volume 6.33420 ppm1 1.246 ppm2 4.313
 
! ############ hot_mothernoesy_072403.979 assigned
assi (resid 23 and name HB#)
     (resid 23 and name HA)
6 0.1 0.1 peak 979 volume 15.76290 ppm1 1.246 ppm2 3.768
 
! ############ hot_mothernoesy_072403.982 assigned
assi (resid 23 and name HB#)
     (resid 22 and name HB#)
6 0.1 0.1 peak 982 volume 6.53210 ppm1 1.246 ppm2 1.671
 
! ############ hot_mothernoesy_072403.989 assigned
assi (resid 32 and name HB#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 989 volume -4.26710 ppm1 1.568 ppm2 0.609
 
! ############ hot_mothernoesy_072403.990 assigned
assi (resid 32 and name HB#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 990 volume -3.98760 ppm1 1.565 ppm2 0.157
 
! ############ hot_mothernoesy_072403.1023 assigned
assi (resid 22 and name HB#)
     (resid 21 and name HD1#)
6 0.1 0.1 peak 1023 volume 13.08830 ppm1 1.680 ppm2 0.986
 
! ############ hot_mothernoesy_072403.1024 assigned
assi (resid 22 and name HB#)
     (resid 22 and name HA)
6 0.1 0.1 peak 1024 volume 28.39570 ppm1 1.678 ppm2 4.058
 
! ############ hot_mothernoesy_072403.1027 assigned
assi (resid 22 and name HB#)
     (resid 23 and name HB#)
6 0.1 0.1 peak 1027 volume 4.44140 ppm1 1.676 ppm2 1.248
 
! ############ hot_mothernoesy_072403.1028 assigned
assi (resid 22 and name HB#)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 1028 volume 8.88330 ppm1 1.678 ppm2 0.728
 
! ############ hot_mothernoesy_072403.1035 assigned
assi (resid 16 and name HE#)
     (resid 16 and name HD#)
6 0.1 0.1 peak 1035 volume -12.06730 ppm1 2.345 ppm2 1.373
 
! ############ hot_mothernoesy_072403.1038 assigned
assi (resid 16 and name HE#)
     (resid 16 and name HB#)
6 0.1 0.1 peak 1038 volume -6.88040 ppm1 2.339 ppm2 1.834
 
! ############ hot_mothernoesy_072403.1039 assigned
assi (resid 16 and name HE#)
     (resid 16 and name HD#)
6 0.1 0.1 peak 1039 volume -11.01660 ppm1 2.337 ppm2 1.257
 
! ############ hot_mothernoesy_072403.1040 assigned
assi (resid 16 and name HE#)
     (resid 16 and name HG#)
6 0.1 0.1 peak 1040 volume -14.01640 ppm1 2.342 ppm2 0.798
 
! ############ hot_mothernoesy_072403.1072 assigned
assi (resid 34 and name HG2#)
     (resid 34 and name HA)
6 0.1 0.1 peak 1072 volume 10.97160 ppm1 1.031 ppm2 4.417
 
! ############ hot_mothernoesy_072403.1073 assigned
assi (resid 34 and name HG2#)
     (resid 35 and name HD#)
6 0.1 0.1 peak 1073 volume 6.68080 ppm1 1.030 ppm2 3.954
 
! ############ hot_mothernoesy_072403.1074 assigned
assi (resid 34 and name HG2#)
     (resid 29 and name HA)
6 0.1 0.1 peak 1074 volume 10.51100 ppm1 1.031 ppm2 3.610
 
! ############ hot_mothernoesy_072403.1078 assigned
assi (resid 34 and name HG2#)
     (resid 34 and name HB)
6 0.1 0.1 peak 1078 volume 22.10880 ppm1 1.030 ppm2 1.557
 
! ############ hot_mothernoesy_072403.1098 assigned
assi (resid 15 and name HB#)
     (resid 12 and name HA)
6 0.1 0.1 peak 1098 volume -3.19460 ppm1 2.833 ppm2 4.155
 
! ############ hot_mothernoesy_072403.1101 assigned
assi (resid 15 and name HB#)
     (resid 15 and name HB#)
6 0.1 0.1 peak 1101 volume -9.89130 ppm1 2.526 ppm2 2.831
 
! ############ hot_mothernoesy_072403.1168 assigned
assi (resid 68 and name HA)
     (resid 68 and name HD#)
6 0.1 0.1 peak 1168 volume 3.42920 ppm1 4.458 ppm2 3.917
 
! ############ hot_mothernoesy_072403.1171 assigned
assi (resid 68 and name HA)
     (resid 68 and name HB#)
6 0.1 0.1 peak 1171 volume 15.26790 ppm1 4.457 ppm2 1.907
 
! ############ hot_mothernoesy_072403.1181 assigned
assi (resid 75 and name HB#)
     (resid 75 and name HA)
6 0.1 0.1 peak 1181 volume -12.67410 ppm1 3.001 ppm2 4.547
 
! ############ hot_mothernoesy_072403.1183 assigned
assi (resid 53 and name HA)
     (resid 53 and name HB#)
6 0.1 0.1 peak 1183 volume 3.99120 ppm1 3.715 ppm2 3.564
 
! ############ hot_mothernoesy_072403.1184 assigned
assi (resid 53 and name HA)
     (resid 53 and name HB#)
6 0.1 0.1 peak 1184 volume 4.14390 ppm1 3.717 ppm2 3.230
 
! ############ hot_mothernoesy_072403.1200 assigned
assi (resid 6 and name HB)
     (resid 6 and name HA)
6 0.1 0.1 peak 1200 volume -10.64960 ppm1 1.877 ppm2 4.026
 
! ############ hot_mothernoesy_072403.1206 assigned
assi (resid 6 and name HB)
     (resid 6 and name HB)
6 0.1 0.1 peak 1206 volume -269.12881 ppm1 1.878 ppm2 1.877
 
! ############ hot_mothernoesy_072403.1207 assigned
assi (resid 6 and name HB)
     (resid 6 and name HG1#)
6 0.1 0.1 peak 1207 volume -11.22000 ppm1 1.879 ppm2 1.451
 
! ############ hot_mothernoesy_072403.1208 assigned
assi (resid 6 and name HB)
     (resid 6 and name HG1#)
6 0.1 0.1 peak 1208 volume -5.71600 ppm1 1.878 ppm2 1.184
 
! ############ hot_mothernoesy_072403.1209 assigned
assi (resid 6 and name HB)
     (resid 6 and name HG2#)
6 0.1 0.1 peak 1209 volume -24.23260 ppm1 1.877 ppm2 0.894
 
! ############ hot_mothernoesy_072403.1216 assigned
assi (resid 34 and name HD1#)
     (resid 34 and name HA)
6 0.1 0.1 peak 1216 volume 4.96210 ppm1 0.987 ppm2 4.416
 
! ############ hot_mothernoesy_072403.1217 assigned
assi (resid 34 and name HD1#)
     (resid 29 and name HA)
6 0.1 0.1 peak 1217 volume 6.89750 ppm1 0.986 ppm2 3.584
 
! ############ hot_mothernoesy_072403.1220 assigned
assi (resid 34 and name HD1#)
     (resid 34 and name HB)
6 0.1 0.1 peak 1220 volume 31.30730 ppm1 0.987 ppm2 1.568
 
! ############ hot_mothernoesy_072403.1222 assigned
assi (resid 34 and name HD1#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 1222 volume 5.78470 ppm1 0.988 ppm2 0.611
 
! ############ hot_mothernoesy_072403.1223 assigned
assi (resid 34 and name HD1#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 1223 volume 14.53770 ppm1 0.986 ppm2 0.159
 
! ############ hot_mothernoesy_072403.1228 assigned
assi (resid 6 and name HA)
     (resid 6 and name HB)
6 0.1 0.1 peak 1228 volume 16.09140 ppm1 4.027 ppm2 1.877
 
! ############ hot_mothernoesy_072403.1229 assigned
assi (resid 6 and name HA)
     (resid 6 and name HG1#)
6 0.1 0.1 peak 1229 volume 8.13210 ppm1 4.025 ppm2 1.182
 
! ############ hot_mothernoesy_072403.1230 assigned
assi (resid 6 and name HA)
     (resid 6 and name HG2#)
6 0.1 0.1 peak 1230 volume 23.08540 ppm1 4.026 ppm2 0.894
 
! ############ hot_mothernoesy_072403.1231 assigned
assi (resid 6 and name HA)
     (resid 6 and name HG1#)
6 0.1 0.1 peak 1231 volume 9.02900 ppm1 4.023 ppm2 1.442
 
! ############ hot_mothernoesy_072403.1238 assigned
assi (resid 29 and name HA)
     (resid 29 and name HB#)
6 0.1 0.1 peak 1238 volume 4.66710 ppm1 3.576 ppm2 1.881
 
! ############ hot_mothernoesy_072403.1240 assigned
assi (resid 29 and name HA)
     (resid 34 and name HG2#)
6 0.1 0.1 peak 1240 volume 8.89060 ppm1 3.578 ppm2 0.998
 
! ############ hot_mothernoesy_072403.1245 assigned
assi (resid 37 and name HB)
     (resid 37 and name HD1#)
6 0.1 0.1 peak 1245 volume -7.89170 ppm1 1.942 ppm2 0.877
 
! ############ hot_mothernoesy_072403.1246 assigned
assi (resid 37 and name HB)
     (resid 37 and name HG1#)
6 0.1 0.1 peak 1246 volume -4.29080 ppm1 1.932 ppm2 1.484
 
! ############ hot_mothernoesy_072403.1248 assigned
assi (resid 52 and name HA)
     (resid 52 and name HB#)
6 0.1 0.1 peak 1248 volume 5.16590 ppm1 4.357 ppm2 3.371
 
! ############ hot_mothernoesy_072403.1249 assigned
assi (resid 52 and name HA)
     (resid 52 and name HB#)
6 0.1 0.1 peak 1249 volume 4.56440 ppm1 4.358 ppm2 3.061
 
! ############ hot_mothernoesy_072403.1257 assigned
assi (resid 24 and name HB#)
     (resid 27 and name HB#)
6 0.1 0.1 peak 1257 volume 3.73640 ppm1 3.158 ppm2 1.352
 
! ############ hot_mothernoesy_072403.1258 assigned
assi (resid 37 and name HB)
     (resid 37 and name HG2#)
6 0.1 0.1 peak 1258 volume -11.15830 ppm1 1.940 ppm2 1.047
 
! ############ hot_mothernoesy_072403.1270 assigned
assi (resid 36 and name HA)
     (resid 36 and name HB)
6 0.1 0.1 peak 1270 volume 8.81730 ppm1 4.251 ppm2 2.338
 
! ############ hot_mothernoesy_072403.1273 assigned
assi (resid 16 and name HA)
     (resid 16 and name HB#)
6 0.1 0.1 peak 1273 volume 8.99250 ppm1 3.851 ppm2 1.833
 
! ############ hot_mothernoesy_072403.1277 assigned
assi (resid 16 and name HA)
     (resid 16 and name HG#)
6 0.1 0.1 peak 1277 volume 5.82990 ppm1 3.848 ppm2 0.775
 
! ############ hot_mothernoesy_072403.1279 assigned
assi (resid 16 and name HA)
     (resid 15 and name HB#)
6 0.1 0.1 peak 1279 volume 4.91690 ppm1 3.850 ppm2 2.513
 
! ############ hot_mothernoesy_072403.1301 assigned
assi (resid 6 and name HD1#)
     (resid 6 and name HA)
6 0.1 0.1 peak 1301 volume 9.68680 ppm1 0.865 ppm2 4.024
 
! ############ hot_mothernoesy_072403.1302 assigned
assi (resid 6 and name HD1#)
     (resid 6 and name HB)
6 0.1 0.1 peak 1302 volume 15.14830 ppm1 0.865 ppm2 1.876
 
! ############ hot_mothernoesy_072403.1303 assigned
assi (resid 6 and name HD1#)
     (resid 6 and name HG1#)
6 0.1 0.1 peak 1303 volume 47.03590 ppm1 0.865 ppm2 1.169
 
! ############ hot_mothernoesy_072403.1338 assigned
assi (resid 37 and name HD1#)
     (resid 37 and name HA)
6 0.1 0.1 peak 1338 volume 11.14940 ppm1 0.876 ppm2 4.499
 
! ############ hot_mothernoesy_072403.1339 assigned
assi (resid 37 and name HD1#)
     (resid 36 and name HA)
6 0.1 0.1 peak 1339 volume 3.21830 ppm1 0.875 ppm2 4.249
 
! ############ hot_mothernoesy_072403.1349 assigned
assi (resid 37 and name HD1#)
     (resid 37 and name HB)
6 0.1 0.1 peak 1349 volume 23.20140 ppm1 0.876 ppm2 1.937
 
! ############ hot_mothernoesy_072403.1350 assigned
assi (resid 37 and name HD1#)
     (resid 37 and name HG1#)
6 0.1 0.1 peak 1350 volume 50.62670 ppm1 0.876 ppm2 1.480
 
! ############ hot_mothernoesy_072403.1355 assigned
assi (resid 64 and name HA)
     (resid 64 and name HB#)
6 0.1 0.1 peak 1355 volume 9.50690 ppm1 4.304 ppm2 4.028
 
! ############ hot_mothernoesy_072403.1365 assigned
assi (resid 55 and name HG#)
     (resid 52 and name HA)
6 0.1 0.1 peak 1365 volume -3.21540 ppm1 2.392 ppm2 4.353
 
! ############ hot_mothernoesy_072403.1368 assigned
assi (resid 55 and name HG#)
     (resid 51 and name HG2#)
6 0.1 0.1 peak 1368 volume -5.79910 ppm1 2.394 ppm2 1.331
 
! ############ hot_mothernoesy_072403.1370 assigned
assi (resid 55 and name HG#)
     (resid 55 and name HA)
6 0.1 0.1 peak 1370 volume -9.77460 ppm1 2.170 ppm2 3.979
 
! ############ hot_mothernoesy_072403.1374 assigned
assi (resid 55 and name HG#)
     (resid 51 and name HG2#)
6 0.1 0.1 peak 1374 volume -3.91290 ppm1 2.169 ppm2 1.330
 
! ############ hot_mothernoesy_072403.1387 assigned
assi (resid 37 and name HA)
     (resid 37 and name HG1#)
6 0.1 0.1 peak 1387 volume 6.30770 ppm1 4.497 ppm2 1.511
 
! ############ hot_mothernoesy_072403.1388 assigned
assi (resid 37 and name HA)
     (resid 37 and name HG2#)
6 0.1 0.1 peak 1388 volume 15.30840 ppm1 4.496 ppm2 1.046
 
! ############ hot_mothernoesy_072403.1389 assigned
assi (resid 37 and name HA)
     (resid 37 and name HD1#)
6 0.1 0.1 peak 1389 volume 6.44350 ppm1 4.498 ppm2 0.887
 
! ############ hot_mothernoesy_072403.1391 assigned
assi (resid 37 and name HA)
     (resid 37 and name HB)
6 0.1 0.1 peak 1391 volume 3.59370 ppm1 4.491 ppm2 1.956
 
! ############ hot_mothernoesy_072403.1397 assigned
assi (resid 12 and name HA)
     (resid 15 and name HB#)
6 0.1 0.1 peak 1397 volume 4.86930 ppm1 4.154 ppm2 2.529
 
! ############ hot_mothernoesy_072403.1404 assigned
assi (resid 12 and name HA)
     (resid 15 and name HB#)
6 0.1 0.1 peak 1404 volume 6.23150 ppm1 4.155 ppm2 2.830
 
! ############ hot_mothernoesy_072403.1435 assigned
assi (resid 34 and name HA)
     (resid 29 and name HA)
6 0.1 0.1 peak 1435 volume 7.01000 ppm1 4.417 ppm2 3.619
 
! ############ hot_mothernoesy_072403.1436 assigned
assi (resid 34 and name HA)
     (resid 34 and name HB)
6 0.1 0.1 peak 1436 volume 5.14310 ppm1 4.419 ppm2 1.572
 
! ############ hot_mothernoesy_072403.1437 assigned
assi (resid 34 and name HA)
     (resid 34 and name HG2#)
6 0.1 0.1 peak 1437 volume 11.47730 ppm1 4.418 ppm2 1.026
 
! ############ hot_mothernoesy_072403.1521 assigned
assi (resid 15 and name HA)
     (resid 15 and name HB#)
6 0.1 0.1 peak 1521 volume 10.58260 ppm1 4.547 ppm2 2.526
 
! ############ hot_mothernoesy_072403.1545 assigned
assi (resid 63 and name HA)
     (resid 63 and name HB#)
6 0.1 0.1 peak 1545 volume 5.75490 ppm1 4.109 ppm2 1.771
 
! ############ hot_mothernoesy_072403.1571 assigned
assi (resid 16 and name HB#)
     (resid 16 and name HA)
6 0.1 0.1 peak 1571 volume -7.34700 ppm1 1.831 ppm2 3.852
 
! ############ hot_mothernoesy_072403.1596 assigned
assi (resid 68 and name HB#)
     (resid 68 and name HA)
6 0.1 0.1 peak 1596 volume -16.49550 ppm1 1.906 ppm2 4.420
 
! ############ hot_mothernoesy_072403.1599 assigned
assi (resid 68 and name HB#)
     (resid 68 and name HD#)
6 0.1 0.1 peak 1599 volume -9.12700 ppm1 1.904 ppm2 3.610
 
! ############ hot_mothernoesy_072403.1628 assigned
assi (resid 23 and name HA)
     (resid 23 and name HB#)
6 0.1 0.1 peak 1628 volume 12.12260 ppm1 3.770 ppm2 1.246
 
! ############ hot_mothernoesy_072403.1632 assigned
assi (resid 22 and name HA)
     (resid 22 and name HB#)
6 0.1 0.1 peak 1632 volume 18.49820 ppm1 4.054 ppm2 1.678
 
! ############ hot_mothernoesy_072403.1633 assigned
assi (resid 22 and name HA)
     (resid 21 and name HD1#)
6 0.1 0.1 peak 1633 volume 7.62180 ppm1 4.055 ppm2 0.995
 
! ############ hot_mothernoesy_072403.1674 assigned
assi (resid 32 and name HA)
     (resid 32 and name HN)
6 0.1 0.1 peak 1674 volume -3.23720 ppm1 4.170 ppm2 7.760
 
! ############ hot_mothernoesy_072403.1729 assigned
assi (resid 32 and name HG)
     (resid 32 and name HN)
6 0.1 0.1 peak 1729 volume 3.39830 ppm1 1.240 ppm2 7.753
 
! ############ hot_mothernoesy_072403.1730 assigned
assi (resid 49 and name HG)
     (resid 49 and name HN)
6 0.1 0.1 peak 1730 volume 3.88300 ppm1 0.928 ppm2 8.290
 
! ############ hot_mothernoesy_072403.1733 assigned
assi (resid 57 and name HG)
     (resid 57 and name HN)
6 0.1 0.1 peak 1733 volume 3.51190 ppm1 0.904 ppm2 8.762
 
! ############ hot_mothernoesy_072403.1737 assigned
assi (resid 67 and name HD2#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 1737 volume 5.04680 ppm1 0.990 ppm2 6.793
 
! ############ hot_mothernoesy_072403.1738 assigned
assi (resid 67 and name HD2#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 1738 volume 7.53120 ppm1 0.990 ppm2 6.458
 
! ############ hot_mothernoesy_072403.1741 assigned
assi (resid 26 and name HG2#)
     (resid 26 and name HN)
6 0.1 0.1 peak 1741 volume 12.04490 ppm1 1.388 ppm2 8.405
 
! ############ hot_mothernoesy_072403.1743 assigned
assi (resid 26 and name HG2#)
     (resid 53 and name HE#)
6 0.1 0.1 peak 1743 volume 11.88780 ppm1 1.388 ppm2 7.104
 
! ############ hot_mothernoesy_072403.1746 assigned
assi (resid 32 and name HD2#)
     (resid 32 and name HN)
6 0.1 0.1 peak 1746 volume 4.37510 ppm1 0.157 ppm2 7.749
 
! ############ hot_mothernoesy_072403.1747 assigned
assi (resid 32 and name HD2#)
     (resid 60 and name HE#)
6 0.1 0.1 peak 1747 volume 3.65530 ppm1 0.160 ppm2 6.885
 
! ############ hot_mothernoesy_072403.1748 assigned
assi (resid 32 and name HD2#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 1748 volume 3.92830 ppm1 0.158 ppm2 6.798
 
! ############ hot_mothernoesy_072403.1749 assigned
assi (resid 32 and name HD2#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 1749 volume 4.90160 ppm1 0.158 ppm2 6.458
 
! ############ hot_mothernoesy_072403.1752 assigned
assi (resid 21 and name HD1#)
     (resid 21 and name HN)
6 0.1 0.1 peak 1752 volume 8.56240 ppm1 0.987 ppm2 8.009
 
! ############ hot_mothernoesy_072403.1754 assigned
assi (resid 21 and name HD1#)
     (resid 22 and name HN)
6 0.1 0.1 peak 1754 volume 4.74950 ppm1 0.990 ppm2 8.189
 
! ############ hot_mothernoesy_072403.1766 assigned
assi (resid 67 and name HD1#)
     (resid 67 and name HN)
6 0.1 0.1 peak 1766 volume 5.37710 ppm1 0.913 ppm2 8.060
 
! ############ hot_mothernoesy_072403.1767 assigned
assi (resid 67 and name HD1#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 1767 volume 3.60840 ppm1 0.914 ppm2 6.456
 
! ############ hot_mothernoesy_072403.1772 assigned
assi (resid 36 and name HG2#)
     (resid 37 and name HN)
6 0.1 0.1 peak 1772 volume 8.20520 ppm1 1.014 ppm2 8.605
 
! ############ hot_mothernoesy_072403.1779 assigned
assi (resid 65 and name HD1#)
     (resid 66 and name HN)
6 0.1 0.1 peak 1779 volume 4.21190 ppm1 0.905 ppm2 7.930
 
! ############ hot_mothernoesy_072403.1780 assigned
assi (resid 65 and name HD1#)
     (resid 65 and name HN)
6 0.1 0.1 peak 1780 volume 8.65180 ppm1 0.903 ppm2 7.502
 
! ############ hot_mothernoesy_072403.1782 assigned
assi (resid 41 and name HG2#)
     (resid 41 and name HN)
6 0.1 0.1 peak 1782 volume 3.68920 ppm1 0.730 ppm2 7.552
 
! ############ hot_mothernoesy_072403.1787 assigned
assi (resid 41 and name HG2#)
     (resid 44 and name HN)
6 0.1 0.1 peak 1787 volume 3.37260 ppm1 0.724 ppm2 7.305
 
! ############ hot_mothernoesy_072403.1788 assigned
assi (resid 32 and name HD1#)
     (resid 32 and name HN)
6 0.1 0.1 peak 1788 volume 5.11810 ppm1 0.611 ppm2 7.754
 
! ############ hot_mothernoesy_072403.1789 assigned
assi (resid 32 and name HD1#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 1789 volume 3.19750 ppm1 0.614 ppm2 6.794
 
! ############ hot_mothernoesy_072403.1790 assigned
assi (resid 32 and name HD1#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 1790 volume 4.71750 ppm1 0.612 ppm2 6.461
 
! ############ hot_mothernoesy_072403.1793 assigned
assi (resid 17 and name HG2#)
     (resid 17 and name HN)
6 0.1 0.1 peak 1793 volume 30.16990 ppm1 1.140 ppm2 7.760
 
! ############ hot_mothernoesy_072403.1794 assigned
assi (resid 51 and name HG2#)
     (resid 51 and name HN)
6 0.1 0.1 peak 1794 volume 5.20140 ppm1 1.331 ppm2 8.699
 
! ############ hot_mothernoesy_072403.1795 assigned
assi (resid 51 and name HG2#)
     (resid 52 and name HN)
6 0.1 0.1 peak 1795 volume 4.25880 ppm1 1.329 ppm2 7.999
 
! ############ hot_mothernoesy_072403.1801 assigned
assi (resid 70 and name HA#)
     (resid 71 and name HN)
6 0.1 0.1 peak 1801 volume -6.25520 ppm1 3.992 ppm2 8.183
 
! ############ hot_mothernoesy_072403.1802 assigned
assi (resid 17 and name HG1#)
     (resid 17 and name HN)
6 0.1 0.1 peak 1802 volume 9.50020 ppm1 1.007 ppm2 7.758
 
! ############ hot_mothernoesy_072403.1804 assigned
assi (resid 51 and name HB)
     (resid 51 and name HN)
6 0.1 0.1 peak 1804 volume 4.27640 ppm1 4.404 ppm2 8.697
 
! ############ hot_mothernoesy_072403.1805 assigned
assi (resid 51 and name HB)
     (resid 52 and name HN)
6 0.1 0.1 peak 1805 volume 4.49930 ppm1 4.407 ppm2 8.000
 
! ############ hot_mothernoesy_072403.1806 assigned
assi (resid 36 and name HG1#)
     (resid 37 and name HN)
6 0.1 0.1 peak 1806 volume 5.60240 ppm1 1.029 ppm2 8.558
 
! ############ hot_mothernoesy_072403.1808 assigned
assi (resid 36 and name HG1#)
     (resid 36 and name HN)
6 0.1 0.1 peak 1808 volume 9.37300 ppm1 1.025 ppm2 7.762
 
! ############ hot_mothernoesy_072403.1832 assigned
assi (resid 19 and name HA)
     (resid 19 and name HN)
6 0.1 0.1 peak 1832 volume 6.43040 ppm1 4.073 ppm2 8.638
 
! ############ hot_mothernoesy_072403.1835 assigned
assi (resid 17 and name HA)
     (resid 20 and name HN)
6 0.1 0.1 peak 1835 volume 3.37020 ppm1 3.907 ppm2 8.634
 
! ############ hot_mothernoesy_072403.1836 assigned
assi (resid 17 and name HA)
     (resid 17 and name HN)
6 0.1 0.1 peak 1836 volume 7.83750 ppm1 3.911 ppm2 7.759
 
! ############ hot_mothernoesy_072403.1837 assigned
assi (resid 42 and name HB#)
     (resid 42 and name HN)
6 0.1 0.1 peak 1837 volume 24.26310 ppm1 1.465 ppm2 8.466
 
! ############ hot_mothernoesy_072403.1838 assigned
assi (resid 42 and name HB#)
     (resid 41 and name HN)
6 0.1 0.1 peak 1838 volume 3.83130 ppm1 1.465 ppm2 7.550
 
! ############ hot_mothernoesy_072403.1840 assigned
assi (resid 42 and name HB#)
     (resid 53 and name HE#)
6 0.1 0.1 peak 1840 volume 12.88280 ppm1 1.466 ppm2 7.127
 
! ############ hot_mothernoesy_072403.1845 assigned
assi (resid 27 and name HB#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 1845 volume 3.62400 ppm1 1.349 ppm2 6.800
 
! ############ hot_mothernoesy_072403.1846 assigned
assi (resid 27 and name HB#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 1846 volume 5.60660 ppm1 1.350 ppm2 6.453
 
! ############ hot_mothernoesy_072403.1847 assigned
assi (resid 37 and name HG2#)
     (resid 38 and name HN)
6 0.1 0.1 peak 1847 volume 22.95340 ppm1 1.046 ppm2 9.352
 
! ############ hot_mothernoesy_072403.1849 assigned
assi (resid 37 and name HG2#)
     (resid 40 and name HN)
6 0.1 0.1 peak 1849 volume 20.98030 ppm1 1.045 ppm2 7.216
 
! ############ hot_mothernoesy_072403.1850 assigned
assi (resid 37 and name HG2#)
     (resid 37 and name HN)
6 0.1 0.1 peak 1850 volume 4.25060 ppm1 1.048 ppm2 8.601
 
! ############ hot_mothernoesy_072403.1851 assigned
assi (resid 41 and name HA)
     (resid 41 and name HN)
6 0.1 0.1 peak 1851 volume 5.29850 ppm1 3.531 ppm2 7.550
 
! ############ hot_mothernoesy_072403.1852 assigned
assi (resid 21 and name HB#)
     (resid 21 and name HN)
6 0.1 0.1 peak 1852 volume -4.95700 ppm1 2.043 ppm2 8.016
 
! ############ hot_mothernoesy_072403.1855 assigned
assi (resid 23 and name HB#)
     (resid 23 and name HN)
6 0.1 0.1 peak 1855 volume 16.50180 ppm1 1.247 ppm2 8.354
 
! ############ hot_mothernoesy_072403.1856 assigned
assi (resid 23 and name HB#)
     (resid 24 and name HN)
6 0.1 0.1 peak 1856 volume 8.74180 ppm1 1.246 ppm2 8.007
 
! ############ hot_mothernoesy_072403.1857 assigned
assi (resid 23 and name HB#)
     (resid 53 and name HD#)
6 0.1 0.1 peak 1857 volume 5.12200 ppm1 1.246 ppm2 7.290
 
! ############ hot_mothernoesy_072403.1858 assigned
assi (resid 23 and name HB#)
     (resid 53 and name HE#)
6 0.1 0.1 peak 1858 volume 6.44520 ppm1 1.246 ppm2 7.130
 
! ############ hot_mothernoesy_072403.1859 assigned
assi (resid 23 and name HB#)
     (resid 60 and name HE#)
6 0.1 0.1 peak 1859 volume 10.41200 ppm1 1.246 ppm2 6.896
 
! ############ hot_mothernoesy_072403.1866 assigned
assi (resid 22 and name HB#)
     (resid 53 and name HD#)
6 0.1 0.1 peak 1866 volume 4.73780 ppm1 1.679 ppm2 7.290
 
! ############ hot_mothernoesy_072403.1867 assigned
assi (resid 22 and name HB#)
     (resid 23 and name HN)
6 0.1 0.1 peak 1867 volume 11.38110 ppm1 1.677 ppm2 8.352
 
! ############ hot_mothernoesy_072403.1868 assigned
assi (resid 22 and name HB#)
     (resid 22 and name HN)
6 0.1 0.1 peak 1868 volume 18.68790 ppm1 1.678 ppm2 8.190
 
! ############ hot_mothernoesy_072403.1869 assigned
assi (resid 22 and name HB#)
     (resid 21 and name HN)
6 0.1 0.1 peak 1869 volume 4.19450 ppm1 1.676 ppm2 8.009
 
! ############ hot_mothernoesy_072403.1870 assigned
assi (resid 22 and name HB#)
     (resid 53 and name HE#)
6 0.1 0.1 peak 1870 volume 8.57050 ppm1 1.678 ppm2 7.126
 
! ############ hot_mothernoesy_072403.1873 assigned
assi (resid 16 and name HE#)
     (resid 52 and name HE#)
6 0.1 0.1 peak 1873 volume -3.24580 ppm1 2.339 ppm2 6.983
 
! ############ hot_mothernoesy_072403.1878 assigned
assi (resid 35 and name HA)
     (resid 36 and name HN)
6 0.1 0.1 peak 1878 volume 21.97360 ppm1 4.195 ppm2 7.760
 
! ############ hot_mothernoesy_072403.1879 assigned
assi (resid 34 and name HG2#)
     (resid 34 and name HN)
6 0.1 0.1 peak 1879 volume 5.38430 ppm1 1.032 ppm2 8.626
 
! ############ hot_mothernoesy_072403.1884 assigned
assi (resid 15 and name HB#)
     (resid 15 and name HN)
6 0.1 0.1 peak 1884 volume -3.81060 ppm1 2.520 ppm2 8.741
 
! ############ hot_mothernoesy_072403.1885 assigned
assi (resid 15 and name HB#)
     (resid 15 and name HN)
6 0.1 0.1 peak 1885 volume -4.60720 ppm1 2.821 ppm2 8.749
 
! ############ hot_mothernoesy_072403.1892 assigned
assi (resid 34 and name HB)
     (resid 34 and name HN)
6 0.1 0.1 peak 1892 volume -3.68280 ppm1 1.556 ppm2 8.628
 
! ############ hot_mothernoesy_072403.1896 assigned
assi (resid 68 and name HA)
     (resid 69 and name HN)
6 0.1 0.1 peak 1896 volume 28.87830 ppm1 4.458 ppm2 8.438
 
! ############ hot_mothernoesy_072403.1899 assigned
assi (resid 75 and name HB#)
     (resid 75 and name HD#)
6 0.1 0.1 peak 1899 volume -11.98810 ppm1 3.000 ppm2 7.144
 
! ############ hot_mothernoesy_072403.1900 assigned
assi (resid 53 and name HA)
     (resid 53 and name HN)
6 0.1 0.1 peak 1900 volume 4.53850 ppm1 3.715 ppm2 8.761
 
! ############ hot_mothernoesy_072403.1901 assigned
assi (resid 53 and name HA)
     (resid 53 and name HD#)
6 0.1 0.1 peak 1901 volume 4.08860 ppm1 3.716 ppm2 7.296
 
! ############ hot_mothernoesy_072403.1902 assigned
assi (resid 75 and name HB#)
     (resid 75 and name HD#)
6 0.1 0.1 peak 1902 volume -11.75110 ppm1 3.117 ppm2 7.147
 
! ############ hot_mothernoesy_072403.1908 assigned
assi (resid 6 and name HB)
     (resid 6 and name HN)
6 0.1 0.1 peak 1908 volume -10.66480 ppm1 1.878 ppm2 7.795
 
! ############ hot_mothernoesy_072403.1910 assigned
assi (resid 34 and name HD1#)
     (resid 34 and name HN)
6 0.1 0.1 peak 1910 volume 4.86610 ppm1 0.986 ppm2 8.628
 
! ############ hot_mothernoesy_072403.1911 assigned
assi (resid 34 and name HD1#)
     (resid 60 and name HE#)
6 0.1 0.1 peak 1911 volume 7.53800 ppm1 0.986 ppm2 6.913
 
! ############ hot_mothernoesy_072403.1913 assigned
assi (resid 24 and name HB#)
     (resid 60 and name HE#)
6 0.1 0.1 peak 1913 volume 3.40630 ppm1 3.161 ppm2 6.894
 
! ############ hot_mothernoesy_072403.1914 assigned
assi (resid 24 and name HB#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 1914 volume 3.38300 ppm1 3.160 ppm2 6.802
 
! ############ hot_mothernoesy_072403.1917 assigned
assi (resid 52 and name HB#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 1917 volume -3.18190 ppm1 3.379 ppm2 7.174
 
! ############ hot_mothernoesy_072403.1922 assigned
assi (resid 29 and name HA)
     (resid 29 and name HN)
6 0.1 0.1 peak 1922 volume 3.17630 ppm1 3.578 ppm2 7.895
 
! ############ hot_mothernoesy_072403.1923 assigned
assi (resid 52 and name HA)
     (resid 52 and name HN)
6 0.1 0.1 peak 1923 volume 3.77350 ppm1 4.353 ppm2 8.001
 
! ############ hot_mothernoesy_072403.1924 assigned
assi (resid 52 and name HA)
     (resid 52 and name HD#)
6 0.1 0.1 peak 1924 volume 7.00410 ppm1 4.356 ppm2 7.173
 
! ############ hot_mothernoesy_072403.1925 assigned
assi (resid 60 and name HA)
     (resid 60 and name HE#)
6 0.1 0.1 peak 1925 volume 5.91070 ppm1 4.258 ppm2 6.880
 
! ############ hot_mothernoesy_072403.1927 assigned
assi (resid 36 and name HA)
     (resid 37 and name HN)
6 0.1 0.1 peak 1927 volume 9.89130 ppm1 4.252 ppm2 8.604
 
! ############ hot_mothernoesy_072403.1928 assigned
assi (resid 36 and name HA)
     (resid 36 and name HN)
6 0.1 0.1 peak 1928 volume 4.86510 ppm1 4.251 ppm2 7.759
 
! ############ hot_mothernoesy_072403.1929 assigned
assi (resid 16 and name HA)
     (resid 52 and name HE#)
6 0.1 0.1 peak 1929 volume 3.50970 ppm1 3.855 ppm2 6.983
 
! ############ hot_mothernoesy_072403.1931 assigned
assi (resid 16 and name HA)
     (resid 16 and name HN)
6 0.1 0.1 peak 1931 volume 5.34140 ppm1 3.852 ppm2 7.990
 
! ############ hot_mothernoesy_072403.1933 assigned
assi (resid 33 and name HB#)
     (resid 33 and name HD2#)
6 0.1 0.1 peak 1933 volume -4.76100 ppm1 3.186 ppm2 7.487
 
! ############ hot_mothernoesy_072403.1940 assigned
assi (resid 47 and name HA)
     (resid 47 and name HN)
6 0.1 0.1 peak 1940 volume 6.60880 ppm1 3.676 ppm2 8.918
 
! ############ hot_mothernoesy_072403.1945 assigned
assi (resid 37 and name HD1#)
     (resid 38 and name HN)
6 0.1 0.1 peak 1945 volume 4.71000 ppm1 0.877 ppm2 9.351
 
! ############ hot_mothernoesy_072403.1948 assigned
assi (resid 37 and name HD1#)
     (resid 37 and name HN)
6 0.1 0.1 peak 1948 volume 5.21030 ppm1 0.877 ppm2 8.607
 
! ############ hot_mothernoesy_072403.1949 assigned
assi (resid 37 and name HD1#)
     (resid 40 and name HE2#)
6 0.1 0.1 peak 1949 volume 3.75970 ppm1 0.874 ppm2 7.646
 
! ############ hot_mothernoesy_072403.1950 assigned
assi (resid 37 and name HD1#)
     (resid 40 and name HN)
6 0.1 0.1 peak 1950 volume 3.73860 ppm1 0.877 ppm2 7.212
 
! ############ hot_mothernoesy_072403.1951 assigned
assi (resid 37 and name HD1#)
     (resid 40 and name HE2#)
6 0.1 0.1 peak 1951 volume 4.15910 ppm1 0.876 ppm2 6.841
 
! ############ hot_mothernoesy_072403.1957 assigned
assi (resid 55 and name HG#)
     (resid 55 and name HN)
6 0.1 0.1 peak 1957 volume -7.75950 ppm1 2.393 ppm2 8.303
 
! ############ hot_mothernoesy_072403.1958 assigned
assi (resid 55 and name HG#)
     (resid 55 and name HN)
6 0.1 0.1 peak 1958 volume -6.86180 ppm1 2.168 ppm2 8.304
 
! ############ hot_mothernoesy_072403.1961 assigned
assi (resid 37 and name HA)
     (resid 38 and name HN)
6 0.1 0.1 peak 1961 volume 12.17590 ppm1 4.491 ppm2 9.350
 
! ############ hot_mothernoesy_072403.1979 assigned
assi (resid 20 and name HA)
     (resid 20 and name HN)
6 0.1 0.1 peak 1979 volume 4.98490 ppm1 4.319 ppm2 8.636
 
! ############ hot_mothernoesy_072403.1998 assigned
assi (resid 75 and name HA)
     (resid 75 and name HD#)
6 0.1 0.1 peak 1998 volume 15.37390 ppm1 4.548 ppm2 7.147
 
! ############ hot_mothernoesy_072403.2015 assigned
assi (resid 15 and name HA)
     (resid 15 and name HN)
6 0.1 0.1 peak 2015 volume 8.94310 ppm1 4.550 ppm2 8.747
 
! ############ hot_mothernoesy_072403.2026 assigned
assi (resid 63 and name HA)
     (resid 64 and name HN)
6 0.1 0.1 peak 2026 volume 4.28980 ppm1 4.105 ppm2 7.774
 
! ############ hot_mothernoesy_072403.2027 assigned
assi (resid 63 and name HA)
     (resid 63 and name HN)
6 0.1 0.1 peak 2027 volume 6.39250 ppm1 4.107 ppm2 7.636
 
! ############ hot_mothernoesy_072403.2044 assigned
assi (resid 73 and name HB#)
     (resid 74 and name HN)
6 0.1 0.1 peak 2044 volume -4.99960 ppm1 1.910 ppm2 8.458
 
! ############ hot_mothernoesy_072403.2052 assigned
assi (resid 23 and name HA)
     (resid 23 and name HN)
6 0.1 0.1 peak 2052 volume 6.04270 ppm1 3.770 ppm2 8.356
 
! ############ hot_mothernoesy_072403.2053 assigned
assi (resid 23 and name HA)
     (resid 53 and name HE#)
6 0.1 0.1 peak 2053 volume 7.44870 ppm1 3.772 ppm2 7.128
 
! ############ hot_mothernoesy_072403.2073 assigned
assi (resid 52 and name HE#)
     (resid 16 and name HA)
6 0.1 0.1 peak 2073 volume 2.65430 ppm1 6.980 ppm2 3.853
 
! ############ hot_mothernoesy_072403.2076 assigned
assi (resid 60 and name HE#)
     (resid 23 and name HB#)
6 0.1 0.1 peak 2076 volume 3.58890 ppm1 6.915 ppm2 1.248
 
! ############ hot_mothernoesy_072403.2079 assigned
assi (resid 28 and name HE#)
     (resid 64 and name HA)
6 0.1 0.1 peak 2079 volume 2.28340 ppm1 6.458 ppm2 4.284
 
! ############ hot_mothernoesy_072403.2080 assigned
assi (resid 28 and name HE#)
     (resid 64 and name HB#)
6 0.1 0.1 peak 2080 volume 2.48690 ppm1 6.454 ppm2 4.173
 
! ############ hot_mothernoesy_072403.2081 assigned
assi (resid 28 and name HE#)
     (resid 28 and name HA)
6 0.1 0.1 peak 2081 volume 2.96170 ppm1 6.454 ppm2 3.725
 
! ############ hot_mothernoesy_072403.2083 assigned
assi (resid 28 and name HE#)
     (resid 67 and name HD2#)
6 0.1 0.1 peak 2083 volume 9.37620 ppm1 6.455 ppm2 0.988
 
! ############ hot_mothernoesy_072403.2084 assigned
assi (resid 28 and name HE#)
     (resid 67 and name HD1#)
6 0.1 0.1 peak 2084 volume 3.84640 ppm1 6.454 ppm2 0.926
 
! ############ hot_mothernoesy_072403.2086 assigned
assi (resid 28 and name HE#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 2086 volume 3.08390 ppm1 6.456 ppm2 0.611
 
! ############ hot_mothernoesy_072403.2087 assigned
assi (resid 28 and name HE#)
     (resid 24 and name HB#)
6 0.1 0.1 peak 2087 volume 2.93490 ppm1 6.454 ppm2 3.162
 
! ############ hot_mothernoesy_072403.2090 assigned
assi (resid 28 and name HE#)
     (resid 27 and name HB#)
6 0.1 0.1 peak 2090 volume 5.32990 ppm1 6.455 ppm2 1.349
 
! ############ hot_mothernoesy_072403.2091 assigned
assi (resid 28 and name HE#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2091 volume 3.67790 ppm1 6.454 ppm2 0.156
 
! ############ hot_mothernoesy_072403.2094 assigned
assi (resid 75 and name HD#)
     (resid 75 and name HB#)
6 0.1 0.1 peak 2094 volume -7.41330 ppm1 7.146 ppm2 3.115
 
! ############ hot_mothernoesy_072403.2095 assigned
assi (resid 75 and name HD#)
     (resid 75 and name HB#)
6 0.1 0.1 peak 2095 volume -9.14310 ppm1 7.145 ppm2 3.002
 
! ############ hot_mothernoesy_072403.2097 assigned
assi (resid 52 and name HD#)
     (resid 52 and name HA)
6 0.1 0.1 peak 2097 volume -3.50820 ppm1 7.170 ppm2 4.348
 
! ############ hot_mothernoesy_072403.2098 assigned
assi (resid 52 and name HD#)
     (resid 52 and name HB#)
6 0.1 0.1 peak 2098 volume -3.06730 ppm1 7.172 ppm2 3.372
 
! ############ hot_mothernoesy_072403.2105 assigned
assi (resid 28 and name HD#)
     (resid 28 and name HA)
6 0.1 0.1 peak 2105 volume -4.97050 ppm1 6.793 ppm2 3.714
 
! ############ hot_mothernoesy_072403.2106 assigned
assi (resid 28 and name HD#)
     (resid 28 and name HB#)
6 0.1 0.1 peak 2106 volume -3.09230 ppm1 6.796 ppm2 2.944
 
! ############ hot_mothernoesy_072403.2107 assigned
assi (resid 28 and name HD#)
     (resid 28 and name HB#)
6 0.1 0.1 peak 2107 volume -2.69290 ppm1 6.795 ppm2 2.653
 
! ############ hot_mothernoesy_072403.2108 assigned
assi (resid 28 and name HD#)
     (resid 67 and name HD2#)
6 0.1 0.1 peak 2108 volume -4.13450 ppm1 6.793 ppm2 0.992
 
! ############ hot_mothernoesy_072403.2109 assigned
assi (resid 28 and name HD#)
     (resid 24 and name HB#)
6 0.1 0.1 peak 2109 volume -2.51380 ppm1 6.791 ppm2 3.163
 
! ############ hot_mothernoesy_072403.2155 assigned
assi (resid 52 and name HE#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2155 volume 14.79930 ppm1 6.981 ppm2 7.173
 
! ############ hot_mothernoesy_072403.2170 assigned
assi (resid 28 and name HE#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 2170 volume 22.50760 ppm1 6.455 ppm2 6.795
 
! ############ hot_mothernoesy_072403.2188 assigned
assi (resid 75 and name HD#)
     (resid 75 and name HE#)
6 0.1 0.1 peak 2188 volume -70.58250 ppm1 7.144 ppm2 6.848
 
! ############ hot_mothernoesy_072403.2194 assigned
assi (resid 28 and name HD#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 2194 volume -12.78940 ppm1 6.794 ppm2 6.458
 
! ############ hot_mothernoesy_072403.2220 assigned
assi (resid 75 and name HD#)
     (resid 75 and name HA)
6 0.1 0.1 peak 2220 volume -5.05370 ppm1 7.146 ppm2 4.547
 
! ############ hot_mothernoesy_072403.2244 assigned
assi (resid 34 and name HD1#)
     (resid 33 and name HN)
6 0.1 0.1 peak 2244 volume 2.73560 ppm1 0.986 ppm2 7.889
 
! ############ hot_mothernoesy_072403.2246 assigned
assi (resid 34 and name HD1#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 2246 volume 2.02140 ppm1 0.990 ppm2 6.462
 
! ############ hot_mothernoesy_072403.2247 assigned
assi (resid 34 and name HD1#)
     (resid 35 and name HA)
6 0.1 0.1 peak 2247 volume 3.06640 ppm1 0.991 ppm2 4.184
 
! ############ hot_mothernoesy_072403.2248 assigned
assi (resid 34 and name HD1#)
     (resid 35 and name HD#)
6 0.1 0.1 peak 2248 volume 1.99510 ppm1 0.985 ppm2 3.949
 
! ############ hot_mothernoesy_072403.2250 assigned
assi (resid 6 and name HD1#)
     (resid 6 and name HN)
6 0.1 0.1 peak 2250 volume 2.99390 ppm1 0.864 ppm2 7.795
 
! ############ hot_mothernoesy_072403.2251 assigned
assi (resid 34 and name HG2#)
     (resid 33 and name HN)
6 0.1 0.1 peak 2251 volume 2.10230 ppm1 1.030 ppm2 7.887
 
! ############ hot_mothernoesy_072403.2252 assigned
assi (resid 34 and name HB)
     (resid 29 and name HA)
6 0.1 0.1 peak 2252 volume -2.51100 ppm1 1.551 ppm2 3.587
 
! ############ hot_mothernoesy_072403.2253 assigned
assi (resid 67 and name HD1#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 2253 volume 2.34970 ppm1 0.913 ppm2 6.799
 
! ############ hot_mothernoesy_072403.2264 assigned
assi (resid 21 and name HB#)
     (resid 22 and name HN)
6 0.1 0.1 peak 2264 volume -2.78470 ppm1 2.040 ppm2 8.189
 
! ############ hot_mothernoesy_072403.2267 assigned
assi (resid 21 and name HB#)
     (resid 21 and name HN)
6 0.1 0.1 peak 2267 volume -4.25790 ppm1 1.798 ppm2 8.027
 
! ############ hot_mothernoesy_072403.2268 assigned
assi (resid 67 and name HA)
     (resid 67 and name HD1#)
6 0.1 0.1 peak 2268 volume -17.71020 ppm1 4.657 ppm2 0.913
 
! ############ hot_mothernoesy_072403.2269 assigned
assi (resid 67 and name HA)
     (resid 68 and name HD#)
6 0.1 0.1 peak 2269 volume -10.61480 ppm1 4.657 ppm2 3.615
 
! ############ hot_mothernoesy_072403.2270 assigned
assi (resid 67 and name HA)
     (resid 68 and name HD#)
6 0.1 0.1 peak 2270 volume -17.19470 ppm1 4.664 ppm2 3.914
 
! ############ hot_mothernoesy_072403.2276 assigned
assi (resid 34 and name HA)
     (resid 34 and name HN)
6 0.1 0.1 peak 2276 volume 3.34180 ppm1 4.421 ppm2 8.639
 
! ############ hot_mothernoesy_072403.2280 assigned
assi (resid 32 and name HD1#)
     (resid 29 and name HA)
6 0.1 0.1 peak 2280 volume 2.06041 ppm1 0.609 ppm2 3.589
 
! ############ hot_mothernoesy_072403.2281 assigned
assi (resid 32 and name HD1#)
     (resid 70 and name HA#)
6 0.1 0.1 peak 2281 volume 3.77501 ppm1 0.611 ppm2 4.002
 
! ############ hot_mothernoesy_072403.2284 assigned
assi (resid 70 and name HA#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 2284 volume -2.81911 ppm1 3.988 ppm2 0.610
 
! ############ hot_mothernoesy_072403.2291 assigned
assi (resid 53 and name HE#)
     (resid 23 and name HA)
6 0.1 0.1 peak 2291 volume -1.46460 ppm1 7.129 ppm2 3.772
 
! ############ hot_mothernoesy_072403.2292 assigned
assi (resid 53 and name HE#)
     (resid 22 and name HB#)
6 0.1 0.1 peak 2292 volume -1.30733 ppm1 7.125 ppm2 1.673
 
! ############ hot_mothernoesy_072403.2294 assigned
assi (resid 53 and name HE#)
     (resid 23 and name HB#)
6 0.1 0.1 peak 2294 volume -1.00537 ppm1 7.134 ppm2 1.243
 
! ############ hot_mothernoesy_072403.2299 assigned
assi (resid 75 and name HB#)
     (resid 75 and name HE#)
6 0.1 0.1 peak 2299 volume -1.72084 ppm1 3.005 ppm2 6.844
 
! ############ hot_mothernoesy_072403.2302 assigned
assi (resid 53 and name HD#)
     (resid 54 and name HN)
6 0.1 0.1 peak 2302 volume -0.85091 ppm1 7.310 ppm2 7.795
 
! ############ hot_mothernoesy_072403.2303 assigned
assi (resid 53 and name HD#)
     (resid 53 and name HA)
6 0.1 0.1 peak 2303 volume -1.41575 ppm1 7.300 ppm2 3.694
 
! ############ hot_mothernoesy_072403.2304 assigned
assi (resid 53 and name HD#)
     (resid 53 and name HB#)
6 0.1 0.1 peak 2304 volume -1.08087 ppm1 7.296 ppm2 3.547
 
! ############ hot_mothernoesy_072403.2305 assigned
assi (resid 53 and name HD#)
     (resid 54 and name HG#)
6 0.1 0.1 peak 2305 volume -0.85626 ppm1 7.287 ppm2 2.937
 
! ############ hot_mothernoesy_072403.2306 assigned
assi (resid 53 and name HD#)
     (resid 53 and name HB#)
6 0.1 0.1 peak 2306 volume -0.84589 ppm1 7.294 ppm2 3.234
 
! ############ hot_mothernoesy_072403.2307 assigned
assi (resid 53 and name HD#)
     (resid 23 and name HB#)
6 0.1 0.1 peak 2307 volume -1.06820 ppm1 7.286 ppm2 1.253
 
! ############ hot_mothernoesy_072403.2308 assigned
assi (resid 53 and name HD#)
     (resid 22 and name HB#)
6 0.1 0.1 peak 2308 volume -1.16746 ppm1 7.297 ppm2 1.673
 
! ############ hot_mothernoesy_072403.2310 assigned
assi (resid 32 and name HG)
     (resid 28 and name HD#)
6 0.1 0.1 peak 2310 volume 1.05965 ppm1 1.232 ppm2 6.795
 
! ############ hot_mothernoesy_072403.2313 assigned
assi (resid 28 and name HE#)
     (resid 28 and name HN)
6 0.1 0.1 peak 2313 volume 1.24284 ppm1 6.455 ppm2 8.070
 
! ############ hot_mothernoesy_072403.2319 assigned
assi (resid 60 and name HE#)
     (resid 60 and name HA)
6 0.1 0.1 peak 2319 volume 1.45783 ppm1 6.926 ppm2 4.254
 
! ############ hot_mothernoesy_072403.2320 assigned
assi (resid 60 and name HE#)
     (resid 24 and name HB#)
6 0.1 0.1 peak 2320 volume 1.89235 ppm1 6.915 ppm2 3.162
 
! ############ hot_mothernoesy_072403.2323 assigned
assi (resid 53 and name HD#)
     (resid 23 and name HB#)
6 0.1 0.1 peak 2323 volume -0.77542 ppm1 7.290 ppm2 1.256
 
! ############ hot_mothernoesy_072403.2324 assigned
assi (resid 53 and name HD#)
     (resid 22 and name HB#)
6 0.1 0.1 peak 2324 volume -1.11696 ppm1 7.294 ppm2 1.678
 
! ############ hot_mothernoesy_072403.2327 assigned
assi (resid 53 and name HD#)
     (resid 53 and name HA)
6 0.1 0.1 peak 2327 volume -0.93566 ppm1 7.305 ppm2 3.713
 
! ############ hot_mothernoesy_072403.2330 assigned
assi (resid 23 and name HA)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 2330 volume 2.15194 ppm1 3.771 ppm2 0.739
 
! ############ hot_mothernoesy_072403.2333 assigned
assi (resid 41 and name HG2#)
     (resid 23 and name HA)
6 0.1 0.1 peak 2333 volume 1.09544 ppm1 0.727 ppm2 3.773
 
! ############ hot_mothernoesy_072403.2334 assigned
assi (resid 41 and name HG2#)
     (resid 44 and name HG#)
6 0.1 0.1 peak 2334 volume 2.85942 ppm1 0.726 ppm2 2.450
 
! ############ hot_mothernoesy_072403.2335 assigned
assi (resid 41 and name HG2#)
     (resid 42 and name HA)
6 0.1 0.1 peak 2335 volume 2.02903 ppm1 0.727 ppm2 2.913
 
! ############ hot_mothernoesy_072403.2336 assigned
assi (resid 23 and name HA)
     (resid 22 and name HB#)
6 0.1 0.1 peak 2336 volume 2.51495 ppm1 3.780 ppm2 1.667
 
! ############ hot_mothernoesy_072403.2338 assigned
assi (resid 22 and name HA)
     (resid 53 and name HE#)
6 0.1 0.1 peak 2338 volume 1.17891 ppm1 4.045 ppm2 7.132
 
! ############ hot_mothernoesy_072403.2339 assigned
assi (resid 53 and name HE#)
     (resid 22 and name HA)
6 0.1 0.1 peak 2339 volume -0.59421 ppm1 7.137 ppm2 4.050
 
! ############ hot_mothernoesy_072403.2344 assigned
assi (resid 15 and name HB#)
     (resid 12 and name HA)
6 0.1 0.1 peak 2344 volume -2.02292 ppm1 2.521 ppm2 4.159
 
! ############ hot_mothernoesy_072403.2345 assigned
assi (resid 15 and name HB#)
     (resid 15 and name HA)
6 0.1 0.1 peak 2345 volume -5.95619 ppm1 2.519 ppm2 4.543
 
! ############ hot_mothernoesy_072403.2351 assigned
assi (resid 12 and name HA)
     (resid 15 and name HA)
6 0.1 0.1 peak 2351 volume 1.98982 ppm1 4.161 ppm2 4.560
 
! ############ hot_mothernoesy_072403.2352 assigned
assi (resid 17 and name HG1#)
     (resid 20 and name HN)
6 0.1 0.1 peak 2352 volume 2.18475 ppm1 1.006 ppm2 8.638
 
! ############ hot_mothernoesy_072403.2353 assigned
assi (resid 17 and name HG1#)
     (resid 52 and name HE#)
6 0.1 0.1 peak 2353 volume 1.37439 ppm1 1.008 ppm2 6.955
 
! ############ hot_mothernoesy_072403.2354 assigned
assi (resid 17 and name HG1#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2354 volume 1.12421 ppm1 1.005 ppm2 7.161
 
! ############ hot_mothernoesy_072403.2355 assigned
assi (resid 52 and name HD#)
     (resid 52 and name HN)
6 0.1 0.1 peak 2355 volume -1.47960 ppm1 7.177 ppm2 8.004
 
! ############ hot_mothernoesy_072403.2358 assigned
assi (resid 52 and name HD#)
     (resid 53 and name HN)
6 0.1 0.1 peak 2358 volume -1.56171 ppm1 7.175 ppm2 8.753
 
! ############ hot_mothernoesy_072403.2359 assigned
assi (resid 17 and name HG2#)
     (resid 52 and name HE#)
6 0.1 0.1 peak 2359 volume 1.13442 ppm1 1.138 ppm2 6.955
 
! ############ hot_mothernoesy_072403.2360 assigned
assi (resid 17 and name HG2#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2360 volume 0.99942 ppm1 1.136 ppm2 7.143
 
! ############ hot_mothernoesy_072403.2361 assigned
assi (resid 17 and name HG2#)
     (resid 20 and name HN)
6 0.1 0.1 peak 2361 volume 2.33691 ppm1 1.141 ppm2 8.642
 
! ############ hot_mothernoesy_072403.2362 assigned
assi (resid 17 and name HG2#)
     (resid 15 and name HN)
6 0.1 0.1 peak 2362 volume 1.52538 ppm1 1.141 ppm2 8.745
 
! ############ hot_mothernoesy_072403.2367 assigned
assi (resid 19 and name HA)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2367 volume 1.61461 ppm1 4.066 ppm2 7.180
 
! ############ hot_mothernoesy_072403.2368 assigned
assi (resid 19 and name HA)
     (resid 53 and name HD#)
6 0.1 0.1 peak 2368 volume 1.58888 ppm1 4.069 ppm2 7.296
 
! ############ hot_mothernoesy_072403.2369 assigned
assi (resid 51 and name HA)
     (resid 51 and name HN)
6 0.1 0.1 peak 2369 volume 2.62030 ppm1 4.112 ppm2 8.700
 
! ############ hot_mothernoesy_072403.2370 assigned
assi (resid 53 and name HD#)
     (resid 19 and name HA)
6 0.1 0.1 peak 2370 volume -0.79894 ppm1 7.299 ppm2 4.042
 
! ############ hot_mothernoesy_072403.2371 assigned
assi (resid 21 and name HB#)
     (resid 23 and name HN)
6 0.1 0.1 peak 2371 volume -1.07786 ppm1 2.047 ppm2 8.355
 
! ############ hot_mothernoesy_072403.2372 assigned
assi (resid 21 and name HB#)
     (resid 22 and name HN)
6 0.1 0.1 peak 2372 volume -2.45901 ppm1 1.802 ppm2 8.189
 
! ############ hot_mothernoesy_072403.2373 assigned
assi (resid 21 and name HB#)
     (resid 23 and name HN)
6 0.1 0.1 peak 2373 volume -1.13590 ppm1 1.798 ppm2 8.360
 
! ############ hot_mothernoesy_072403.2376 assigned
assi (resid 26 and name HG2#)
     (resid 41 and name HN)
6 0.1 0.1 peak 2376 volume 1.81473 ppm1 1.392 ppm2 7.548
 
! ############ hot_mothernoesy_072403.2377 assigned
assi (resid 26 and name HA)
     (resid 41 and name HG1#)
6 0.1 0.1 peak 2377 volume 1.23697 ppm1 3.497 ppm2 0.734
 
! ############ hot_mothernoesy_072403.2378 assigned
assi (resid 28 and name HA)
     (resid 67 and name HD2#)
6 0.1 0.1 peak 2378 volume 1.52620 ppm1 3.718 ppm2 0.985
 
! ############ hot_mothernoesy_072403.2379 assigned
assi (resid 28 and name HA)
     (resid 27 and name HB#)
6 0.1 0.1 peak 2379 volume 1.15992 ppm1 3.715 ppm2 1.348
 
! ############ hot_mothernoesy_072403.2382 assigned
assi (resid 28 and name HA)
     (resid 28 and name HB#)
6 0.1 0.1 peak 2382 volume 2.07552 ppm1 3.720 ppm2 2.645
 
! ############ hot_mothernoesy_072403.2383 assigned
assi (resid 28 and name HA)
     (resid 28 and name HB#)
6 0.1 0.1 peak 2383 volume 1.85425 ppm1 3.718 ppm2 2.955
 
! ############ hot_mothernoesy_072403.2384 assigned
assi (resid 28 and name HA)
     (resid 28 and name HE#)
6 0.1 0.1 peak 2384 volume 2.03982 ppm1 3.719 ppm2 6.459
 
! ############ hot_mothernoesy_072403.2385 assigned
assi (resid 28 and name HA)
     (resid 28 and name HD#)
6 0.1 0.1 peak 2385 volume 7.18400 ppm1 3.716 ppm2 6.796
 
! ############ hot_mothernoesy_072403.2388 assigned
assi (resid 28 and name HA)
     (resid 28 and name HN)
6 0.1 0.1 peak 2388 volume 1.54845 ppm1 3.725 ppm2 8.069
 
! ############ hot_mothernoesy_072403.2389 assigned
assi (resid 28 and name HB#)
     (resid 28 and name HA)
6 0.1 0.1 peak 2389 volume -0.81200 ppm1 2.650 ppm2 3.745
 
! ############ hot_mothernoesy_072403.2391 assigned
assi (resid 33 and name HB#)
     (resid 33 and name HD2#)
6 0.1 0.1 peak 2391 volume -1.36660 ppm1 3.185 ppm2 6.776
 
! ############ hot_mothernoesy_072403.2395 assigned
assi (resid 24 and name HB#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 2395 volume 1.07029 ppm1 3.167 ppm2 6.456
 
! ############ hot_mothernoesy_072403.2399 assigned
assi (resid 64 and name HA)
     (resid 28 and name HD#)
6 0.1 0.1 peak 2399 volume 0.54605 ppm1 4.301 ppm2 6.803
 
! ############ hot_mothernoesy_072403.2400 assigned
assi (resid 64 and name HA)
     (resid 28 and name HE#)
6 0.1 0.1 peak 2400 volume 1.33411 ppm1 4.304 ppm2 6.448
 
! ############ hot_mothernoesy_072403.2401 assigned
assi (resid 28 and name HE#)
     (resid 64 and name HB#)
6 0.1 0.1 peak 2401 volume 1.47627 ppm1 6.457 ppm2 4.005
 
! ############ hot_mothernoesy_072403.2402 assigned
assi (resid 64 and name HB#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 2402 volume 1.13031 ppm1 4.047 ppm2 6.458
 
! ############ hot_mothernoesy_072403.2406 assigned
assi (resid 64 and name HB#)
     (resid 28 and name HE#)
6 0.1 0.1 peak 2406 volume 0.67989 ppm1 4.175 ppm2 6.454
 
! ############ hot_mothernoesy_072403.2407 assigned
assi (resid 67 and name HD2#)
     (resid 28 and name HA)
6 0.1 0.1 peak 2407 volume 1.11434 ppm1 0.989 ppm2 3.706
 
! ############ hot_mothernoesy_072403.2408 assigned
assi (resid 28 and name HD#)
     (resid 28 and name HN)
6 0.1 0.1 peak 2408 volume -2.22737 ppm1 6.794 ppm2 8.068
 
! ############ hot_mothernoesy_072403.2410 assigned
assi (resid 28 and name HD#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2410 volume -1.55690 ppm1 6.791 ppm2 0.156
 
! ############ hot_mothernoesy_072403.2411 assigned
assi (resid 28 and name HD#)
     (resid 29 and name HA)
6 0.1 0.1 peak 2411 volume -1.48420 ppm1 6.792 ppm2 3.521
 
! ############ hot_mothernoesy_072403.2412 assigned
assi (resid 28 and name HD#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 2412 volume -0.98870 ppm1 6.813 ppm2 0.614
 
! ############ hot_mothernoesy_072403.2413 assigned
assi (resid 28 and name HD#)
     (resid 27 and name HB#)
6 0.1 0.1 peak 2413 volume -1.57022 ppm1 6.795 ppm2 1.346
 
! ############ hot_mothernoesy_072403.2414 assigned
assi (resid 28 and name HB#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 2414 volume -1.86604 ppm1 2.952 ppm2 6.787
 
! ############ hot_mothernoesy_072403.2415 assigned
assi (resid 28 and name HB#)
     (resid 28 and name HD#)
6 0.1 0.1 peak 2415 volume -0.85089 ppm1 2.624 ppm2 6.794
 
! ############ hot_mothernoesy_072403.2417 assigned
assi (resid 27 and name HB#)
     (resid 28 and name HA)
6 0.1 0.1 peak 2417 volume 1.59260 ppm1 1.352 ppm2 3.751
 
! ############ hot_mothernoesy_072403.2418 assigned
assi (resid 29 and name HA)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2418 volume 1.29746 ppm1 3.581 ppm2 0.163
 
! ############ hot_mothernoesy_072403.2419 assigned
assi (resid 29 and name HA)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 2419 volume 1.03324 ppm1 3.585 ppm2 0.601
 
! ############ hot_mothernoesy_072403.2423 assigned
assi (resid 29 and name HA)
     (resid 34 and name HN)
6 0.1 0.1 peak 2423 volume 0.95715 ppm1 3.573 ppm2 8.630
 
! ############ hot_mothernoesy_072403.2424 assigned
assi (resid 29 and name HA)
     (resid 28 and name HD#)
6 0.1 0.1 peak 2424 volume 0.95760 ppm1 3.556 ppm2 6.805
 
! ############ hot_mothernoesy_072403.2426 assigned
assi (resid 52 and name HE#)
     (resid 16 and name HE#)
6 0.1 0.1 peak 2426 volume 1.87155 ppm1 6.984 ppm2 2.351
 
! ############ hot_mothernoesy_072403.2427 assigned
assi (resid 16 and name HE#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2427 volume -2.62481 ppm1 2.341 ppm2 7.174
 
! ############ hot_mothernoesy_072403.2428 assigned
assi (resid 16 and name HE#)
     (resid 16 and name HN)
6 0.1 0.1 peak 2428 volume -1.68346 ppm1 2.351 ppm2 7.988
 
! ############ hot_mothernoesy_072403.2429 assigned
assi (resid 16 and name HE#)
     (resid 16 and name HA)
6 0.1 0.1 peak 2429 volume -1.77285 ppm1 2.344 ppm2 3.851
 
! ############ hot_mothernoesy_072403.2431 assigned
assi (resid 52 and name HD#)
     (resid 55 and name HG#)
6 0.1 0.1 peak 2431 volume -1.29697 ppm1 7.171 ppm2 2.374
 
! ############ hot_mothernoesy_072403.2432 assigned
assi (resid 16 and name HA)
     (resid 16 and name HE#)
6 0.1 0.1 peak 2432 volume 1.65397 ppm1 3.846 ppm2 2.330
 
! ############ hot_mothernoesy_072403.2434 assigned
assi (resid 16 and name HA)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2434 volume 1.93806 ppm1 3.850 ppm2 7.170
 
! ############ hot_mothernoesy_072403.2435 assigned
assi (resid 16 and name HA)
     (resid 17 and name HN)
6 0.1 0.1 peak 2435 volume 1.64056 ppm1 3.848 ppm2 7.759
 
! ############ hot_mothernoesy_072403.2436 assigned
assi (resid 52 and name HD#)
     (resid 16 and name HA)
6 0.1 0.1 peak 2436 volume -0.93726 ppm1 7.170 ppm2 3.860
 
! ############ hot_mothernoesy_072403.2439 assigned
assi (resid 15 and name HB#)
     (resid 16 and name HA)
6 0.1 0.1 peak 2439 volume -0.77802 ppm1 2.515 ppm2 3.863
 
! ############ hot_mothernoesy_072403.2443 assigned
assi (resid 16 and name HD#)
     (resid 52 and name HE#)
6 0.1 0.1 peak 2443 volume 0.76599 ppm1 1.260 ppm2 6.986
 
! ############ hot_mothernoesy_072403.2444 assigned
assi (resid 16 and name HD#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2444 volume 0.88240 ppm1 1.265 ppm2 7.192
 
! ############ hot_mothernoesy_072403.2446 assigned
assi (resid 16 and name HD#)
     (resid 16 and name HA)
6 0.1 0.1 peak 2446 volume 1.23681 ppm1 1.252 ppm2 3.855
 
! ############ hot_mothernoesy_072403.2449 assigned
assi (resid 16 and name HA)
     (resid 16 and name HD#)
6 0.1 0.1 peak 2449 volume 2.39006 ppm1 3.845 ppm2 1.383
 
! ############ hot_mothernoesy_072403.2450 assigned
assi (resid 52 and name HE#)
     (resid 16 and name HD#)
6 0.1 0.1 peak 2450 volume 1.86561 ppm1 6.984 ppm2 1.250
 
! ############ hot_mothernoesy_072403.2451 assigned
assi (resid 16 and name HD#)
     (resid 16 and name HN)
6 0.1 0.1 peak 2451 volume 1.75321 ppm1 1.255 ppm2 7.993
 
! ############ hot_mothernoesy_072403.2452 assigned
assi (resid 16 and name HD#)
     (resid 52 and name HE#)
6 0.1 0.1 peak 2452 volume 1.05448 ppm1 1.364 ppm2 6.978
 
! ############ hot_mothernoesy_072403.2453 assigned
assi (resid 16 and name HD#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2453 volume 0.79503 ppm1 1.356 ppm2 7.150
 
! ############ hot_mothernoesy_072403.2457 assigned
assi (resid 32 and name HD1#)
     (resid 66 and name HE2#)
6 0.1 0.1 peak 2457 volume 2.29130 ppm1 0.611 ppm2 6.914
 
! ############ hot_mothernoesy_072403.2458 assigned
assi (resid 32 and name HD1#)
     (resid 66 and name HE2#)
6 0.1 0.1 peak 2458 volume 1.13609 ppm1 0.612 ppm2 7.514
 
! ############ hot_mothernoesy_072403.2459 assigned
assi (resid 32 and name HD1#)
     (resid 67 and name HN)
6 0.1 0.1 peak 2459 volume 1.33797 ppm1 0.612 ppm2 8.056
 
! ############ hot_mothernoesy_072403.2460 assigned
assi (resid 32 and name HD1#)
     (resid 70 and name HN)
6 0.1 0.1 peak 2460 volume 1.27048 ppm1 0.607 ppm2 8.474
 
! ############ hot_mothernoesy_072403.2461 assigned
assi (resid 32 and name HD1#)
     (resid 34 and name HN)
6 0.1 0.1 peak 2461 volume 0.73254 ppm1 0.614 ppm2 8.569
 
! ############ hot_mothernoesy_072403.2462 assigned
assi (resid 32 and name HD1#)
     (resid 63 and name HN)
6 0.1 0.1 peak 2462 volume 1.96469 ppm1 0.607 ppm2 7.654
 
! ############ hot_mothernoesy_072403.2464 assigned
assi (resid 71 and name HB#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 2464 volume 2.95688 ppm1 3.873 ppm2 0.611
 
! ############ hot_mothernoesy_072403.2465 assigned
assi (resid 71 and name HB#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2465 volume 0.53430 ppm1 3.861 ppm2 0.138
 
! ############ hot_mothernoesy_072403.2468 assigned
assi (resid 32 and name HD2#)
     (resid 34 and name HN)
6 0.1 0.1 peak 2468 volume 1.17412 ppm1 0.163 ppm2 8.620
 
! ############ hot_mothernoesy_072403.2470 assigned
assi (resid 32 and name HD2#)
     (resid 67 and name HN)
6 0.1 0.1 peak 2470 volume 0.79072 ppm1 0.154 ppm2 8.071
 
! ############ hot_mothernoesy_072403.2472 assigned
assi (resid 32 and name HD2#)
     (resid 66 and name HE2#)
6 0.1 0.1 peak 2472 volume 0.90258 ppm1 0.152 ppm2 7.524
 
! ############ hot_mothernoesy_072403.2474 assigned
assi (resid 60 and name HE#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2474 volume 0.87406 ppm1 6.914 ppm2 0.147
 
! ############ hot_mothernoesy_072403.2475 assigned
assi (resid 64 and name HA)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2475 volume 0.93633 ppm1 4.302 ppm2 0.157
 
! ############ hot_mothernoesy_072403.2476 assigned
assi (resid 64 and name HA)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 2476 volume 0.96761 ppm1 4.310 ppm2 0.607
 
! ############ hot_mothernoesy_072403.2480 assigned
assi (resid 63 and name HA)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 2480 volume 0.87602 ppm1 4.100 ppm2 0.629
 
! ############ hot_mothernoesy_072403.2481 assigned
assi (resid 63 and name HA)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2481 volume 0.91238 ppm1 4.108 ppm2 0.137
 
! ############ hot_mothernoesy_072403.2482 assigned
assi (resid 63 and name HA)
     (resid 63 and name HD1#)
6 0.1 0.1 peak 2482 volume 22.47628 ppm1 4.106 ppm2 0.803
 
! ############ hot_mothernoesy_072403.2484 assigned
assi (resid 34 and name HG2#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2484 volume 1.51075 ppm1 1.028 ppm2 0.160
 
! ############ hot_mothernoesy_072403.2486 assigned
assi (resid 32 and name HA)
     (resid 32 and name HG)
6 0.1 0.1 peak 2486 volume -2.32432 ppm1 4.163 ppm2 1.252
 
! ############ hot_mothernoesy_072403.2488 assigned
assi (resid 42 and name HA)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 2488 volume 2.22694 ppm1 2.926 ppm2 0.725
 
! ############ hot_mothernoesy_072403.2489 assigned
assi (resid 68 and name HD#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 2489 volume -1.10035 ppm1 3.610 ppm2 0.604
 
! ############ hot_mothernoesy_072403.2490 assigned
assi (resid 68 and name HD#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 2490 volume -0.58522 ppm1 3.609 ppm2 0.185
 
! ############ hot_mothernoesy_072403.2492 assigned
assi (resid 68 and name HD#)
     (resid 67 and name HN)
6 0.1 0.1 peak 2492 volume -1.74285 ppm1 3.611 ppm2 8.060
 
! ############ hot_mothernoesy_072403.2493 assigned
assi (resid 34 and name HG2#)
     (resid 60 and name HE#)
6 0.1 0.1 peak 2493 volume 1.33415 ppm1 1.030 ppm2 6.917
 
! ############ hot_mothernoesy_072403.2494 assigned
assi (resid 34 and name HG2#)
     (resid 35 and name HA)
6 0.1 0.1 peak 2494 volume 2.56366 ppm1 1.033 ppm2 4.196
 
! ############ hot_mothernoesy_072403.2495 assigned
assi (resid 68 and name HD#)
     (resid 68 and name HA)
6 0.1 0.1 peak 2495 volume -2.66526 ppm1 3.613 ppm2 4.455
 
! ############ hot_mothernoesy_072403.2496 assigned
assi (resid 34 and name HB)
     (resid 34 and name HA)
6 0.1 0.1 peak 2496 volume -1.37311 ppm1 1.544 ppm2 4.413
 
! ############ hot_mothernoesy_072403.2497 assigned
assi (resid 34 and name HB)
     (resid 33 and name HN)
6 0.1 0.1 peak 2497 volume -1.24651 ppm1 1.544 ppm2 7.883
 
! ############ hot_mothernoesy_072403.2499 assigned
assi (resid 36 and name HA)
     (resid 37 and name HB)
6 0.1 0.1 peak 2499 volume 2.72666 ppm1 4.255 ppm2 1.934
 
! ############ hot_mothernoesy_072403.2500 assigned
assi (resid 36 and name HA)
     (resid 37 and name HG1#)
6 0.1 0.1 peak 2500 volume 2.59437 ppm1 4.255 ppm2 1.521
 
! ############ hot_mothernoesy_072403.2501 assigned
assi (resid 37 and name HG1#)
     (resid 36 and name HA)
6 0.1 0.1 peak 2501 volume 1.19845 ppm1 1.482 ppm2 4.251
 
! ############ hot_mothernoesy_072403.2502 assigned
assi (resid 37 and name HG1#)
     (resid 37 and name HN)
6 0.1 0.1 peak 2502 volume 0.66071 ppm1 1.483 ppm2 8.608
 
! ############ hot_mothernoesy_072403.2505 assigned
assi (resid 37 and name HB)
     (resid 37 and name HN)
6 0.1 0.1 peak 2505 volume -2.61425 ppm1 1.938 ppm2 8.609
 
! ############ hot_mothernoesy_072403.2506 assigned
assi (resid 37 and name HB)
     (resid 37 and name HA)
6 0.1 0.1 peak 2506 volume -2.20636 ppm1 1.926 ppm2 4.496
 
! ############ hot_mothernoesy_072403.2507 assigned
assi (resid 37 and name HB)
     (resid 40 and name HN)
6 0.1 0.1 peak 2507 volume -1.71287 ppm1 1.944 ppm2 7.213
 
! ############ hot_mothernoesy_072403.2508 assigned
assi (resid 37 and name HB)
     (resid 38 and name HN)
6 0.1 0.1 peak 2508 volume -1.15639 ppm1 1.931 ppm2 9.345
 
! ############ hot_mothernoesy_072403.2509 assigned
assi (resid 42 and name HA)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 2509 volume 1.12510 ppm1 2.917 ppm2 0.959
 
! ############ hot_mothernoesy_072403.2510 assigned
assi (resid 44 and name HG#)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 2510 volume -1.07210 ppm1 2.474 ppm2 0.725
 
! ############ hot_mothernoesy_072403.2513 assigned
assi (resid 44 and name HG#)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 2513 volume -0.90876 ppm1 2.318 ppm2 0.728
 
! ############ hot_mothernoesy_072403.2517 assigned
assi (resid 41 and name HA)
     (resid 42 and name HN)
6 0.1 0.1 peak 2517 volume 2.27037 ppm1 3.528 ppm2 8.468
 
! ############ hot_mothernoesy_072403.2519 assigned
assi (resid 41 and name HA)
     (resid 22 and name HB#)
6 0.1 0.1 peak 2519 volume 1.37535 ppm1 3.533 ppm2 1.674
 
! ############ hot_mothernoesy_072403.2520 assigned
assi (resid 41 and name HA)
     (resid 44 and name HG#)
6 0.1 0.1 peak 2520 volume 2.91016 ppm1 3.531 ppm2 2.470
 
! ############ hot_mothernoesy_072403.2523 assigned
assi (resid 22 and name HB#)
     (resid 41 and name HA)
6 0.1 0.1 peak 2523 volume 1.87288 ppm1 1.680 ppm2 3.519
 
! ############ hot_mothernoesy_072403.2524 assigned
assi (resid 44 and name HG#)
     (resid 41 and name HA)
6 0.1 0.1 peak 2524 volume -2.91757 ppm1 2.473 ppm2 3.532
 
! ############ hot_mothernoesy_072403.2533 assigned
assi (resid 58 and name HA)
     (resid 59 and name HN)
6 0.1 0.1 peak 2533 volume 1.05937 ppm1 3.892 ppm2 7.420
 
! ############ hot_mothernoesy_072403.2538 assigned
assi (resid 52 and name HB#)
     (resid 52 and name HN)
6 0.1 0.1 peak 2538 volume -1.97959 ppm1 3.383 ppm2 7.997
 
! ############ hot_mothernoesy_072403.2539 assigned
assi (resid 52 and name HB#)
     (resid 53 and name HN)
6 0.1 0.1 peak 2539 volume -1.25481 ppm1 3.390 ppm2 8.751
 
! ############ hot_mothernoesy_072403.2540 assigned
assi (resid 52 and name HB#)
     (resid 52 and name HE#)
6 0.1 0.1 peak 2540 volume -0.89378 ppm1 3.386 ppm2 6.986
 
! ############ hot_mothernoesy_072403.2543 assigned
assi (resid 49 and name HB#)
     (resid 49 and name HN)
6 0.1 0.1 peak 2543 volume -0.94725 ppm1 1.646 ppm2 8.289
 
! ############ hot_mothernoesy_072403.2544 assigned
assi (resid 49 and name HB#)
     (resid 49 and name HD1#)
6 0.1 0.1 peak 2544 volume -2.49602 ppm1 1.635 ppm2 0.809
 
! ############ hot_mothernoesy_072403.2545 assigned
assi (resid 49 and name HB#)
     (resid 49 and name HG)
6 0.1 0.1 peak 2545 volume -2.92672 ppm1 1.649 ppm2 0.934
 
! ############ hot_mothernoesy_072403.2546 assigned
assi (resid 49 and name HB#)
     (resid 49 and name HB#)
6 0.1 0.1 peak 2546 volume -2.62193 ppm1 1.656 ppm2 2.170
 
! ############ hot_mothernoesy_072403.2547 assigned
assi (resid 49 and name HB#)
     (resid 49 and name HN)
6 0.1 0.1 peak 2547 volume -1.20422 ppm1 2.184 ppm2 8.280
 
! ############ hot_mothernoesy_072403.2548 assigned
assi (resid 49 and name HB#)
     (resid 49 and name HB#)
6 0.1 0.1 peak 2548 volume -2.01602 ppm1 2.172 ppm2 1.642
 
! ############ hot_mothernoesy_072403.2550 assigned
assi (resid 49 and name HB#)
     (resid 49 and name HG)
6 0.1 0.1 peak 2550 volume -3.28985 ppm1 2.165 ppm2 0.936
 
! ############ hot_mothernoesy_072403.2551 assigned
assi (resid 49 and name HB#)
     (resid 49 and name HD1#)
6 0.1 0.1 peak 2551 volume -2.24439 ppm1 2.181 ppm2 0.811
 
! ############ hot_mothernoesy_072403.2553 assigned
assi (resid 49 and name HB#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2553 volume -0.73353 ppm1 2.178 ppm2 7.177
 
! ############ hot_mothernoesy_072403.2558 assigned
assi (resid 72 and name HB#)
     (resid 75 and name HN)
6 0.1 0.1 peak 2558 volume -0.71783 ppm1 2.583 ppm2 7.863
 
! ############ hot_mothernoesy_072403.2567 assigned
assi (resid 52 and name HE#)
     (resid 52 and name HA)
6 0.1 0.1 peak 2567 volume 1.96290 ppm1 6.975 ppm2 4.332
 
! ############ hot_mothernoesy_072403.2568 assigned
assi (resid 52 and name HE#)
     (resid 52 and name HN)
6 0.1 0.1 peak 2568 volume 1.44556 ppm1 6.979 ppm2 8.001
 
! ############ hot_mothernoesy_072403.2569 assigned
assi (resid 20 and name HA)
     (resid 21 and name HN)
6 0.1 0.1 peak 2569 volume 1.88857 ppm1 4.313 ppm2 8.012
 
! ############ hot_mothernoesy_072403.2571 assigned
assi (resid 20 and name HA)
     (resid 52 and name HE#)
6 0.1 0.1 peak 2571 volume 2.43939 ppm1 4.328 ppm2 6.968
 
! ############ hot_mothernoesy_072403.2572 assigned
assi (resid 20 and name HA)
     (resid 20 and name HB#)
6 0.1 0.1 peak 2572 volume 5.14380 ppm1 4.319 ppm2 3.265
 
! ############ hot_mothernoesy_072403.2575 assigned
assi (resid 20 and name HA)
     (resid 23 and name HB#)
6 0.1 0.1 peak 2575 volume 4.92826 ppm1 4.326 ppm2 1.247
 
! ############ hot_mothernoesy_072403.2578 assigned
assi (resid 20 and name HB#)
     (resid 52 and name HE#)
6 0.1 0.1 peak 2578 volume -1.69697 ppm1 3.278 ppm2 6.977
 
! ############ hot_mothernoesy_072403.2579 assigned
assi (resid 20 and name HB#)
     (resid 20 and name HA)
6 0.1 0.1 peak 2579 volume -2.84828 ppm1 3.262 ppm2 4.315
 
! ############ hot_mothernoesy_072403.2589 assigned
assi (resid 56 and name HA)
     (resid 56 and name HN)
6 0.1 0.1 peak 2589 volume 2.26325 ppm1 3.677 ppm2 8.439
 
! ############ hot_mothernoesy_072403.2590 assigned
assi (resid 56 and name HA)
     (resid 57 and name HN)
6 0.1 0.1 peak 2590 volume 1.90393 ppm1 3.678 ppm2 8.754
 
! ############ hot_mothernoesy_072403.2591 assigned
assi (resid 56 and name HA)
     (resid 59 and name HN)
6 0.1 0.1 peak 2591 volume 2.41599 ppm1 3.680 ppm2 7.414
 
! ############ hot_mothernoesy_072403.2593 assigned
assi (resid 56 and name HA)
     (resid 59 and name HB#)
6 0.1 0.1 peak 2593 volume 2.96596 ppm1 3.685 ppm2 2.872
 
! ############ hot_mothernoesy_072403.2596 assigned
assi (resid 56 and name HA)
     (resid 56 and name HG#)
6 0.1 0.1 peak 2596 volume 1.98725 ppm1 3.691 ppm2 1.576
 
! ############ hot_mothernoesy_072403.2598 assigned
assi (resid 53 and name HD#)
     (resid 53 and name HN)
6 0.1 0.1 peak 2598 volume -0.79343 ppm1 7.286 ppm2 8.771
 
! ############ hot_mothernoesy_072403.2600 assigned
assi (resid 59 and name HB#)
     (resid 56 and name HA)
6 0.1 0.1 peak 2600 volume 1.00269 ppm1 2.911 ppm2 3.697
 
! ############ hot_mothernoesy_072403.2602 assigned
assi (resid 59 and name HB#)
     (resid 60 and name HN)
6 0.1 0.1 peak 2602 volume 0.53779 ppm1 2.920 ppm2 8.718
 
! ############ hot_mothernoesy_072403.2604 assigned
assi (resid 59 and name HB#)
     (resid 59 and name HB#)
6 0.1 0.1 peak 2604 volume 3.17543 ppm1 2.899 ppm2 3.078
 
! ############ hot_mothernoesy_072403.2605 assigned
assi (resid 59 and name HB#)
     (resid 59 and name HN)
6 0.1 0.1 peak 2605 volume 2.09768 ppm1 2.888 ppm2 7.420
 
! ############ hot_mothernoesy_072403.2608 assigned
assi (resid 53 and name HA)
     (resid 54 and name HN)
6 0.1 0.1 peak 2608 volume 1.70297 ppm1 3.716 ppm2 7.787
 
! ############ hot_mothernoesy_072403.2609 assigned
assi (resid 53 and name HA)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2609 volume 1.52398 ppm1 3.708 ppm2 7.173
 
! ############ hot_mothernoesy_072403.2612 assigned
assi (resid 51 and name HG2#)
     (resid 50 and name HN)
6 0.1 0.1 peak 2612 volume 1.16120 ppm1 1.330 ppm2 7.567
 
! ############ hot_mothernoesy_072403.2615 assigned
assi (resid 52 and name HA)
     (resid 55 and name HG#)
6 0.1 0.1 peak 2615 volume 2.10014 ppm1 4.349 ppm2 2.393
 
! ############ hot_mothernoesy_072403.2616 assigned
assi (resid 55 and name HG#)
     (resid 56 and name HN)
6 0.1 0.1 peak 2616 volume -2.32355 ppm1 2.395 ppm2 8.442
 
! ############ hot_mothernoesy_072403.2617 assigned
assi (resid 55 and name HG#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2617 volume -0.98520 ppm1 2.396 ppm2 7.171
 
! ############ hot_mothernoesy_072403.2618 assigned
assi (resid 55 and name HG#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2618 volume -1.24221 ppm1 2.165 ppm2 7.182
 
! ############ hot_mothernoesy_072403.2620 assigned
assi (resid 55 and name HG#)
     (resid 56 and name HN)
6 0.1 0.1 peak 2620 volume -3.06681 ppm1 2.174 ppm2 8.441
 
! ############ hot_mothernoesy_072403.2625 assigned
assi (resid 53 and name HB#)
     (resid 53 and name HA)
6 0.1 0.1 peak 2625 volume -1.70869 ppm1 3.235 ppm2 3.710
 
! ############ hot_mothernoesy_072403.2627 assigned
assi (resid 54 and name HG#)
     (resid 53 and name HE#)
6 0.1 0.1 peak 2627 volume -1.52239 ppm1 2.945 ppm2 7.126
 
! ############ hot_mothernoesy_072403.2628 assigned
assi (resid 54 and name HG#)
     (resid 53 and name HD#)
6 0.1 0.1 peak 2628 volume -2.28709 ppm1 2.941 ppm2 7.298
 
! ############ hot_mothernoesy_072403.2630 assigned
assi (resid 16 and name HG#)
     (resid 52 and name HD#)
6 0.1 0.1 peak 2630 volume 1.12364 ppm1 0.765 ppm2 7.167
 
! ############ hot_mothernoesy_072403.2631 assigned
assi (resid 16 and name HG#)
     (resid 52 and name HE#)
6 0.1 0.1 peak 2631 volume 1.56387 ppm1 0.751 ppm2 6.983
 
! ############ hot_mothernoesy_072403.2634 assigned
assi (resid 59 and name HB#)
     (resid 60 and name HN)
6 0.1 0.1 peak 2634 volume 0.85902 ppm1 3.058 ppm2 8.706
 
! ############ hot_mothernoesy_072403.2640 assigned
assi (resid 68 and name HA)
     (resid 68 and name HD#)
6 0.1 0.1 peak 2640 volume 3.00919 ppm1 4.457 ppm2 3.611
 
! ############ hot_mothernoesy_072403.2643 assigned
assi (resid 47 and name HA)
     (resid 50 and name HN)
6 0.1 0.1 peak 2643 volume 1.98587 ppm1 3.670 ppm2 7.556
 
! ############ hot_gnoesyNhsqc_051903.1 assigned
assi (resid 38 and name HN)
     (resid 37 and name HA)
6 0.1 0.1 peak 1 volume 73.74097 ppm1 9.329 ppm2 4.466
 
! ############ hot_gnoesyNhsqc_051903.6 assigned
assi (resid 38 and name HN)
     (resid 37 and name HB)
6 0.1 0.1 peak 6 volume 11.88596 ppm1 9.328 ppm2 1.936
 
! ############ hot_gnoesyNhsqc_051903.8 assigned
assi (resid 38 and name HN)
     (resid 37 and name HD1#)
6 0.1 0.1 peak 8 volume 55.89860 ppm1 9.323 ppm2 0.838
 
! ############ hot_gnoesyNhsqc_051903.50 assigned
assi (resid 52 and name HN)
     (resid 52 and name HA)
6 0.1 0.1 peak 50 volume 49.01030 ppm1 7.992 ppm2 4.358
 
! ############ hot_gnoesyNhsqc_051903.59 assigned
assi (resid 52 and name HN)
     (resid 51 and name HG2#)
6 0.1 0.1 peak 59 volume 18.60896 ppm1 7.992 ppm2 1.302
 
! ############ hot_gnoesyNhsqc_051903.77 assigned
assi (resid 19 and name HN)
     (resid 19 and name HG1#)
6 0.1 0.1 peak 77 volume 69.08827 ppm1 8.623 ppm2 1.506
 
! ############ hot_gnoesyNhsqc_051903.81 assigned
assi (resid 19 and name HN)
     (resid 19 and name HA)
6 0.1 0.1 peak 81 volume 22.36437 ppm1 8.619 ppm2 4.044
 
! ############ hot_gnoesyNhsqc_051903.115 assigned
assi (resid 50 and name HN)
     (resid 51 and name HG2#)
6 0.1 0.1 peak 115 volume 5.50705 ppm1 7.528 ppm2 1.317
 
! ############ hot_gnoesyNhsqc_051903.117 assigned
assi (resid 50 and name HN)
     (resid 47 and name HA)
6 0.1 0.1 peak 117 volume 13.86325 ppm1 7.527 ppm2 3.648
 
! ############ hot_gnoesyNhsqc_051903.121 assigned
assi (resid 67 and name HN)
     (resid 68 and name HD#)
6 0.1 0.1 peak 121 volume 16.00974 ppm1 8.054 ppm2 3.884
 
! ############ hot_gnoesyNhsqc_051903.122 assigned
assi (resid 67 and name HN)
     (resid 68 and name HD#)
6 0.1 0.1 peak 122 volume 13.87288 ppm1 8.055 ppm2 3.580
 
! ############ hot_gnoesyNhsqc_051903.128 assigned
assi (resid 67 and name HN)
     (resid 67 and name HD1#)
6 0.1 0.1 peak 128 volume 39.47304 ppm1 8.054 ppm2 0.900
 
! ############ hot_gnoesyNhsqc_051903.129 assigned
assi (resid 67 and name HN)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 129 volume 6.48385 ppm1 8.054 ppm2 0.580
 
! ############ hot_gnoesyNhsqc_051903.130 assigned
assi (resid 61 and name HN)
     (resid 61 and name HA)
6 0.1 0.1 peak 130 volume 22.18457 ppm1 9.157 ppm2 4.169
 
! ############ hot_gnoesyNhsqc_051903.134 assigned
assi (resid 61 and name HN)
     (resid 61 and name HB#)
6 0.1 0.1 peak 134 volume 48.71948 ppm1 9.157 ppm2 1.864
 
! ############ hot_gnoesyNhsqc_051903.136 assigned
assi (resid 61 and name HN)
     (resid 61 and name HD#)
6 0.1 0.1 peak 136 volume 15.87137 ppm1 9.155 ppm2 2.950
 
! ############ hot_gnoesyNhsqc_051903.167 assigned
assi (resid 22 and name HN)
     (resid 21 and name HB#)
6 0.1 0.1 peak 167 volume 27.13451 ppm1 8.167 ppm2 2.009
 
! ############ hot_gnoesyNhsqc_051903.176 assigned
assi (resid 22 and name HN)
     (resid 22 and name HB#)
6 0.1 0.1 peak 176 volume 92.58594 ppm1 8.163 ppm2 1.656
 
! ############ hot_gnoesyNhsqc_051903.183 assigned
assi (resid 42 and name HN)
     (resid 42 and name HB#)
6 0.1 0.1 peak 183 volume 110.99683 ppm1 8.449 ppm2 1.437
 
! ############ hot_gnoesyNhsqc_051903.184 assigned
assi (resid 42 and name HN)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 184 volume 51.51216 ppm1 8.447 ppm2 0.949
 
! ############ hot_gnoesyNhsqc_051903.193 assigned
assi (resid 26 and name HN)
     (resid 26 and name HG2#)
6 0.1 0.1 peak 193 volume 68.50545 ppm1 8.386 ppm2 1.361
 
! ############ hot_gnoesyNhsqc_051903.194 assigned
assi (resid 26 and name HN)
     (resid 26 and name HG1#)
6 0.1 0.1 peak 194 volume 70.15990 ppm1 8.385 ppm2 0.943
 
! ############ hot_gnoesyNhsqc_051903.199 assigned
assi (resid 22 and name HN)
     (resid 21 and name HD1#)
6 0.1 0.1 peak 199 volume 32.05183 ppm1 8.164 ppm2 0.961
 
! ############ hot_gnoesyNhsqc_051903.206 assigned
assi (resid 34 and name HN)
     (resid 29 and name HA)
6 0.1 0.1 peak 206 volume 17.92336 ppm1 8.613 ppm2 3.563
 
! ############ hot_gnoesyNhsqc_051903.211 assigned
assi (resid 34 and name HN)
     (resid 34 and name HG2#)
6 0.1 0.1 peak 211 volume 68.28639 ppm1 8.615 ppm2 0.992
 
! ############ hot_gnoesyNhsqc_051903.212 assigned
assi (resid 34 and name HN)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 212 volume 5.50206 ppm1 8.611 ppm2 0.589
 
! ############ hot_gnoesyNhsqc_051903.213 assigned
assi (resid 34 and name HN)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 213 volume 6.75662 ppm1 8.614 ppm2 0.122
 
! ############ hot_gnoesyNhsqc_051903.234 assigned
assi (resid 55 and name HN)
     (resid 55 and name HG#)
6 0.1 0.1 peak 234 volume 63.51801 ppm1 8.279 ppm2 2.367
 
! ############ hot_gnoesyNhsqc_051903.245 assigned
assi (resid 69 and name HN)
     (resid 68 and name HA)
6 0.1 0.1 peak 245 volume 255.06973 ppm1 8.431 ppm2 4.427
 
! ############ hot_gnoesyNhsqc_051903.268 assigned
assi (resid 36 and name HN)
     (resid 35 and name HA)
6 0.1 0.1 peak 268 volume 184.65962 ppm1 7.739 ppm2 4.175
 
! ############ hot_gnoesyNhsqc_051903.276 assigned
assi (resid 57 and name HN)
     (resid 56 and name HA)
6 0.1 0.1 peak 276 volume 11.78251 ppm1 8.753 ppm2 3.687
 
! ############ hot_gnoesyNhsqc_051903.283 assigned
assi (resid 57 and name HN)
     (resid 57 and name HG)
6 0.1 0.1 peak 283 volume 32.80605 ppm1 8.751 ppm2 0.898
 
! ############ hot_gnoesyNhsqc_051903.327 assigned
assi (resid 27 and name HN)
     (resid 28 and name HA)
6 0.1 0.1 peak 327 volume 19.41469 ppm1 7.862 ppm2 3.717
 
! ############ hot_gnoesyNhsqc_051903.331 assigned
assi (resid 31 and name HN)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 331 volume 6.62760 ppm1 7.861 ppm2 0.608
 
! ############ hot_gnoesyNhsqc_051903.359 assigned
assi (resid 41 and name HN)
     (resid 42 and name HB#)
6 0.1 0.1 peak 359 volume 21.91759 ppm1 7.532 ppm2 1.438
 
! ############ hot_gnoesyNhsqc_051903.360 assigned
assi (resid 41 and name HN)
     (resid 41 and name HG1#)
6 0.1 0.1 peak 360 volume 92.96261 ppm1 7.532 ppm2 0.953
 
! ############ hot_gnoesyNhsqc_051903.361 assigned
assi (resid 41 and name HN)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 361 volume 25.08619 ppm1 7.530 ppm2 0.701
 
! ############ hot_gnoesyNhsqc_051903.369 assigned
assi (resid 20 and name HN)
     (resid 20 and name HA)
6 0.1 0.1 peak 369 volume 23.59081 ppm1 8.621 ppm2 4.287
 
! ############ hot_gnoesyNhsqc_051903.370 assigned
assi (resid 20 and name HN)
     (resid 17 and name HA)
6 0.1 0.1 peak 370 volume 17.51625 ppm1 8.621 ppm2 3.875
 
! ############ hot_gnoesyNhsqc_051903.381 assigned
assi (resid 23 and name HN)
     (resid 21 and name HB#)
6 0.1 0.1 peak 381 volume 6.57461 ppm1 8.329 ppm2 2.015
 
! ############ hot_gnoesyNhsqc_051903.382 assigned
assi (resid 23 and name HN)
     (resid 22 and name HB#)
6 0.1 0.1 peak 382 volume 53.96293 ppm1 8.328 ppm2 1.652
 
! ############ hot_gnoesyNhsqc_051903.383 assigned
assi (resid 23 and name HN)
     (resid 23 and name HB#)
6 0.1 0.1 peak 383 volume 76.86515 ppm1 8.328 ppm2 1.221
 
! ############ hot_gnoesyNhsqc_051903.390 assigned
assi (resid 15 and name HN)
     (resid 15 and name HA)
6 0.1 0.1 peak 390 volume 56.16144 ppm1 8.740 ppm2 4.517
 
! ############ hot_gnoesyNhsqc_051903.398 assigned
assi (resid 15 and name HN)
     (resid 17 and name HG2#)
6 0.1 0.1 peak 398 volume 7.76817 ppm1 8.740 ppm2 1.102
 
! ############ hot_gnoesyNhsqc_051903.416 assigned
assi (resid 17 and name HN)
     (resid 17 and name HA)
6 0.1 0.1 peak 416 volume 60.79599 ppm1 7.730 ppm2 3.893
 
! ############ hot_gnoesyNhsqc_051903.433 assigned
assi (resid 16 and name HN)
     (resid 16 and name HG#)
6 0.1 0.1 peak 433 volume 24.74663 ppm1 7.970 ppm2 0.740
 
! ############ hot_gnoesyNhsqc_051903.435 assigned
assi (resid 16 and name HN)
     (resid 16 and name HA)
6 0.1 0.1 peak 435 volume 38.85895 ppm1 7.967 ppm2 3.844
 
! ############ hot_gnoesyNhsqc_051903.438 assigned
assi (resid 16 and name HN)
     (resid 16 and name HE#)
6 0.1 0.1 peak 438 volume 29.06356 ppm1 7.959 ppm2 2.288
 
! ############ hot_gnoesyNhsqc_051903.461 assigned
assi (resid 49 and name HN)
     (resid 49 and name HG)
6 0.1 0.1 peak 461 volume 19.75107 ppm1 8.270 ppm2 0.898
 
! ############ hot_gnoesyNhsqc_051903.464 assigned
assi (resid 49 and name HN)
     (resid 49 and name HD1#)
6 0.1 0.1 peak 464 volume 26.10202 ppm1 8.269 ppm2 0.785
 
! ############ hot_gnoesyNhsqc_051903.471 assigned
assi (resid 63 and name HN)
     (resid 63 and name HD1#)
6 0.1 0.1 peak 471 volume 46.75345 ppm1 7.618 ppm2 0.782
 
! ############ hot_gnoesyNhsqc_051903.483 assigned
assi (resid 28 and name HN)
     (resid 28 and name HA)
6 0.1 0.1 peak 483 volume 25.87944 ppm1 8.051 ppm2 3.701
 
! ############ hot_gnoesyNhsqc_051903.503 assigned
assi (resid 59 and name HN)
     (resid 58 and name HA)
6 0.1 0.1 peak 503 volume 16.84421 ppm1 7.391 ppm2 3.880
 
! ############ hot_gnoesyNhsqc_051903.513 assigned
assi (resid 53 and name HN)
     (resid 53 and name HA)
6 0.1 0.1 peak 513 volume 31.64417 ppm1 8.742 ppm2 3.677
 
! ############ hot_gnoesyNhsqc_051903.533 assigned
assi (resid 56 and name HN)
     (resid 56 and name HA)
6 0.1 0.1 peak 533 volume 20.66503 ppm1 8.424 ppm2 3.668
 
! ############ hot_gnoesyNhsqc_051903.545 assigned
assi (resid 75 and name HN)
     (resid 72 and name HB#)
6 0.1 0.1 peak 545 volume 25.33289 ppm1 7.855 ppm2 2.785
 
! ############ hot_gnoesyNhsqc_051903.565 assigned
assi (resid 21 and name HN)
     (resid 21 and name HB#)
6 0.1 0.1 peak 565 volume 51.54109 ppm1 7.986 ppm2 2.005
 
! ############ hot_gnoesyNhsqc_051903.567 assigned
assi (resid 21 and name HN)
     (resid 21 and name HD1#)
6 0.1 0.1 peak 567 volume 54.00645 ppm1 7.986 ppm2 0.964
 
! ############ hot_gnoesyNhsqc_051903.599 assigned
assi (resid 32 and name HN)
     (resid 32 and name HA)
6 0.1 0.1 peak 599 volume 33.79601 ppm1 7.730 ppm2 4.142
 
! ############ hot_gnoesyNhsqc_051903.607 assigned
assi (resid 32 and name HN)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 607 volume 19.16188 ppm1 7.729 ppm2 0.588
 
! ############ hot_gnoesyNhsqc_051903.608 assigned
assi (resid 32 and name HN)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 608 volume 18.06286 ppm1 7.733 ppm2 0.125
 
! ############ hot_gnoesyNhsqc_051903.617 assigned
assi (resid 29 and name HN)
     (resid 28 and name HA)
6 0.1 0.1 peak 617 volume 8.61492 ppm1 7.882 ppm2 3.690
 
! ############ hot_gnoesyNhsqc_051903.639 assigned
assi (resid 51 and name HN)
     (resid 51 and name HB)
6 0.1 0.1 peak 639 volume 39.14614 ppm1 8.684 ppm2 4.377
 
! ############ hot_gnoesyNhsqc_051903.640 assigned
assi (resid 51 and name HN)
     (resid 51 and name HA)
6 0.1 0.1 peak 640 volume 24.55116 ppm1 8.684 ppm2 4.090
 
! ############ hot_gnoesyNhsqc_051903.642 assigned
assi (resid 51 and name HN)
     (resid 51 and name HG2#)
6 0.1 0.1 peak 642 volume 23.53702 ppm1 8.684 ppm2 1.304
 
! ############ hot_gnoesyNhsqc_051903.667 assigned
assi (resid 54 and name HN)
     (resid 53 and name HA)
6 0.1 0.1 peak 667 volume 14.99720 ppm1 7.750 ppm2 3.665
 
! ############ hot_gnoesyNhsqc_051903.670 assigned
assi (resid 54 and name HN)
     (resid 54 and name HG#)
6 0.1 0.1 peak 670 volume 42.68156 ppm1 7.751 ppm2 2.946
 
! ############ hot_gnoesyNhsqc_051903.671 assigned
assi (resid 54 and name HN)
     (resid 54 and name HB#)
6 0.1 0.1 peak 671 volume 32.14315 ppm1 7.751 ppm2 2.366
 
! ############ hot_gnoesyNhsqc_051903.672 assigned
assi (resid 54 and name HN)
     (resid 54 and name HB#)
6 0.1 0.1 peak 672 volume 38.21783 ppm1 7.751 ppm2 2.119
 
! ############ hot_gnoesyNhsqc_051903.686 assigned
assi (resid 44 and name HN)
     (resid 41 and name HG2#)
6 0.1 0.1 peak 686 volume 10.52741 ppm1 7.287 ppm2 0.703
 
! ############ hot_gnoesyNhsqc_051903.696 assigned
assi (resid 33 and name HN)
     (resid 34 and name HD1#)
6 0.1 0.1 peak 696 volume 20.91226 ppm1 7.855 ppm2 0.979
 
! ############ hot_gnoesyNhsqc_051903.697 assigned
assi (resid 33 and name HN)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 697 volume 10.23582 ppm1 7.855 ppm2 0.582
 
! ############ hot_gnoesyNhsqc_051903.698 assigned
assi (resid 33 and name HN)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 698 volume 7.06436 ppm1 7.853 ppm2 0.128
 
! ############ hot_gnoesyNhsqc_051903.734 assigned
assi (resid 39 and name HN)
     (resid 38 and name HB#)
6 0.1 0.1 peak 734 volume 72.24970 ppm1 9.332 ppm2 1.487
 
! ############ hot_gnoesyNhsqc_051903.773 assigned
assi (resid 24 and name HN)
     (resid 23 and name HB#)
6 0.1 0.1 peak 773 volume 42.02295 ppm1 7.982 ppm2 1.222
 
! ############ hot_gnoesyNhsqc_051903.779 assigned
assi (resid 43 and name HN)
     (resid 43 and name HD#)
6 0.1 0.1 peak 779 volume 22.71556 ppm1 6.991 ppm2 3.177
 
! ############ hot_gnoesyNhsqc_051903.784 assigned
assi (resid 43 and name HN)
     (resid 42 and name HB#)
6 0.1 0.1 peak 784 volume 69.95876 ppm1 6.989 ppm2 1.442
 
! ############ hot_gnoesyNhsqc_051903.836 assigned
assi (resid 40 and name HE2#)
     (resid 37 and name HD1#)
6 0.1 0.1 peak 836 volume 17.00829 ppm1 7.629 ppm2 0.850
 
! ############ hot_gnoesyNhsqc_051903.845 assigned
assi (resid 66 and name HE2#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 845 volume 8.62853 ppm1 7.510 ppm2 0.576
 
! ############ hot_gnoesyNhsqc_051903.864 assigned
assi (resid 66 and name HE2#)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 864 volume 7.30703 ppm1 6.908 ppm2 0.585
 
! ############ hot_gnoesyNhsqc_051903.875 assigned
assi (resid 33 and name HD2#)
     (resid 33 and name HB#)
6 0.1 0.1 peak 875 volume 19.26346 ppm1 6.763 ppm2 3.159
 
! ############ hot_gnoesyNhsqc_051903.876 assigned
assi (resid 33 and name HD2#)
     (resid 33 and name HB#)
6 0.1 0.1 peak 876 volume 24.77305 ppm1 6.763 ppm2 2.795
 
! ############ hot_gnoesyNhsqc_051903.878 assigned
assi (resid 66 and name HE2#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 878 volume 5.23013 ppm1 7.510 ppm2 0.118
 
! ############ hot_gnoesyNhsqc_051903.897 assigned
assi (resid 70 and name HN)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 897 volume 6.11491 ppm1 8.468 ppm2 0.577
 
! ############ hot_gnoesyNhsqc_051903.1027 assigned
assi (resid 19 and name HN)
     (resid 52 and name HE#)
6 0.1 0.1 peak 1027 volume 10.08783 ppm1 8.616 ppm2 6.954
 
! ############ hot_gnoesyNhsqc_051903.1159 assigned
assi (resid 20 and name HN)
     (resid 52 and name HE#)
6 0.1 0.1 peak 1159 volume 14.16380 ppm1 8.621 ppm2 6.956
 
! ############ hot_gnoesyNhsqc_051903.1216 assigned
assi (resid 28 and name HN)
     (resid 28 and name HE#)
6 0.1 0.1 peak 1216 volume 5.41251 ppm1 8.046 ppm2 6.422
 
! ############ hot_gnoesyNhsqc_051903.1230 assigned
assi (resid 53 and name HN)
     (resid 54 and name HN)
6 0.1 0.1 peak 1230 volume 20.23413 ppm1 8.741 ppm2 7.750
 
! ############ hot_gnoesyNhsqc_051903.1232 assigned
assi (resid 53 and name HN)
     (resid 53 and name HD#)
6 0.1 0.1 peak 1232 volume 16.50090 ppm1 8.741 ppm2 7.263
 
! ############ hot_gnoesyNhsqc_051903.1233 assigned
assi (resid 53 and name HN)
     (resid 53 and name HE#)
6 0.1 0.1 peak 1233 volume 17.02567 ppm1 8.741 ppm2 7.138
 
! ############ hot_gnoesyNhsqc_051903.1234 assigned
assi (resid 53 and name HN)
     (resid 52 and name HE#)
6 0.1 0.1 peak 1234 volume 8.29619 ppm1 8.740 ppm2 7.007
 
! ############ hot_gnoesyNhsqc_051903.1309 assigned
assi (resid 54 and name HN)
     (resid 53 and name HN)
6 0.1 0.1 peak 1309 volume 20.99330 ppm1 7.751 ppm2 8.740
 
! ############ hot_gnoesyNhsqc_051903.1311 assigned
assi (resid 54 and name HN)
     (resid 53 and name HD#)
6 0.1 0.1 peak 1311 volume 12.86890 ppm1 7.751 ppm2 7.260
 
! ############ hot_gnoesyNhsqc_051903.1472 assigned
assi (resid 66 and name HE2#)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 1472 volume 4.05209 ppm1 6.915 ppm2 0.120
 
! ############ hot_gnoesyNhsqc_051903.1478 assigned
assi (resid 67 and name HN)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 1478 volume 4.47052 ppm1 8.054 ppm2 0.128
 
! ############ hot_gnoesyNhsqc_051903.1479 assigned
assi (resid 63 and name HN)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 1479 volume 3.48816 ppm1 7.616 ppm2 0.126
 
! ############ hot_gnoesyNhsqc_051903.1480 assigned
assi (resid 63 and name HN)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 1480 volume 4.62480 ppm1 7.622 ppm2 0.607
 
! ############ hot_gnoesyNhsqc_051903.1481 assigned
assi (resid 64 and name HN)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 1481 volume 5.04792 ppm1 7.753 ppm2 0.122
 
! ############ hot_gnoesyNhsqc_051903.1482 assigned
assi (resid 64 and name HN)
     (resid 32 and name HD1#)
6 0.1 0.1 peak 1482 volume 4.30694 ppm1 7.755 ppm2 0.579
 
! ############ hot_gnoesyNhsqc_051903.1483 assigned
assi (resid 31 and name HN)
     (resid 32 and name HD2#)
6 0.1 0.1 peak 1483 volume 5.37378 ppm1 7.863 ppm2 0.118
 
! ############ hot_gnoesyNhsqc_051903.1485 assigned
assi (resid 21 and name HN)
     (resid 20 and name HA)
6 0.1 0.1 peak 1485 volume 16.55458 ppm1 7.978 ppm2 4.291
 
! ############ hot_gnoesyNhsqc_051903.1493 assigned
assi (resid 56 and name HN)
     (resid 55 and name HG#)
6 0.1 0.1 peak 1493 volume 8.43438 ppm1 8.428 ppm2 2.352
 


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1  -5.123  12.873   2.230
    2   2H    MET   1          2HT       MET   1  -4.970  14.546   2.423
    3   3H    MET   1          3HT       MET   1  -6.250  13.724   3.163
    4    HA   MET   1           HA       MET   1  -4.555  14.284   4.772
    5   1HB   MET   1          2HB       MET   1  -4.711  11.329   4.143
    6   2HB   MET   1          1HB       MET   1  -4.200  12.013   5.680
    7   1HG   MET   1          2HG       MET   1  -6.408  12.990   5.990
    8   2HG   MET   1          1HG       MET   1  -6.924  12.331   4.438
    9   1HE   MET   1          1HE       MET   1  -8.536  11.800   7.176
   10   2HE   MET   1          2HE       MET   1  -8.921  10.097   6.933
   11   3HE   MET   1          3HE       MET   1  -9.003  11.221   5.577
   12    H    TYR   2           H        TYR   2  -3.377  13.535   1.796
   13    HA   TYR   2           HA       TYR   2  -1.309  13.364   0.870
   14   1HB   TYR   2          2HB       TYR   2  -0.536  14.653   3.491
   15   2HB   TYR   2          1HB       TYR   2   0.558  14.463   2.125
   16    HD1  TYR   2           1HD      TYR   2  -2.250  16.336   3.489
   17    HD2  TYR   2           2HD      TYR   2   0.190  15.746   0.054
   18    HE1  TYR   2           1HE      TYR   2  -3.058  18.461   2.556
   19    HE2  TYR   2           2HE      TYR   2  -0.612  17.871  -0.888
   20    HH   TYR   2           HH       TYR   2  -2.294  20.168   0.924
   21    H    ASP   3           H        ASP   3   1.208  12.832   1.973
   22    HA   ASP   3           HA       ASP   3   1.126  10.030   2.187
   23   1HB   ASP   3          2HB       ASP   3   3.373  11.883   3.005
   24   2HB   ASP   3          1HB       ASP   3   3.518  10.165   2.648
   25    H    TRP   4           H        TRP   4   2.100   8.778   4.014
   26    HA   TRP   4           HA       TRP   4   1.709   9.911   6.664
   27   1HB   TRP   4          2HB       TRP   4   0.221   8.050   7.341
   28   2HB   TRP   4          1HB       TRP   4  -0.512   9.059   6.094
   29    HD1  TRP   4           HD       TRP   4  -0.781   7.994   3.658
   30    HE1  TRP   4           1HE      TRP   4  -0.786   5.550   2.839
   31    HE3  TRP   4           3HE      TRP   4   1.239   5.766   7.778
   32    HZ2  TRP   4           2HZ      TRP   4  -0.034   3.013   3.822
   33    HZ3  TRP   4           3HZ      TRP   4   1.569   3.331   7.760
   34    HH2  TRP   4           HH       TRP   4   0.945   1.983   5.825
   35    H    ASN   5           H        ASN   5   2.961   7.607   4.476
   36    HA   ASN   5           HA       ASN   5   4.253   5.977   6.500
   37   1HB   ASN   5          2HB       ASN   5   3.411   5.587   3.839
   38   2HB   ASN   5          1HB       ASN   5   5.167   5.473   3.810
   39   1HD2  ASN   5          1HD2      ASN   5   3.041   3.459   3.466
   40   2HD2  ASN   5          2HD2      ASN   5   3.394   2.216   4.613
   41    H    ILE   6           H        ILE   6   5.015   8.702   6.525
   42    HA   ILE   6           HA       ILE   6   7.429   9.175   5.124
   43    HB   ILE   6           HB       ILE   6   6.555  10.445   7.709
   44   1HG1  ILE   6          2HG1      ILE   6   4.763  10.462   5.980
   45   2HG1  ILE   6          1HG1      ILE   6   5.330  12.065   6.424
   46   1HG2  ILE   6          1HG2      ILE   6   8.825  10.988   7.143
   47   2HG2  ILE   6          2HG2      ILE   6   7.806  12.396   6.835
   48   3HG2  ILE   6          3HG2      ILE   6   8.354  11.393   5.491
   49   1HD1  ILE   6          1HD1      ILE   6   4.980  11.849   4.024
   50   2HD1  ILE   6          2HD1      ILE   6   6.154  10.535   3.973
   51   3HD1  ILE   6          3HD1      ILE   6   6.671  12.164   4.406
   52    H    ALA   7           H        ALA   7   6.686   7.237   7.801
   53    HA   ALA   7           HA       ALA   7   9.030   7.456   9.328
   54   1HB   ALA   7          1HB       ALA   7   7.221   5.067   9.013
   55   2HB   ALA   7          2HB       ALA   7   6.998   6.385  10.164
   56   3HB   ALA   7          3HB       ALA   7   8.394   5.315  10.306
   57    H    ALA   8           H        ALA   8   8.545   6.180   6.244
   58    HA   ALA   8           HA       ALA   8  10.592   4.187   6.310
   59   1HB   ALA   8          1HB       ALA   8  10.229   4.044   3.890
   60   2HB   ALA   8          2HB       ALA   8   9.163   5.446   3.979
   61   3HB   ALA   8          3HB       ALA   8   8.719   3.947   4.795
   62    H    LYS   9           H        LYS   9  12.640   4.806   6.603
   63    HA   LYS   9           HA       LYS   9  13.600   7.317   5.497
   64   1HB   LYS   9          2HB       LYS   9  14.642   5.321   7.457
   65   2HB   LYS   9          1HB       LYS   9  15.795   6.363   6.633
   66   1HG   LYS   9          2HG       LYS   9  15.164   7.276   8.780
   67   2HG   LYS   9          1HG       LYS   9  14.606   8.324   7.478
   68   1HD   LYS   9          2HD       LYS   9  12.380   7.700   7.766
   69   2HD   LYS   9          1HD       LYS   9  12.812   6.235   8.654
   70   1HE   LYS   9          2HE       LYS   9  12.014   7.744  10.276
   71   2HE   LYS   9          1HE       LYS   9  13.774   7.746  10.410
   72   1HZ   LYS   9          1HZ       LYS   9  12.188   9.782   8.947
   73   2HZ   LYS   9          2HZ       LYS   9  13.864   9.792   9.172
   74   3HZ   LYS   9          3HZ       LYS   9  12.832   9.988  10.499
   75    H    SER  10           H        SER  10  14.554   3.881   5.338
   76    HA   SER  10           HA       SER  10  16.501   4.182   3.347
   77   1HB   SER  10          2HB       SER  10  16.323   2.149   4.698
   78   2HB   SER  10          1HB       SER  10  14.765   1.778   3.960
   79    HG   SER  10           HG       SER  10  15.886   0.781   2.501
   80    H    GLN  11           H        GLN  11  16.378   3.371   1.106
   81    HA   GLN  11           HA       GLN  11  14.176   4.613  -0.258
   82   1HB   GLN  11          2HB       GLN  11  16.478   4.775  -1.104
   83   2HB   GLN  11          1HB       GLN  11  16.510   3.035  -1.352
   84   1HG   GLN  11          2HG       GLN  11  14.690   3.249  -2.982
   85   2HG   GLN  11          1HG       GLN  11  14.709   4.997  -2.752
   86   1HE2  GLN  11          1HE2      GLN  11  16.364   2.258  -4.089
   87   2HE2  GLN  11          2HE2      GLN  11  17.480   3.148  -5.062
   88    H    GLU  12           H        GLU  12  15.451   1.293  -0.067
   89    HA   GLU  12           HA       GLU  12  13.503   0.091  -1.681
   90   1HB   GLU  12          2HB       GLU  12  15.288  -0.967   0.495
   91   2HB   GLU  12          1HB       GLU  12  14.140  -2.009  -0.332
   92   1HG   GLU  12          2HG       GLU  12  16.339  -2.205  -1.317
   93   2HG   GLU  12          1HG       GLU  12  15.205  -1.499  -2.467
   94    H    GLU  13           H        GLU  13  13.438   0.989   1.706
   95    HA   GLU  13           HA       GLU  13  11.146  -0.587   2.357
   96   1HB   GLU  13          2HB       GLU  13  12.288   1.816   3.795
   97   2HB   GLU  13          1HB       GLU  13  11.106   0.688   4.446
   98   1HG   GLU  13          2HG       GLU  13  13.893  -0.061   3.600
   99   2HG   GLU  13          1HG       GLU  13  13.401   0.291   5.256
  100    H    ARG  14           H        ARG  14  11.617   2.886   1.718
  101    HA   ARG  14           HA       ARG  14   8.911   3.598   2.047
  102   1HB   ARG  14          2HB       ARG  14   9.498   5.715   1.045
  103   2HB   ARG  14          1HB       ARG  14  10.779   5.211   2.137
  104   1HG   ARG  14          2HG       ARG  14  12.088   4.429   0.210
  105   2HG   ARG  14          1HG       ARG  14  10.813   5.008  -0.865
  106   1HD   ARG  14          2HD       ARG  14  11.128   7.278  -0.011
  107   2HD   ARG  14          1HD       ARG  14  12.400   6.697   1.062
  108    HE   ARG  14           HE       ARG  14  12.980   6.032  -1.629
  109   1HH1  ARG  14          1HH1      ARG  14  12.939   8.721   0.589
  110   2HH1  ARG  14          2HH1      ARG  14  14.177   9.595  -0.248
  111   1HH2  ARG  14          1HH2      ARG  14  14.607   7.180  -2.740
  112   2HH2  ARG  14          2HH2      ARG  14  15.124   8.722  -2.142
  113    H    ASP  15           H        ASP  15  10.727   2.641  -0.825
  114    HA   ASP  15           HA       ASP  15   8.776   3.327  -2.721
  115   1HB   ASP  15          2HB       ASP  15  10.906   1.189  -2.839
  116   2HB   ASP  15          1HB       ASP  15   9.959   1.736  -4.217
  117    H    LYS  16           H        LYS  16   9.405   0.155  -1.185
  118    HA   LYS  16           HA       LYS  16   7.347  -1.198  -2.532
  119   1HB   LYS  16          2HB       LYS  16   8.558  -1.810   0.165
  120   2HB   LYS  16          1HB       LYS  16   7.563  -2.913  -0.777
  121   1HG   LYS  16          2HG       LYS  16   9.440  -2.333  -2.603
  122   2HG   LYS  16          1HG       LYS  16  10.384  -2.137  -1.124
  123   1HD   LYS  16          2HD       LYS  16  10.667  -4.390  -1.659
  124   2HD   LYS  16          1HD       LYS  16   9.394  -4.407  -0.437
  125   1HE   LYS  16          2HE       LYS  16   7.719  -4.452  -2.288
  126   2HE   LYS  16          1HE       LYS  16   9.054  -4.620  -3.426
  127   1HZ   LYS  16          1HZ       LYS  16   8.295  -6.525  -1.284
  128   2HZ   LYS  16          2HZ       LYS  16   9.696  -6.666  -2.219
  129   3HZ   LYS  16          3HZ       LYS  16   8.175  -6.771  -2.953
  130    H    VAL  17           H        VAL  17   7.289   0.669   0.464
  131    HA   VAL  17           HA       VAL  17   4.642  -0.182   1.143
  132    HB   VAL  17           HB       VAL  17   4.790   1.607   2.847
  133   1HG1  VAL  17          1HG1      VAL  17   5.502  -0.740   3.259
  134   2HG1  VAL  17          2HG1      VAL  17   6.362   0.438   4.249
  135   3HG1  VAL  17          3HG1      VAL  17   7.147  -0.263   2.835
  136   1HG2  VAL  17          1HG2      VAL  17   6.170   3.203   1.920
  137   2HG2  VAL  17          2HG2      VAL  17   7.386   2.008   1.477
  138   3HG2  VAL  17          3HG2      VAL  17   7.173   2.464   3.168
  139    H    ASN  18           H        ASN  18   6.127   2.599  -0.406
  140    HA   ASN  18           HA       ASN  18   3.900   4.295  -0.476
  141   1HB   ASN  18          2HB       ASN  18   6.314   4.001  -2.255
  142   2HB   ASN  18          1HB       ASN  18   5.048   5.154  -2.651
  143   1HD2  ASN  18          1HD2      ASN  18   5.934   4.375   0.630
  144   2HD2  ASN  18          2HD2      ASN  18   6.692   5.881   0.996
  145    H    VAL  19           H        VAL  19   4.885   1.622  -2.511
  146    HA   VAL  19           HA       VAL  19   2.702   2.013  -4.373
  147    HB   VAL  19           HB       VAL  19   5.140   0.871  -4.675
  148   1HG1  VAL  19          1HG1      VAL  19   4.901  -1.533  -4.952
  149   2HG1  VAL  19          2HG1      VAL  19   3.243  -1.450  -4.359
  150   3HG1  VAL  19          3HG1      VAL  19   4.584  -1.059  -3.282
  151   1HG2  VAL  19          1HG2      VAL  19   4.177  -0.154  -6.778
  152   2HG2  VAL  19          2HG2      VAL  19   3.877   1.566  -6.536
  153   3HG2  VAL  19          3HG2      VAL  19   2.601   0.395  -6.208
  154    H    ASP  20           H        ASP  20   3.388   0.331  -1.475
  155    HA   ASP  20           HA       ASP  20   1.390  -1.691  -1.647
  156   1HB   ASP  20          2HB       ASP  20   3.307  -1.847  -0.097
  157   2HB   ASP  20          1HB       ASP  20   2.681  -0.473   0.807
  158    H    LEU  21           H        LEU  21   1.535   1.496  -0.132
  159    HA   LEU  21           HA       LEU  21  -1.113   1.433   0.878
  160   1HB   LEU  21          2HB       LEU  21  -0.791   3.866   1.212
  161   2HB   LEU  21          1HB       LEU  21   0.500   2.897   1.895
  162    HG   LEU  21           HG       LEU  21   1.678   3.428  -0.403
  163   1HD1  LEU  21          1HD1      LEU  21   1.164   5.690  -1.170
  164   2HD1  LEU  21          2HD1      LEU  21  -0.210   5.750  -0.064
  165   3HD1  LEU  21          3HD1      LEU  21  -0.200   4.596  -1.399
  166   1HD2  LEU  21          1HD2      LEU  21   2.754   5.338   0.670
  167   2HD2  LEU  21          2HD2      LEU  21   2.521   4.013   1.810
  168   3HD2  LEU  21          3HD2      LEU  21   1.449   5.413   1.855
  169    H    ALA  22           H        ALA  22   0.398   2.259  -2.098
  170    HA   ALA  22           HA       ALA  22  -1.625   3.802  -3.278
  171   1HB   ALA  22          1HB       ALA  22   0.636   3.652  -4.188
  172   2HB   ALA  22          2HB       ALA  22  -0.562   3.208  -5.404
  173   3HB   ALA  22          3HB       ALA  22   0.368   1.953  -4.583
  174    H    ALA  23           H        ALA  23  -0.934   0.338  -3.421
  175    HA   ALA  23           HA       ALA  23  -3.090  -0.434  -5.023
  176   1HB   ALA  23          1HB       ALA  23  -2.719  -2.675  -4.177
  177   2HB   ALA  23          2HB       ALA  23  -1.785  -2.035  -2.825
  178   3HB   ALA  23          3HB       ALA  23  -1.172  -1.882  -4.470
  179    H    SER  24           H        SER  24  -2.878   0.360  -1.658
  180    HA   SER  24           HA       SER  24  -5.361  -0.794  -0.862
  181   1HB   SER  24          2HB       SER  24  -3.389  -0.094   0.643
  182   2HB   SER  24          1HB       SER  24  -4.052   1.536   0.518
  183    HG   SER  24           HG       SER  24  -5.964   0.791   1.434
  184    H    GLY  25           H        GLY  25  -4.397   2.599  -1.513
  185   1HA   GLY  25          2HA       GLY  25  -6.926   3.712  -1.063
  186   2HA   GLY  25          1HA       GLY  25  -5.664   4.419  -2.059
  187    H    VAL  26           H        VAL  26  -5.455   2.491  -4.043
  188    HA   VAL  26           HA       VAL  26  -7.392   3.320  -5.833
  189    HB   VAL  26           HB       VAL  26  -5.670   0.845  -5.901
  190   1HG1  VAL  26          1HG1      VAL  26  -6.130   0.832  -8.339
  191   2HG1  VAL  26          2HG1      VAL  26  -7.361   2.067  -8.082
  192   3HG1  VAL  26          3HG1      VAL  26  -7.552   0.467  -7.362
  193   1HG2  VAL  26          1HG2      VAL  26  -4.290   2.163  -7.426
  194   2HG2  VAL  26          2HG2      VAL  26  -4.455   2.966  -5.864
  195   3HG2  VAL  26          3HG2      VAL  26  -5.390   3.531  -7.249
  196    H    ALA  27           H        ALA  27  -7.199   0.019  -4.418
  197    HA   ALA  27           HA       ALA  27  -9.936  -0.467  -5.273
  198   1HB   ALA  27          1HB       ALA  27  -8.037  -2.338  -3.876
  199   2HB   ALA  27          2HB       ALA  27  -8.197  -2.168  -5.626
  200   3HB   ALA  27          3HB       ALA  27  -9.553  -2.765  -4.670
  201    H    TYR  28           H        TYR  28  -8.179  -0.795  -2.178
  202    HA   TYR  28           HA       TYR  28 -10.226  -1.505  -0.527
  203   1HB   TYR  28          2HB       TYR  28  -7.610  -0.631  -0.191
  204   2HB   TYR  28          1HB       TYR  28  -8.559   0.504   0.755
  205    HD1  TYR  28           1HD      TYR  28  -7.593  -0.214   2.835
  206    HD2  TYR  28           2HD      TYR  28  -9.625  -2.999   0.338
  207    HE1  TYR  28           1HE      TYR  28  -7.643  -1.826   4.687
  208    HE2  TYR  28           2HE      TYR  28  -9.683  -4.618   2.188
  209    HH   TYR  28           HH       TYR  28  -8.974  -3.783   5.390
  210    H    LYS  29           H        LYS  29  -9.537   1.794  -1.647
  211    HA   LYS  29           HA       LYS  29 -11.476   2.973   0.090
  212   1HB   LYS  29          2HB       LYS  29  -9.712   4.379  -0.621
  213   2HB   LYS  29          1HB       LYS  29  -9.973   3.980  -2.309
  214   1HG   LYS  29          2HG       LYS  29 -12.246   5.258  -0.957
  215   2HG   LYS  29          1HG       LYS  29 -10.807   6.259  -1.161
  216   1HD   LYS  29          2HD       LYS  29 -10.809   5.740  -3.566
  217   2HD   LYS  29          1HD       LYS  29 -12.274   4.781  -3.346
  218   1HE   LYS  29          2HE       LYS  29 -13.475   6.759  -2.594
  219   2HE   LYS  29          1HE       LYS  29 -12.008   7.725  -2.750
  220   1HZ   LYS  29          1HZ       LYS  29 -13.478   8.006  -4.651
  221   2HZ   LYS  29          2HZ       LYS  29 -13.407   6.347  -4.980
  222   3HZ   LYS  29          3HZ       LYS  29 -12.015   7.297  -5.122
  223    H    GLU  30           H        GLU  30 -11.552   2.019  -3.339
  224    HA   GLU  30           HA       GLU  30 -14.152   3.123  -3.758
  225   1HB   GLU  30          2HB       GLU  30 -12.112   2.229  -5.390
  226   2HB   GLU  30          1HB       GLU  30 -13.367   1.017  -5.616
  227   1HG   GLU  30          2HG       GLU  30 -13.671   3.985  -5.992
  228   2HG   GLU  30          1HG       GLU  30 -13.552   2.776  -7.270
  229    H    ARG  31           H        ARG  31 -12.964   0.038  -2.663
  230    HA   ARG  31           HA       ARG  31 -15.409  -1.362  -3.195
  231   1HB   ARG  31          2HB       ARG  31 -13.136  -2.169  -1.376
  232   2HB   ARG  31          1HB       ARG  31 -14.402  -3.216  -2.001
  233   1HG   ARG  31          2HG       ARG  31 -12.410  -1.773  -3.733
  234   2HG   ARG  31          1HG       ARG  31 -12.209  -3.428  -3.159
  235   1HD   ARG  31          2HD       ARG  31 -13.090  -3.626  -5.322
  236   2HD   ARG  31          1HD       ARG  31 -14.455  -3.912  -4.244
  237    HE   ARG  31           HE       ARG  31 -14.942  -1.438  -4.692
  238   1HH1  ARG  31          1HH1      ARG  31 -13.486  -3.606  -7.000
  239   2HH1  ARG  31          2HH1      ARG  31 -14.086  -2.745  -8.378
  240   1HH2  ARG  31          1HH2      ARG  31 -15.734  -0.301  -6.498
  241   2HH2  ARG  31          2HH2      ARG  31 -15.365  -0.867  -8.092
  242    H    LEU  32           H        LEU  32 -13.802  -0.789  -0.043
  243    HA   LEU  32           HA       LEU  32 -16.307  -1.074   1.308
  244   1HB   LEU  32          2HB       LEU  32 -13.724  -0.123   2.520
  245   2HB   LEU  32          1HB       LEU  32 -15.066  -0.904   3.325
  246    HG   LEU  32           HG       LEU  32 -13.642  -2.660   3.243
  247   1HD1  LEU  32          1HD1      LEU  32 -15.561  -3.353   1.890
  248   2HD1  LEU  32          2HD1      LEU  32 -14.070  -4.170   1.407
  249   3HD1  LEU  32          3HD1      LEU  32 -14.705  -2.842   0.437
  250   1HD2  LEU  32          1HD2      LEU  32 -11.984  -1.106   1.963
  251   2HD2  LEU  32          2HD2      LEU  32 -12.480  -2.066   0.571
  252   3HD2  LEU  32          3HD2      LEU  32 -11.754  -2.856   1.973
  253    H    ASN  33           H        ASN  33 -14.032   1.526   2.104
  254    HA   ASN  33           HA       ASN  33 -15.425   3.697   1.109
  255   1HB   ASN  33          2HB       ASN  33 -16.381   4.448   3.383
  256   2HB   ASN  33          1HB       ASN  33 -17.302   3.277   2.448
  257   1HD2  ASN  33          1HD2      ASN  33 -18.344   2.448   4.236
  258   2HD2  ASN  33          2HD2      ASN  33 -17.539   1.479   5.420
  259    H    ILE  34           H        ILE  34 -12.781   2.481   2.089
  260    HA   ILE  34           HA       ILE  34 -11.654   3.969   4.117
  261    HB   ILE  34           HB       ILE  34 -10.446   2.766   1.637
  262   1HG1  ILE  34          2HG1      ILE  34  -9.449   1.206   3.268
  263   2HG1  ILE  34          1HG1      ILE  34 -10.224   2.089   4.577
  264   1HG2  ILE  34          1HG2      ILE  34  -8.212   3.173   2.619
  265   2HG2  ILE  34          2HG2      ILE  34  -8.967   4.223   3.819
  266   3HG2  ILE  34          3HG2      ILE  34  -9.032   4.651   2.110
  267   1HD1  ILE  34          1HD1      ILE  34 -11.665   0.639   2.370
  268   2HD1  ILE  34          2HD1      ILE  34 -12.405   1.460   3.743
  269   3HD1  ILE  34          3HD1      ILE  34 -11.410   0.028   4.004
  270    HA   PRO  35           HA       PRO  35 -11.800   8.040   2.316
  271   1HB   PRO  35          2HB       PRO  35 -10.820   9.424   4.371
  272   2HB   PRO  35          1HB       PRO  35 -12.396   8.626   4.480
  273   1HG   PRO  35          2HG       PRO  35  -9.725   7.670   5.473
  274   2HG   PRO  35          1HG       PRO  35 -11.278   7.723   6.338
  275   1HD   PRO  35          2HD       PRO  35 -10.330   5.472   5.147
  276   2HD   PRO  35          1HD       PRO  35 -12.065   5.826   5.288
  277    H    VAL  36           H        VAL  36 -10.184   7.593   0.664
  278    HA   VAL  36           HA       VAL  36  -7.792   9.148   1.056
  279    HB   VAL  36           HB       VAL  36  -6.266   7.399   0.197
  280   1HG1  VAL  36          1HG1      VAL  36  -7.673   6.689   2.771
  281   2HG1  VAL  36          2HG1      VAL  36  -6.315   7.799   2.582
  282   3HG1  VAL  36          3HG1      VAL  36  -6.095   6.077   2.271
  283   1HG2  VAL  36          1HG2      VAL  36  -7.882   6.009  -0.930
  284   2HG2  VAL  36          2HG2      VAL  36  -8.636   5.590   0.609
  285   3HG2  VAL  36          3HG2      VAL  36  -6.994   5.050   0.256
  286    H    ILE  37           H        ILE  37  -6.642   9.455  -1.071
  287    HA   ILE  37           HA       ILE  37  -8.651   9.442  -3.206
  288    HB   ILE  37           HB       ILE  37  -6.093  11.031  -3.053
  289   1HG1  ILE  37          2HG1      ILE  37  -7.632  11.739  -1.301
  290   2HG1  ILE  37          1HG1      ILE  37  -7.549  12.962  -2.565
  291   1HG2  ILE  37          1HG2      ILE  37  -6.879  10.595  -5.334
  292   2HG2  ILE  37          2HG2      ILE  37  -7.005  12.302  -4.910
  293   3HG2  ILE  37          3HG2      ILE  37  -8.447  11.288  -4.916
  294   1HD1  ILE  37          1HD1      ILE  37  -9.668  12.139  -3.480
  295   2HD1  ILE  37          2HD1      ILE  37  -9.824  12.664  -1.804
  296   3HD1  ILE  37          3HD1      ILE  37  -9.750  10.944  -2.186
  297    H    ALA  38           H        ALA  38  -8.429   8.204  -4.921
  298    HA   ALA  38           HA       ALA  38  -6.436   6.220  -5.092
  299   1HB   ALA  38          1HB       ALA  38  -7.482   5.588  -7.187
  300   2HB   ALA  38          2HB       ALA  38  -8.374   7.109  -7.218
  301   3HB   ALA  38          3HB       ALA  38  -8.700   5.920  -5.956
  302    H    GLU  39           H        GLU  39  -6.857   9.256  -6.918
  303    HA   GLU  39           HA       GLU  39  -4.634   8.708  -8.636
  304   1HB   GLU  39          2HB       GLU  39  -4.881  11.124  -9.285
  305   2HB   GLU  39          1HB       GLU  39  -6.313  10.131  -9.507
  306   1HG   GLU  39          2HG       GLU  39  -7.229  11.013  -7.406
  307   2HG   GLU  39          1HG       GLU  39  -5.807  12.040  -7.238
  308    H    GLN  40           H        GLN  40  -4.953   9.934  -5.474
  309    HA   GLN  40           HA       GLN  40  -2.685  11.606  -5.322
  310   1HB   GLN  40          2HB       GLN  40  -4.628  10.717  -3.546
  311   2HB   GLN  40          1HB       GLN  40  -3.135  10.043  -2.910
  312   1HG   GLN  40          2HG       GLN  40  -2.278  12.510  -3.322
  313   2HG   GLN  40          1HG       GLN  40  -3.996  12.866  -3.160
  314   1HE2  GLN  40          1HE2      GLN  40  -5.019  12.503  -1.186
  315   2HE2  GLN  40          2HE2      GLN  40  -4.132  12.269   0.279
  316    H    VAL  41           H        VAL  41  -3.144   8.148  -5.011
  317    HA   VAL  41           HA       VAL  41  -0.360   7.685  -4.356
  318    HB   VAL  41           HB       VAL  41  -0.914   5.433  -4.003
  319   1HG1  VAL  41          1HG1      VAL  41  -2.892   5.488  -2.560
  320   2HG1  VAL  41          2HG1      VAL  41  -3.352   7.042  -3.254
  321   3HG1  VAL  41          3HG1      VAL  41  -1.867   6.902  -2.311
  322   1HG2  VAL  41          1HG2      VAL  41  -2.073   5.080  -6.147
  323   2HG2  VAL  41          2HG2      VAL  41  -3.501   5.872  -5.484
  324   3HG2  VAL  41          3HG2      VAL  41  -2.933   4.356  -4.790
  325    H    ALA  42           H        ALA  42  -2.377   7.841  -7.108
  326    HA   ALA  42           HA       ALA  42  -1.033   6.065  -8.832
  327   1HB   ALA  42          1HB       ALA  42  -3.287   6.856  -9.272
  328   2HB   ALA  42          2HB       ALA  42  -2.217   7.208 -10.630
  329   3HB   ALA  42          3HB       ALA  42  -2.675   8.493  -9.512
  330    H    ARG  43           H        ARG  43  -0.375   9.356  -7.882
  331    HA   ARG  43           HA       ARG  43   1.537   9.743 -10.041
  332   1HB   ARG  43          2HB       ARG  43   1.842  11.992  -9.029
  333   2HB   ARG  43          1HB       ARG  43   0.177  11.639  -9.471
  334   1HG   ARG  43          2HG       ARG  43  -0.181  12.533  -7.421
  335   2HG   ARG  43          1HG       ARG  43   0.070  10.854  -6.941
  336   1HD   ARG  43          2HD       ARG  43   1.336  12.397  -5.524
  337   2HD   ARG  43          1HD       ARG  43   2.401  11.327  -6.436
  338    HE   ARG  43           HE       ARG  43   2.169  13.586  -7.971
  339   1HH1  ARG  43          1HH1      ARG  43   3.215  12.880  -4.723
  340   2HH1  ARG  43          2HH1      ARG  43   4.346  14.190  -4.666
  341   1HH2  ARG  43          1HH2      ARG  43   3.657  15.311  -7.905
  342   2HH2  ARG  43          2HH2      ARG  43   4.598  15.571  -6.475
  343    H    GLU  44           H        GLU  44   1.601   8.314  -7.032
  344    HA   GLU  44           HA       GLU  44   4.488   8.822  -6.759
  345   1HB   GLU  44          2HB       GLU  44   3.831   7.978  -4.312
  346   2HB   GLU  44          1HB       GLU  44   3.889   9.679  -4.766
  347   1HG   GLU  44          2HG       GLU  44   1.494   9.565  -5.284
  348   2HG   GLU  44          1HG       GLU  44   1.476   7.902  -4.712
  349    H    GLN  45           H        GLN  45   2.780   6.663  -8.082
  350    HA   GLN  45           HA       GLN  45   3.427   4.280  -6.577
  351   1HB   GLN  45          2HB       GLN  45   1.305   4.343  -7.736
  352   2HB   GLN  45          1HB       GLN  45   2.108   4.688  -9.263
  353   1HG   GLN  45          2HG       GLN  45   3.228   2.466  -9.087
  354   2HG   GLN  45          1HG       GLN  45   2.216   2.133  -7.682
  355   1HE2  GLN  45          1HE2      GLN  45  -0.002   1.842  -7.961
  356   2HE2  GLN  45          2HE2      GLN  45  -0.690   1.491  -9.507
  357    HA   PRO  46           HA       PRO  46   7.378   4.195  -8.810
  358   1HB   PRO  46          2HB       PRO  46   8.081   2.043  -6.971
  359   2HB   PRO  46          1HB       PRO  46   8.812   3.638  -7.148
  360   1HG   PRO  46          2HG       PRO  46   7.361   2.935  -4.974
  361   2HG   PRO  46          1HG       PRO  46   7.419   4.596  -5.592
  362   1HD   PRO  46          2HD       PRO  46   5.304   2.508  -5.969
  363   2HD   PRO  46          1HD       PRO  46   5.124   4.239  -5.623
  364    H    GLU  47           H        GLU  47   7.254   3.213 -10.719
  365    HA   GLU  47           HA       GLU  47   5.938   0.820 -11.290
  366   1HB   GLU  47          2HB       GLU  47   6.582   1.181 -13.446
  367   2HB   GLU  47          1HB       GLU  47   6.915   2.774 -12.785
  368   1HG   GLU  47          2HG       GLU  47   9.239   2.314 -12.617
  369   2HG   GLU  47          1HG       GLU  47   8.981   0.615 -13.004
  370    H    ASN  48           H        ASN  48   8.896   1.308  -9.748
  371    HA   ASN  48           HA       ASN  48  10.243  -1.063 -10.625
  372   1HB   ASN  48          2HB       ASN  48  10.717   0.691  -8.205
  373   2HB   ASN  48          1HB       ASN  48  11.795  -0.590  -8.750
  374   1HD2  ASN  48          1HD2      ASN  48  13.030  -0.289 -10.587
  375   2HD2  ASN  48          2HD2      ASN  48  13.246   1.265 -11.313
  376    H    LEU  49           H        LEU  49   7.782  -0.371  -8.358
  377    HA   LEU  49           HA       LEU  49   8.047  -3.070  -7.202
  378   1HB   LEU  49          2HB       LEU  49   6.944  -0.570  -5.917
  379   2HB   LEU  49          1HB       LEU  49   6.813  -2.173  -5.222
  380    HG   LEU  49           HG       LEU  49   8.595  -1.095  -4.101
  381   1HD1  LEU  49          1HD1      LEU  49   9.007  -3.437  -4.784
  382   2HD1  LEU  49          2HD1      LEU  49  10.486  -2.497  -4.584
  383   3HD1  LEU  49          3HD1      LEU  49   9.871  -2.839  -6.200
  384   1HD2  LEU  49          1HD2      LEU  49   8.907   0.678  -5.837
  385   2HD2  LEU  49          2HD2      LEU  49   9.879  -0.474  -6.753
  386   3HD2  LEU  49          3HD2      LEU  49  10.404   0.045  -5.154
  387    H    ARG  50           H        ARG  50   6.612  -1.862  -9.559
  388    HA   ARG  50           HA       ARG  50   3.863  -1.762  -9.224
  389   1HB   ARG  50          2HB       ARG  50   5.309  -1.352 -11.338
  390   2HB   ARG  50          1HB       ARG  50   5.078  -3.067 -11.642
  391   1HG   ARG  50          2HG       ARG  50   2.681  -2.772 -11.711
  392   2HG   ARG  50          1HG       ARG  50   2.857  -1.066 -11.295
  393   1HD   ARG  50          2HD       ARG  50   2.509  -1.201 -13.649
  394   2HD   ARG  50          1HD       ARG  50   4.201  -0.782 -13.384
  395    HE   ARG  50           HE       ARG  50   3.991  -3.567 -13.600
  396   1HH1  ARG  50          1HH1      ARG  50   3.654  -0.706 -15.562
  397   2HH1  ARG  50          2HH1      ARG  50   4.084  -1.510 -17.035
  398   1HH2  ARG  50          1HH2      ARG  50   4.557  -4.632 -15.534
  399   2HH2  ARG  50          2HH2      ARG  50   4.596  -3.742 -17.019
  400    H    THR  51           H        THR  51   6.007  -4.436  -9.112
  401    HA   THR  51           HA       THR  51   4.101  -6.502  -9.576
  402    HB   THR  51           HB       THR  51   6.785  -6.597  -8.183
  403    HG1  THR  51           1HG      THR  51   7.472  -7.398 -10.229
  404   1HG2  THR  51          1HG2      THR  51   5.064  -8.832  -9.252
  405   2HG2  THR  51          2HG2      THR  51   5.384  -8.489  -7.552
  406   3HG2  THR  51          3HG2      THR  51   6.696  -9.007  -8.610
  407    H    TYR  52           H        TYR  52   5.586  -5.137  -6.648
  408    HA   TYR  52           HA       TYR  52   4.270  -6.735  -4.767
  409   1HB   TYR  52          2HB       TYR  52   6.257  -5.328  -4.316
  410   2HB   TYR  52          1HB       TYR  52   5.268  -3.887  -4.501
  411    HD1  TYR  52           1HD      TYR  52   5.509  -2.937  -2.380
  412    HD2  TYR  52           2HD      TYR  52   4.302  -6.998  -2.724
  413    HE1  TYR  52           1HE      TYR  52   5.006  -2.976   0.023
  414    HE2  TYR  52           2HE      TYR  52   3.789  -7.055  -0.326
  415    HH   TYR  52           HH       TYR  52   4.449  -5.846   1.734
  416    H    PHE  53           H        PHE  53   3.534  -3.402  -5.776
  417    HA   PHE  53           HA       PHE  53   1.243  -2.909  -4.438
  418   1HB   PHE  53          2HB       PHE  53   1.715  -1.092  -5.685
  419   2HB   PHE  53          1HB       PHE  53   2.342  -2.043  -7.026
  420    HD1  PHE  53           1HD      PHE  53  -0.342  -0.059  -5.808
  421    HD2  PHE  53           2HD      PHE  53   0.616  -3.124  -8.608
  422    HE1  PHE  53           1HE      PHE  53  -2.366   0.485  -7.093
  423    HE2  PHE  53           2HE      PHE  53  -1.405  -2.579  -9.895
  424    HZ   PHE  53           HZ       PHE  53  -2.900  -0.774  -9.140
  425    H    MET  54           H        MET  54   1.498  -4.907  -7.365
  426    HA   MET  54           HA       MET  54  -1.300  -5.277  -7.628
  427   1HB   MET  54          2HB       MET  54  -0.293  -5.684  -9.629
  428   2HB   MET  54          1HB       MET  54   1.171  -6.314  -8.887
  429   1HG   MET  54          2HG       MET  54   0.062  -8.405  -8.431
  430   2HG   MET  54          1HG       MET  54  -1.435  -7.785  -9.124
  431   1HE   MET  54          1HE       MET  54  -1.710  -7.145 -11.696
  432   2HE   MET  54          2HE       MET  54  -0.424  -7.316 -12.890
  433   3HE   MET  54          3HE       MET  54  -0.285  -6.110 -11.610
  434    H    GLU  55           H        GLU  55   1.284  -7.011  -5.989
  435    HA   GLU  55           HA       GLU  55  -0.114  -9.362  -5.368
  436   1HB   GLU  55          2HB       GLU  55   2.082  -7.952  -3.842
  437   2HB   GLU  55          1HB       GLU  55   1.525  -9.578  -3.493
  438   1HG   GLU  55          2HG       GLU  55   2.201 -10.275  -5.747
  439   2HG   GLU  55          1HG       GLU  55   2.802  -8.648  -6.050
  440    H    ARG  56           H        ARG  56   0.338  -6.388  -3.459
  441    HA   ARG  56           HA       ARG  56  -1.410  -7.175  -1.379
  442   1HB   ARG  56          2HB       ARG  56   0.401  -5.239  -1.547
  443   2HB   ARG  56          1HB       ARG  56  -1.001  -4.288  -2.020
  444   1HG   ARG  56          2HG       ARG  56  -0.717  -4.017   0.316
  445   2HG   ARG  56          1HG       ARG  56  -2.122  -5.057   0.080
  446   1HD   ARG  56          2HD       ARG  56  -0.666  -7.027   0.463
  447   2HD   ARG  56          1HD       ARG  56   0.667  -5.931   0.819
  448    HE   ARG  56           HE       ARG  56  -1.429  -5.223   2.491
  449   1HH1  ARG  56          1HH1      ARG  56   0.620  -7.987   1.940
  450   2HH1  ARG  56          2HH1      ARG  56   0.542  -8.534   3.581
  451   1HH2  ARG  56          1HH2      ARG  56  -1.539  -5.936   4.656
  452   2HH2  ARG  56          2HH2      ARG  56  -0.684  -7.368   5.126
  453    H    LEU  57           H        LEU  57  -1.810  -5.339  -4.346
  454    HA   LEU  57           HA       LEU  57  -4.396  -4.402  -4.038
  455   1HB   LEU  57          2HB       LEU  57  -3.086  -3.689  -5.902
  456   2HB   LEU  57          1HB       LEU  57  -2.928  -5.329  -6.498
  457    HG   LEU  57           HG       LEU  57  -5.289  -5.376  -7.096
  458   1HD1  LEU  57          1HD1      LEU  57  -6.168  -3.942  -5.337
  459   2HD1  LEU  57          2HD1      LEU  57  -6.668  -3.360  -6.924
  460   3HD1  LEU  57          3HD1      LEU  57  -5.367  -2.545  -6.056
  461   1HD2  LEU  57          1HD2      LEU  57  -5.238  -3.732  -8.899
  462   2HD2  LEU  57          2HD2      LEU  57  -3.682  -4.547  -8.732
  463   3HD2  LEU  57          3HD2      LEU  57  -3.889  -2.907  -8.115
  464    H    ARG  58           H        ARG  58  -3.475  -7.403  -5.753
  465    HA   ARG  58           HA       ARG  58  -6.025  -8.402  -6.163
  466   1HB   ARG  58          2HB       ARG  58  -4.966 -10.618  -6.343
  467   2HB   ARG  58          1HB       ARG  58  -4.059  -9.385  -7.202
  468   1HG   ARG  58          2HG       ARG  58  -2.431  -9.279  -5.433
  469   2HG   ARG  58          1HG       ARG  58  -3.363 -10.420  -4.468
  470   1HD   ARG  58          2HD       ARG  58  -3.046 -12.124  -6.211
  471   2HD   ARG  58          1HD       ARG  58  -2.079 -10.977  -7.139
  472    HE   ARG  58           HE       ARG  58  -0.810 -11.053  -4.755
  473   1HH1  ARG  58          1HH1      ARG  58  -1.861 -13.524  -6.976
  474   2HH1  ARG  58          2HH1      ARG  58  -0.600 -14.628  -6.543
  475   1HH2  ARG  58          1HH2      ARG  58   0.857 -12.503  -4.182
  476   2HH2  ARG  58          2HH2      ARG  58   0.945 -14.049  -4.959
  477    H    HIS  59           H        HIS  59  -3.929  -8.628  -3.366
  478    HA   HIS  59           HA       HIS  59  -5.492 -10.445  -1.870
  479   1HB   HIS  59          2HB       HIS  59  -3.139  -9.898  -1.327
  480   2HB   HIS  59          1HB       HIS  59  -3.632  -8.270  -0.874
  481    HD1  HIS  59           1HD      HIS  59  -4.933  -8.005   1.365
  482    HD2  HIS  59           2HD      HIS  59  -3.632 -11.871   0.573
  483    HE1  HIS  59           1HE      HIS  59  -5.175  -9.252   3.533
  484    HE2  HIS  59           2HE      HIS  59  -4.275 -11.557   3.059
  485    H    TYR  60           H        TYR  60  -5.297  -6.901  -1.834
  486    HA   TYR  60           HA       TYR  60  -7.175  -6.297   0.060
  487   1HB   TYR  60          2HB       TYR  60  -6.251  -4.908  -2.420
  488   2HB   TYR  60          1HB       TYR  60  -7.639  -4.256  -1.557
  489    HD1  TYR  60           1HD      TYR  60  -4.323  -3.723  -1.978
  490    HD2  TYR  60           2HD      TYR  60  -7.080  -4.391   1.189
  491    HE1  TYR  60           1HE      TYR  60  -2.819  -2.550  -0.426
  492    HE2  TYR  60           2HE      TYR  60  -5.589  -3.217   2.748
  493    HH   TYR  60           HH       TYR  60  -3.196  -2.665   2.943
  494    H    ARG  61           H        ARG  61  -7.708  -7.354  -3.258
  495    HA   ARG  61           HA       ARG  61 -10.451  -6.708  -3.404
  496   1HB   ARG  61          2HB       ARG  61  -8.995  -7.288  -5.353
  497   2HB   ARG  61          1HB       ARG  61  -9.001  -8.959  -4.808
  498   1HG   ARG  61          2HG       ARG  61 -11.412  -9.068  -5.115
  499   2HG   ARG  61          1HG       ARG  61 -11.429  -7.381  -5.632
  500   1HD   ARG  61          2HD       ARG  61 -11.486  -8.788  -7.578
  501   2HD   ARG  61          1HD       ARG  61  -9.918  -7.988  -7.499
  502    HE   ARG  61           HE       ARG  61  -9.774 -10.510  -6.244
  503   1HH1  ARG  61          1HH1      ARG  61 -10.023  -9.053  -9.400
  504   2HH1  ARG  61          2HH1      ARG  61  -9.236 -10.366 -10.210
  505   1HH2  ARG  61          1HH2      ARG  61  -8.736 -12.243  -7.305
  506   2HH2  ARG  61          2HH2      ARG  61  -8.505 -12.179  -9.020
  507    H    GLN  62           H        GLN  62  -8.708  -9.609  -2.376
  508    HA   GLN  62           HA       GLN  62 -10.891 -11.295  -1.950
  509   1HB   GLN  62          2HB       GLN  62  -8.275 -11.128  -0.433
  510   2HB   GLN  62          1HB       GLN  62  -9.409 -12.469  -0.327
  511   1HG   GLN  62          2HG       GLN  62  -9.100 -12.856  -2.754
  512   2HG   GLN  62          1HG       GLN  62  -7.871 -11.591  -2.759
  513   1HE2  GLN  62          1HE2      GLN  62  -6.237 -12.985  -3.379
  514   2HE2  GLN  62          2HE2      GLN  62  -5.578 -14.177  -2.317
  515    H    LEU  63           H        LEU  63  -9.458  -8.800   0.085
  516    HA   LEU  63           HA       LEU  63 -11.303  -9.359   2.249
  517   1HB   LEU  63          2HB       LEU  63  -8.934  -7.586   1.887
  518   2HB   LEU  63          1HB       LEU  63 -10.130  -7.141   3.087
  519    HG   LEU  63           HG       LEU  63  -9.811  -9.289   4.226
  520   1HD1  LEU  63          1HD1      LEU  63  -7.971 -10.763   3.575
  521   2HD1  LEU  63          2HD1      LEU  63  -7.684  -9.772   2.144
  522   3HD1  LEU  63          3HD1      LEU  63  -9.200 -10.658   2.314
  523   1HD2  LEU  63          1HD2      LEU  63  -7.580  -8.860   5.101
  524   2HD2  LEU  63          2HD2      LEU  63  -8.472  -7.354   4.886
  525   3HD2  LEU  63          3HD2      LEU  63  -7.228  -7.815   3.725
  526    H    SER  64           H        SER  64 -11.171  -7.454  -0.579
  527    HA   SER  64           HA       SER  64 -12.636  -5.209   0.220
  528   1HB   SER  64          2HB       SER  64 -13.023  -4.795  -2.058
  529   2HB   SER  64          1HB       SER  64 -11.538  -5.743  -2.085
  530    HG   SER  64           HG       SER  64 -14.158  -6.762  -2.475
  531    H    LEU  65           H        LEU  65 -13.651  -8.451  -0.792
  532    HA   LEU  65           HA       LEU  65 -16.436  -7.872  -0.498
  533   1HB   LEU  65          2HB       LEU  65 -16.597  -9.666  -1.773
  534   2HB   LEU  65          1HB       LEU  65 -14.858  -9.855  -1.692
  535    HG   LEU  65           HG       LEU  65 -15.386 -11.124   0.539
  536   1HD1  LEU  65          1HD1      LEU  65 -17.934 -11.639  -0.967
  537   2HD1  LEU  65          2HD1      LEU  65 -17.828 -10.474   0.353
  538   3HD1  LEU  65          3HD1      LEU  65 -17.487 -12.180   0.653
  539   1HD2  LEU  65          1HD2      LEU  65 -15.401 -13.180  -0.700
  540   2HD2  LEU  65          2HD2      LEU  65 -14.361 -12.010  -1.518
  541   3HD2  LEU  65          3HD2      LEU  65 -15.976 -12.344  -2.144
  542    H    GLN  66           H        GLN  66 -13.996  -9.621   1.418
  543    HA   GLN  66           HA       GLN  66 -15.800 -10.486   3.418
  544   1HB   GLN  66          2HB       GLN  66 -13.996 -11.519   4.274
  545   2HB   GLN  66          1HB       GLN  66 -13.168 -10.972   2.828
  546   1HG   GLN  66          2HG       GLN  66 -11.776 -10.441   4.654
  547   2HG   GLN  66          1HG       GLN  66 -12.495  -8.923   4.111
  548   1HE2  GLN  66          1HE2      GLN  66 -12.479  -7.785   5.957
  549   2HE2  GLN  66          2HE2      GLN  66 -13.327  -8.224   7.393
  550    H    LEU  67           H        LEU  67 -13.755  -7.647   3.139
  551    HA   LEU  67           HA       LEU  67 -13.875  -6.439   5.560
  552   1HB   LEU  67          2HB       LEU  67 -13.850  -5.415   2.767
  553   2HB   LEU  67          1HB       LEU  67 -14.160  -4.258   4.038
  554    HG   LEU  67           HG       LEU  67 -11.681  -5.043   3.058
  555   1HD1  LEU  67          1HD1      LEU  67 -12.442  -3.589   5.574
  556   2HD1  LEU  67          2HD1      LEU  67 -12.091  -2.902   3.991
  557   3HD1  LEU  67          3HD1      LEU  67 -10.806  -3.658   4.928
  558   1HD2  LEU  67          1HD2      LEU  67 -10.506  -6.032   4.924
  559   2HD2  LEU  67          2HD2      LEU  67 -11.788  -7.108   4.369
  560   3HD2  LEU  67          3HD2      LEU  67 -12.007  -6.155   5.837
  561    HA   PRO  68           HA       PRO  68 -17.865  -4.988   6.766
  562   1HB   PRO  68          2HB       PRO  68 -17.634  -2.280   6.932
  563   2HB   PRO  68          1HB       PRO  68 -16.949  -3.396   8.127
  564   1HG   PRO  68          2HG       PRO  68 -15.612  -2.184   5.713
  565   2HG   PRO  68          1HG       PRO  68 -15.060  -2.159   7.411
  566   1HD   PRO  68          2HD       PRO  68 -14.053  -3.948   5.805
  567   2HD   PRO  68          1HD       PRO  68 -14.635  -4.493   7.392
  568    H    LYS  69           H        LYS  69 -19.175  -2.599   6.269
  569    HA   LYS  69           HA       LYS  69 -20.689  -3.061   4.085
  570   1HB   LYS  69          2HB       LYS  69 -21.467  -0.776   4.218
  571   2HB   LYS  69          1HB       LYS  69 -21.211  -1.408   5.840
  572   1HG   LYS  69          2HG       LYS  69 -19.048   0.148   4.496
  573   2HG   LYS  69          1HG       LYS  69 -20.412   0.985   5.235
  574   1HD   LYS  69          2HD       LYS  69 -19.042  -1.108   6.834
  575   2HD   LYS  69          1HD       LYS  69 -18.196   0.419   6.584
  576   1HE   LYS  69          2HE       LYS  69 -21.028   0.257   7.572
  577   2HE   LYS  69          1HE       LYS  69 -19.637   0.267   8.657
  578   1HZ   LYS  69          1HZ       LYS  69 -20.260   2.392   6.675
  579   2HZ   LYS  69          2HZ       LYS  69 -19.002   2.414   7.806
  580   3HZ   LYS  69          3HZ       LYS  69 -20.609   2.481   8.329
  581    H    GLY  70           H        GLY  70 -20.959  -1.781   2.077
  582   1HA   GLY  70          2HA       GLY  70 -19.886  -0.376   0.391
  583   2HA   GLY  70          1HA       GLY  70 -18.348  -1.070   0.889
  584    H    SER  71           H        SER  71 -19.105  -3.753   1.048
  585    HA   SER  71           HA       SER  71 -20.452  -4.767  -1.180
  586   1HB   SER  71          2HB       SER  71 -18.543  -5.495  -2.577
  587   2HB   SER  71          1HB       SER  71 -18.688  -3.738  -2.520
  588    HG   SER  71           HG       SER  71 -16.869  -3.606  -1.420
  589    H    ASP  72           H        ASP  72 -21.045  -6.033   0.702
  590    HA   ASP  72           HA       ASP  72 -19.360  -8.383   0.954
  591   1HB   ASP  72          2HB       ASP  72 -19.599  -8.340   3.433
  592   2HB   ASP  72          1HB       ASP  72 -18.532  -7.116   2.762
  593    HA   PRO  73           HA       PRO  73 -23.656  -9.810   0.769
  594   1HB   PRO  73          2HB       PRO  73 -22.487 -12.150  -0.492
  595   2HB   PRO  73          1HB       PRO  73 -23.584 -10.956  -1.176
  596   1HG   PRO  73          2HG       PRO  73 -21.021 -11.170  -1.984
  597   2HG   PRO  73          1HG       PRO  73 -21.885  -9.619  -1.935
  598   1HD   PRO  73          2HD       PRO  73 -19.975 -10.759   0.088
  599   2HD   PRO  73          1HD       PRO  73 -20.012  -9.130  -0.614
  600    H    ALA  74           H        ALA  74 -20.764 -11.639   1.590
  601    HA   ALA  74           HA       ALA  74 -22.292 -13.566   3.160
  602   1HB   ALA  74          1HB       ALA  74 -20.586 -14.439   1.683
  603   2HB   ALA  74          2HB       ALA  74 -20.162 -14.769   3.363
  604   3HB   ALA  74          3HB       ALA  74 -19.356 -13.465   2.489
  605    H    TYR  75           H        TYR  75 -21.937 -10.737   4.076
  606    HA   TYR  75           HA       TYR  75 -20.342 -11.160   6.499
  607   1HB   TYR  75          2HB       TYR  75 -20.294  -9.046   4.901
  608   2HB   TYR  75          1HB       TYR  75 -21.636  -8.563   5.924
  609    HD1  TYR  75           1HD      TYR  75 -21.292  -7.863   8.185
  610    HD2  TYR  75           2HD      TYR  75 -18.042  -9.370   5.888
  611    HE1  TYR  75           1HE      TYR  75 -19.718  -7.055   9.891
  612    HE2  TYR  75           2HE      TYR  75 -16.455  -8.563   7.589
  613    HH   TYR  75           HH       TYR  75 -17.463  -7.495  10.672
  614    H    GLN  76           H        GLN  76 -23.046 -12.273   5.880
  615    HA   GLN  76           HA       GLN  76 -25.064 -11.047   7.308
  616   1HB   GLN  76          2HB       GLN  76 -25.983 -13.397   7.587
  617   2HB   GLN  76          1HB       GLN  76 -25.674 -12.852   5.941
  618   1HG   GLN  76          2HG       GLN  76 -23.335 -13.935   6.437
  619   2HG   GLN  76          1HG       GLN  76 -24.290 -14.902   7.556
  620   1HE2  GLN  76          1HE2      GLN  76 -23.742 -14.073   4.227
  621   2HE2  GLN  76          2HE2      GLN  76 -24.620 -15.392   3.538
  622    H    LYS  77           H        LYS  77 -26.089 -11.930   9.344
  623    HA   LYS  77           HA       LYS  77 -24.028 -12.528  11.362
  624   1HB   LYS  77          2HB       LYS  77 -25.281 -11.094  12.943
  625   2HB   LYS  77          1HB       LYS  77 -24.637 -10.199  11.575
  626   1HG   LYS  77          2HG       LYS  77 -27.163 -10.934  10.740
  627   2HG   LYS  77          1HG       LYS  77 -27.376 -10.538  12.447
  628   1HD   LYS  77          2HD       LYS  77 -26.272  -8.376  12.070
  629   2HD   LYS  77          1HD       LYS  77 -26.091  -8.777  10.361
  630   1HE   LYS  77          2HE       LYS  77 -28.005  -7.329  10.666
  631   2HE   LYS  77          1HE       LYS  77 -28.539  -8.931  10.160
  632   1HZ   LYS  77          1HZ       LYS  77 -29.047  -9.432  12.485
  633   2HZ   LYS  77          2HZ       LYS  77 -29.929  -8.103  11.926
  634   3HZ   LYS  77          3HZ       LYS  77 -28.591  -7.866  12.932
  635    H    ASP  78           H        ASP  78 -24.556 -13.982  12.939
  636    HA   ASP  78           HA       ASP  78 -25.605 -15.751  13.906
  637   1HB   ASP  78          2HB       ASP  78 -28.123 -14.234  13.197
  638   2HB   ASP  78          1HB       ASP  78 -27.984 -15.517  14.394
  639    H    ASP  79           H        ASP  79 -25.514 -15.297  10.773
  640    HA   ASP  79           HA       ASP  79 -25.925 -16.526   8.911
  641   1HB   ASP  79          2HB       ASP  79 -26.358 -18.657  11.002
  642   2HB   ASP  79          1HB       ASP  79 -26.325 -18.989   9.272
  643    H    ALA  80           H        ALA  80 -28.176 -15.216  10.520
  644    HA   ALA  80           HA       ALA  80 -30.471 -16.764   9.587
  645   1HB   ALA  80          1HB       ALA  80 -30.471 -15.854  11.886
  646   2HB   ALA  80          2HB       ALA  80 -31.823 -15.269  10.915
  647   3HB   ALA  80          3HB       ALA  80 -30.432 -14.224  11.213
  648    H    VAL  81           H        VAL  81 -29.595 -13.302   9.537
  649    HA   VAL  81           HA       VAL  81 -30.761 -13.155   6.833
  650    HB   VAL  81           HB       VAL  81 -32.098 -11.919   8.488
  651   1HG1  VAL  81          1HG1      VAL  81 -30.340 -11.376  10.080
  652   2HG1  VAL  81          2HG1      VAL  81 -31.192  -9.919   9.568
  653   3HG1  VAL  81          3HG1      VAL  81 -29.598 -10.287   8.908
  654   1HG2  VAL  81          1HG2      VAL  81 -30.619 -10.138   6.552
  655   2HG2  VAL  81          2HG2      VAL  81 -32.167  -9.769   7.312
  656   3HG2  VAL  81          3HG2      VAL  81 -32.038 -11.123   6.190
  657    H    LYS  82           H        LYS  82 -29.726 -11.837   5.300
  658    HA   LYS  82           HA       LYS  82 -26.875 -11.454   5.826
  659   1HB   LYS  82          2HB       LYS  82 -26.806 -11.115   3.294
  660   2HB   LYS  82          1HB       LYS  82 -27.184 -12.728   3.876
  661   1HG   LYS  82          2HG       LYS  82 -29.424 -10.866   3.273
  662   2HG   LYS  82          1HG       LYS  82 -28.558 -11.628   1.937
  663   1HD   LYS  82          2HD       LYS  82 -29.051 -13.824   2.816
  664   2HD   LYS  82          1HD       LYS  82 -29.798 -13.116   4.250
  665   1HE   LYS  82          2HE       LYS  82 -30.775 -12.786   1.415
  666   2HE   LYS  82          1HE       LYS  82 -31.465 -13.877   2.614
  667   1HZ   LYS  82          1HZ       LYS  82 -31.988 -11.948   3.992
  668   2HZ   LYS  82          2HZ       LYS  82 -32.739 -11.845   2.481
  669   3HZ   LYS  82          3HZ       LYS  82 -31.364 -10.914   2.806
  670    H    LYS  83           H        LYS  83 -25.863  -9.521   5.725
  671    HA   LYS  83           HA       LYS  83 -27.007  -7.190   4.562
  672   1HB   LYS  83          2HB       LYS  83 -28.400  -7.305   6.587
  673   2HB   LYS  83          1HB       LYS  83 -26.951  -7.328   7.583
  674   1HG   LYS  83          2HG       LYS  83 -26.369  -5.099   6.851
  675   2HG   LYS  83          1HG       LYS  83 -27.753  -5.071   5.757
  676   1HD   LYS  83          2HD       LYS  83 -29.256  -5.305   7.702
  677   2HD   LYS  83          1HD       LYS  83 -27.851  -5.250   8.769
  678   1HE   LYS  83          2HE       LYS  83 -28.954  -3.070   8.616
  679   2HE   LYS  83          1HE       LYS  83 -27.312  -3.015   7.975
  680   1HZ   LYS  83          1HZ       LYS  83 -28.211  -3.165   5.740
  681   2HZ   LYS  83          2HZ       LYS  83 -28.870  -1.834   6.549
  682   3HZ   LYS  83          3HZ       LYS  83 -29.789  -3.240   6.349
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1  -5.991   8.717   4.353
    2   2H    MET   1          2HT       MET   1  -7.234   8.636   5.496
    3   3H    MET   1          3HT       MET   1  -5.625   8.744   6.004
    4    HA   MET   1           HA       MET   1  -7.117  10.829   4.520
    5   1HB   MET   1          2HB       MET   1  -6.116  10.884   7.373
    6   2HB   MET   1          1HB       MET   1  -7.096  12.102   6.569
    7   1HG   MET   1          2HG       MET   1  -8.597  10.954   7.920
    8   2HG   MET   1          1HG       MET   1  -8.855  10.273   6.316
    9   1HE   MET   1          1HE       MET   1  -9.452   7.224   8.729
   10   2HE   MET   1          2HE       MET   1 -10.113   8.137   7.373
   11   3HE   MET   1          3HE       MET   1  -9.910   8.915   8.941
   12    H    TYR   2           H        TYR   2  -5.707  11.710   3.144
   13    HA   TYR   2           HA       TYR   2  -3.832  12.677   2.292
   14   1HB   TYR   2          2HB       TYR   2  -3.186  13.255   5.193
   15   2HB   TYR   2          1HB       TYR   2  -2.512  14.079   3.790
   16    HD1  TYR   2           1HD      TYR   2  -5.256  13.918   6.126
   17    HD2  TYR   2           2HD      TYR   2  -4.029  15.492   2.367
   18    HE1  TYR   2           1HE      TYR   2  -7.090  15.553   6.217
   19    HE2  TYR   2           2HE      TYR   2  -5.858  17.132   2.450
   20    HH   TYR   2           HH       TYR   2  -7.664  17.732   5.269
   21    H    ASP   3           H        ASP   3  -1.224  12.837   3.018
   22    HA   ASP   3           HA       ASP   3  -0.345  10.127   2.687
   23   1HB   ASP   3          2HB       ASP   3   1.944  11.165   2.693
   24   2HB   ASP   3          1HB       ASP   3   0.843  11.837   1.492
   25    H    TRP   4           H        TRP   4   1.621   9.380   4.048
   26    HA   TRP   4           HA       TRP   4   1.646  10.219   6.793
   27   1HB   TRP   4          2HB       TRP   4   0.928   8.026   7.714
   28   2HB   TRP   4          1HB       TRP   4  -0.365   8.871   6.870
   29    HD1  TRP   4           HD       TRP   4   2.239   6.099   6.044
   30    HE1  TRP   4           1HE      TRP   4   1.102   4.394   4.485
   31    HE3  TRP   4           3HE      TRP   4  -2.310   8.378   5.519
   32    HZ2  TRP   4           2HZ      TRP   4  -1.390   4.056   3.208
   33    HZ3  TRP   4           3HZ      TRP   4  -4.014   7.295   4.113
   34    HH2  TRP   4           HH       TRP   4  -3.563   5.180   2.981
   35    H    ASN   5           H        ASN   5   2.934   8.601   4.137
   36    HA   ASN   5           HA       ASN   5   4.895   7.056   5.584
   37   1HB   ASN   5          2HB       ASN   5   3.931   6.375   3.360
   38   2HB   ASN   5          1HB       ASN   5   4.843   7.691   2.630
   39   1HD2  ASN   5          1HD2      ASN   5   5.064   4.631   4.297
   40   2HD2  ASN   5          2HD2      ASN   5   6.683   4.265   3.818
   41    H    ILE   6           H        ILE   6   4.949   9.789   6.274
   42    HA   ILE   6           HA       ILE   6   7.181  11.010   4.903
   43    HB   ILE   6           HB       ILE   6   5.899  11.912   7.479
   44   1HG1  ILE   6          2HG1      ILE   6   5.170  12.664   4.641
   45   2HG1  ILE   6          1HG1      ILE   6   4.190  11.686   5.729
   46   1HG2  ILE   6          1HG2      ILE   6   7.482  13.412   5.395
   47   2HG2  ILE   6          2HG2      ILE   6   8.067  12.919   6.982
   48   3HG2  ILE   6          3HG2      ILE   6   6.772  14.107   6.851
   49   1HD1  ILE   6          1HD1      ILE   6   3.289  13.880   5.714
   50   2HD1  ILE   6          2HD1      ILE   6   4.873  14.600   5.996
   51   3HD1  ILE   6          3HD1      ILE   6   4.095  13.657   7.265
   52    H    ALA   7           H        ALA   7   6.688   8.901   7.538
   53    HA   ALA   7           HA       ALA   7   9.135   9.557   8.921
   54   1HB   ALA   7          1HB       ALA   7   7.269   7.220   9.302
   55   2HB   ALA   7          2HB       ALA   7   7.181   8.759  10.160
   56   3HB   ALA   7          3HB       ALA   7   8.572   7.699  10.389
   57    H    ALA   8           H        ALA   8   8.600   8.099   6.072
   58    HA   ALA   8           HA       ALA   8  10.100   5.732   6.204
   59   1HB   ALA   8          1HB       ALA   8   9.608   7.543   3.846
   60   2HB   ALA   8          2HB       ALA   8   8.596   6.187   4.354
   61   3HB   ALA   8          3HB       ALA   8  10.234   5.895   3.760
   62    H    LYS   9           H        LYS   9  12.250   5.307   6.006
   63    HA   LYS   9           HA       LYS   9  14.047   7.622   5.726
   64   1HB   LYS   9          2HB       LYS   9  14.056   6.839   8.020
   65   2HB   LYS   9          1HB       LYS   9  14.344   5.189   7.492
   66   1HG   LYS   9          2HG       LYS   9  16.310   7.284   6.732
   67   2HG   LYS   9          1HG       LYS   9  16.290   6.695   8.395
   68   1HD   LYS   9          2HD       LYS   9  16.391   4.849   6.027
   69   2HD   LYS   9          1HD       LYS   9  17.851   5.503   6.777
   70   1HE   LYS   9          2HE       LYS   9  15.733   3.845   8.146
   71   2HE   LYS   9          1HE       LYS   9  17.325   3.279   7.646
   72   1HZ   LYS   9          1HZ       LYS   9  16.775   5.379   9.673
   73   2HZ   LYS   9          2HZ       LYS   9  18.315   4.893   9.171
   74   3HZ   LYS   9          3HZ       LYS   9  17.310   3.804   9.988
   75    H    SER  10           H        SER  10  13.864   4.084   5.390
   76    HA   SER  10           HA       SER  10  16.112   4.033   3.580
   77   1HB   SER  10          2HB       SER  10  15.745   2.172   5.137
   78   2HB   SER  10          1HB       SER  10  14.187   1.838   4.382
   79    HG   SER  10           HG       SER  10  16.181   0.609   3.689
   80    H    GLN  11           H        GLN  11  16.010   3.153   1.438
   81    HA   GLN  11           HA       GLN  11  13.998   4.384  -0.140
   82   1HB   GLN  11          2HB       GLN  11  15.946   2.269  -1.042
   83   2HB   GLN  11          1HB       GLN  11  15.180   3.509  -2.028
   84   1HG   GLN  11          2HG       GLN  11  17.082   4.105   0.212
   85   2HG   GLN  11          1HG       GLN  11  17.587   3.895  -1.464
   86   1HE2  GLN  11          1HE2      GLN  11  18.349   5.991  -1.634
   87   2HE2  GLN  11          2HE2      GLN  11  17.299   7.361  -1.706
   88    H    GLU  12           H        GLU  12  14.566   1.138   1.018
   89    HA   GLU  12           HA       GLU  12  12.642  -0.152  -0.630
   90   1HB   GLU  12          2HB       GLU  12  13.794  -0.982   2.041
   91   2HB   GLU  12          1HB       GLU  12  12.850  -2.022   0.982
   92   1HG   GLU  12          2HG       GLU  12  14.547  -1.915  -0.719
   93   2HG   GLU  12          1HG       GLU  12  15.468  -0.747   0.226
   94    H    GLU  13           H        GLU  13  12.477   1.564   2.404
   95    HA   GLU  13           HA       GLU  13   9.917   0.598   3.191
   96   1HB   GLU  13          2HB       GLU  13  11.411   3.107   3.971
   97   2HB   GLU  13          1HB       GLU  13   9.928   2.556   4.736
   98   1HG   GLU  13          2HG       GLU  13  11.073   0.486   5.409
   99   2HG   GLU  13          1HG       GLU  13  12.562   1.105   4.697
  100    H    ARG  14           H        ARG  14  11.000   3.598   1.635
  101    HA   ARG  14           HA       ARG  14   8.408   4.681   1.320
  102   1HB   ARG  14          2HB       ARG  14   9.474   6.258  -0.242
  103   2HB   ARG  14          1HB       ARG  14  10.373   6.102   1.261
  104   1HG   ARG  14          2HG       ARG  14  11.935   4.566   0.139
  105   2HG   ARG  14          1HG       ARG  14  11.054   4.809  -1.371
  106   1HD   ARG  14          2HD       ARG  14  12.358   7.009   0.222
  107   2HD   ARG  14          1HD       ARG  14  13.102   6.205  -1.160
  108    HE   ARG  14           HE       ARG  14  10.543   7.234  -1.836
  109   1HH1  ARG  14          1HH1      ARG  14  13.846   8.185  -1.262
  110   2HH1  ARG  14          2HH1      ARG  14  13.753   9.590  -2.270
  111   1HH2  ARG  14          1HH2      ARG  14  10.412   9.084  -3.166
  112   2HH2  ARG  14          2HH2      ARG  14  11.800  10.102  -3.350
  113    H    ASP  15           H        ASP  15  10.395   2.617  -0.744
  114    HA   ASP  15           HA       ASP  15   8.620   2.861  -2.972
  115   1HB   ASP  15          2HB       ASP  15  11.010   1.157  -2.366
  116   2HB   ASP  15          1HB       ASP  15  10.020   0.827  -3.781
  117    H    LYS  16           H        LYS  16   9.397   0.051  -0.888
  118    HA   LYS  16           HA       LYS  16   7.460  -1.644  -1.962
  119   1HB   LYS  16          2HB       LYS  16   8.654  -1.644   0.808
  120   2HB   LYS  16          1HB       LYS  16   7.723  -2.966   0.118
  121   1HG   LYS  16          2HG       LYS  16   9.541  -2.759  -1.793
  122   2HG   LYS  16          1HG       LYS  16  10.487  -2.075  -0.471
  123   1HD   LYS  16          2HD       LYS  16  10.975  -4.364  -0.411
  124   2HD   LYS  16          1HD       LYS  16   9.775  -4.137   0.863
  125   1HE   LYS  16          2HE       LYS  16   8.917  -4.883  -1.900
  126   2HE   LYS  16          1HE       LYS  16   9.528  -6.119  -0.802
  127   1HZ   LYS  16          1HZ       LYS  16   7.154  -6.001  -0.636
  128   2HZ   LYS  16          2HZ       LYS  16   7.199  -4.337  -0.342
  129   3HZ   LYS  16          3HZ       LYS  16   7.820  -5.413   0.805
  130    H    VAL  17           H        VAL  17   7.126   0.761   0.607
  131    HA   VAL  17           HA       VAL  17   4.516  -0.247   1.338
  132    HB   VAL  17           HB       VAL  17   5.879   2.282   2.257
  133   1HG1  VAL  17          1HG1      VAL  17   3.525   2.447   2.607
  134   2HG1  VAL  17          2HG1      VAL  17   4.269   2.064   4.160
  135   3HG1  VAL  17          3HG1      VAL  17   3.446   0.803   3.239
  136   1HG2  VAL  17          1HG2      VAL  17   7.162   0.271   2.827
  137   2HG2  VAL  17          2HG2      VAL  17   5.725  -0.433   3.570
  138   3HG2  VAL  17          3HG2      VAL  17   6.456   1.015   4.262
  139    H    ASN  18           H        ASN  18   5.702   2.815  -0.105
  140    HA   ASN  18           HA       ASN  18   3.202   3.988  -0.481
  141   1HB   ASN  18          2HB       ASN  18   5.662   4.286  -2.205
  142   2HB   ASN  18          1HB       ASN  18   4.262   5.343  -2.257
  143   1HD2  ASN  18          1HD2      ASN  18   5.811   3.952   0.590
  144   2HD2  ASN  18          2HD2      ASN  18   6.310   5.454   1.267
  145    H    VAL  19           H        VAL  19   4.568   1.298  -2.045
  146    HA   VAL  19           HA       VAL  19   2.903   1.587  -4.428
  147    HB   VAL  19           HB       VAL  19   5.398   0.563  -4.164
  148   1HG1  VAL  19          1HG1      VAL  19   5.371  -1.836  -4.360
  149   2HG1  VAL  19          2HG1      VAL  19   3.613  -1.864  -4.241
  150   3HG1  VAL  19          3HG1      VAL  19   4.585  -1.364  -2.855
  151   1HG2  VAL  19          1HG2      VAL  19   3.252   0.055  -6.179
  152   2HG2  VAL  19          2HG2      VAL  19   4.860  -0.639  -6.380
  153   3HG2  VAL  19          3HG2      VAL  19   4.659   1.110  -6.286
  154    H    ASP  20           H        ASP  20   3.250  -0.326  -1.520
  155    HA   ASP  20           HA       ASP  20   1.221  -2.227  -2.106
  156   1HB   ASP  20          2HB       ASP  20   3.067  -2.537  -0.424
  157   2HB   ASP  20          1HB       ASP  20   2.235  -1.389   0.618
  158    H    LEU  21           H        LEU  21   1.297   0.897  -0.483
  159    HA   LEU  21           HA       LEU  21  -1.451   0.687   0.344
  160   1HB   LEU  21          2HB       LEU  21  -1.179   2.967   1.166
  161   2HB   LEU  21          1HB       LEU  21   0.103   1.920   1.739
  162    HG   LEU  21           HG       LEU  21   1.379   2.907  -0.352
  163   1HD1  LEU  21          1HD1      LEU  21  -0.291   4.242  -1.315
  164   2HD1  LEU  21          2HD1      LEU  21   0.798   5.365  -0.496
  165   3HD1  LEU  21          3HD1      LEU  21  -0.747   4.937   0.242
  166   1HD2  LEU  21          1HD2      LEU  21   0.989   4.449   2.208
  167   2HD2  LEU  21          2HD2      LEU  21   2.373   4.558   1.121
  168   3HD2  LEU  21          3HD2      LEU  21   2.059   3.064   2.003
  169    H    ALA  22           H        ALA  22   0.411   2.098  -2.262
  170    HA   ALA  22           HA       ALA  22  -1.345   3.870  -3.383
  171   1HB   ALA  22          1HB       ALA  22   0.376   1.848  -4.813
  172   2HB   ALA  22          2HB       ALA  22   0.836   3.484  -4.346
  173   3HB   ALA  22          3HB       ALA  22  -0.394   3.235  -5.583
  174    H    ALA  23           H        ALA  23  -1.241   0.352  -3.998
  175    HA   ALA  23           HA       ALA  23  -3.593   0.296  -5.567
  176   1HB   ALA  23          1HB       ALA  23  -3.506  -2.205  -4.763
  177   2HB   ALA  23          2HB       ALA  23  -1.911  -1.739  -4.168
  178   3HB   ALA  23          3HB       ALA  23  -2.297  -1.585  -5.881
  179    H    SER  24           H        SER  24  -2.908  -0.331  -2.161
  180    HA   SER  24           HA       SER  24  -5.293  -1.271  -1.244
  181   1HB   SER  24          2HB       SER  24  -3.558   0.762   0.159
  182   2HB   SER  24          1HB       SER  24  -4.770  -0.267   0.924
  183    HG   SER  24           HG       SER  24  -3.462  -1.929   0.792
  184    H    GLY  25           H        GLY  25  -4.478   2.210  -1.145
  185   1HA   GLY  25          2HA       GLY  25  -6.936   3.172  -0.391
  186   2HA   GLY  25          1HA       GLY  25  -5.813   4.059  -1.408
  187    H    VAL  26           H        VAL  26  -5.878   2.481  -3.715
  188    HA   VAL  26           HA       VAL  26  -7.903   3.590  -5.165
  189    HB   VAL  26           HB       VAL  26  -6.623   0.907  -5.686
  190   1HG1  VAL  26          1HG1      VAL  26  -8.628   1.187  -7.031
  191   2HG1  VAL  26          2HG1      VAL  26  -7.190   1.334  -8.041
  192   3HG1  VAL  26          3HG1      VAL  26  -8.077   2.778  -7.554
  193   1HG2  VAL  26          1HG2      VAL  26  -5.151   2.979  -5.379
  194   2HG2  VAL  26          2HG2      VAL  26  -5.849   3.544  -6.897
  195   3HG2  VAL  26          3HG2      VAL  26  -4.933   2.035  -6.853
  196    H    ALA  27           H        ALA  27  -8.023   0.133  -4.166
  197    HA   ALA  27           HA       ALA  27 -10.882   0.118  -4.733
  198   1HB   ALA  27          1HB       ALA  27  -9.264  -1.730  -5.414
  199   2HB   ALA  27          2HB       ALA  27 -10.807  -2.208  -4.709
  200   3HB   ALA  27          3HB       ALA  27  -9.340  -2.245  -3.727
  201    H    TYR  28           H        TYR  28  -8.801  -0.566  -1.929
  202    HA   TYR  28           HA       TYR  28 -10.599  -1.442  -0.083
  203   1HB   TYR  28          2HB       TYR  28  -8.005  -0.546   0.006
  204   2HB   TYR  28          1HB       TYR  28  -8.844   0.602   1.046
  205    HD1  TYR  28           1HD      TYR  28  -8.542   0.087   3.275
  206    HD2  TYR  28           2HD      TYR  28  -9.111  -3.091   0.503
  207    HE1  TYR  28           1HE      TYR  28  -8.477  -1.531   5.125
  208    HE2  TYR  28           2HE      TYR  28  -9.046  -4.716   2.347
  209    HH   TYR  28           HH       TYR  28  -9.244  -3.793   5.618
  210    H    LYS  29           H        LYS  29 -10.428   1.795  -1.379
  211    HA   LYS  29           HA       LYS  29 -12.087   2.832   0.751
  212   1HB   LYS  29          2HB       LYS  29 -11.817   4.976  -0.244
  213   2HB   LYS  29          1HB       LYS  29 -10.257   4.171  -0.322
  214   1HG   LYS  29          2HG       LYS  29 -10.741   3.590  -2.684
  215   2HG   LYS  29          1HG       LYS  29 -12.228   4.533  -2.571
  216   1HD   LYS  29          2HD       LYS  29 -10.757   6.477  -1.846
  217   2HD   LYS  29          1HD       LYS  29  -9.388   5.500  -2.385
  218   1HE   LYS  29          2HE       LYS  29 -11.722   6.414  -4.061
  219   2HE   LYS  29          1HE       LYS  29 -10.067   7.016  -4.145
  220   1HZ   LYS  29          1HZ       LYS  29 -10.939   4.247  -4.772
  221   2HZ   LYS  29          2HZ       LYS  29  -9.347   4.814  -4.845
  222   3HZ   LYS  29          3HZ       LYS  29 -10.512   5.431  -5.904
  223    H    GLU  30           H        GLU  30 -12.477   2.430  -2.762
  224    HA   GLU  30           HA       GLU  30 -14.994   3.319  -3.121
  225   1HB   GLU  30          2HB       GLU  30 -13.343   1.882  -4.683
  226   2HB   GLU  30          1HB       GLU  30 -14.510   0.629  -4.299
  227   1HG   GLU  30          2HG       GLU  30 -15.145   3.294  -5.533
  228   2HG   GLU  30          1HG       GLU  30 -15.033   1.761  -6.395
  229    H    ARG  31           H        ARG  31 -14.056   0.419  -1.486
  230    HA   ARG  31           HA       ARG  31 -16.811   0.063  -0.544
  231   1HB   ARG  31          2HB       ARG  31 -14.669  -2.061  -0.906
  232   2HB   ARG  31          1HB       ARG  31 -16.258  -2.332  -0.210
  233   1HG   ARG  31          2HG       ARG  31 -16.499  -3.110  -2.368
  234   2HG   ARG  31          1HG       ARG  31 -17.143  -1.470  -2.480
  235   1HD   ARG  31          2HD       ARG  31 -15.022  -0.683  -3.371
  236   2HD   ARG  31          1HD       ARG  31 -14.337  -2.299  -3.211
  237    HE   ARG  31           HE       ARG  31 -16.661  -2.399  -4.806
  238   1HH1  ARG  31          1HH1      ARG  31 -13.355  -1.299  -4.893
  239   2HH1  ARG  31          2HH1      ARG  31 -13.207  -1.472  -6.610
  240   1HH2  ARG  31          1HH2      ARG  31 -16.471  -2.634  -7.070
  241   2HH2  ARG  31          2HH2      ARG  31 -14.976  -2.231  -7.846
  242    H    LEU  32           H        LEU  32 -16.662  -1.015   1.739
  243    HA   LEU  32           HA       LEU  32 -15.858  -1.176   3.850
  244   1HB   LEU  32          2HB       LEU  32 -13.314  -0.162   2.584
  245   2HB   LEU  32          1HB       LEU  32 -13.475  -0.521   4.283
  246    HG   LEU  32           HG       LEU  32 -13.562  -2.827   3.911
  247   1HD1  LEU  32          1HD1      LEU  32 -13.954  -2.279   0.975
  248   2HD1  LEU  32          2HD1      LEU  32 -15.152  -2.953   2.083
  249   3HD1  LEU  32          3HD1      LEU  32 -13.692  -3.870   1.693
  250   1HD2  LEU  32          1HD2      LEU  32 -11.358  -2.266   3.718
  251   2HD2  LEU  32          2HD2      LEU  32 -11.619  -1.319   2.251
  252   3HD2  LEU  32          3HD2      LEU  32 -11.621  -3.083   2.176
  253    H    ASN  33           H        ASN  33 -13.789   0.908   4.629
  254    HA   ASN  33           HA       ASN  33 -15.342   3.364   4.349
  255   1HB   ASN  33          2HB       ASN  33 -14.552   2.115   6.986
  256   2HB   ASN  33          1HB       ASN  33 -15.075   3.787   6.814
  257   1HD2  ASN  33          1HD2      ASN  33 -16.038   0.444   6.507
  258   2HD2  ASN  33          2HD2      ASN  33 -17.740   0.725   6.597
  259    H    ILE  34           H        ILE  34 -13.471   3.770   2.907
  260    HA   ILE  34           HA       ILE  34 -11.248   4.823   4.536
  261    HB   ILE  34           HB       ILE  34 -10.908   3.223   2.010
  262   1HG1  ILE  34          2HG1      ILE  34  -9.192   2.090   3.590
  263   2HG1  ILE  34          1HG1      ILE  34 -10.102   2.880   4.876
  264   1HG2  ILE  34          1HG2      ILE  34  -8.532   3.772   2.112
  265   2HG2  ILE  34          2HG2      ILE  34  -8.856   4.884   3.443
  266   3HG2  ILE  34          3HG2      ILE  34  -9.526   5.205   1.844
  267   1HD1  ILE  34          1HD1      ILE  34 -10.882   0.652   3.091
  268   2HD1  ILE  34          2HD1      ILE  34 -12.136   1.769   3.624
  269   3HD1  ILE  34          3HD1      ILE  34 -11.178   0.887   4.814
  270    HA   PRO  35           HA       PRO  35 -12.245   8.280   1.899
  271   1HB   PRO  35          2HB       PRO  35 -11.676  10.193   3.604
  272   2HB   PRO  35          1HB       PRO  35 -12.966   9.048   4.007
  273   1HG   PRO  35          2HG       PRO  35 -10.123   9.106   4.966
  274   2HG   PRO  35          1HG       PRO  35 -11.611   8.831   5.898
  275   1HD   PRO  35          2HD       PRO  35  -9.937   6.844   4.859
  276   2HD   PRO  35          1HD       PRO  35 -11.610   6.605   5.405
  277    H    VAL  36           H        VAL  36 -10.448   7.726   0.397
  278    HA   VAL  36           HA       VAL  36  -8.238   9.608   0.712
  279    HB   VAL  36           HB       VAL  36  -6.561   7.960   0.040
  280   1HG1  VAL  36          1HG1      VAL  36  -6.616   6.584   2.171
  281   2HG1  VAL  36          2HG1      VAL  36  -8.151   7.381   2.529
  282   3HG1  VAL  36          3HG1      VAL  36  -6.678   8.336   2.365
  283   1HG2  VAL  36          1HG2      VAL  36  -8.027   6.436  -1.174
  284   2HG2  VAL  36          2HG2      VAL  36  -8.791   5.955   0.341
  285   3HG2  VAL  36          3HG2      VAL  36  -7.092   5.576   0.051
  286    H    ILE  37           H        ILE  37  -6.986   9.920  -1.275
  287    HA   ILE  37           HA       ILE  37  -8.762   9.822  -3.595
  288    HB   ILE  37           HB       ILE  37  -6.157  11.321  -3.313
  289   1HG1  ILE  37          2HG1      ILE  37  -7.758  12.091  -1.619
  290   2HG1  ILE  37          1HG1      ILE  37  -7.524  13.314  -2.863
  291   1HG2  ILE  37          1HG2      ILE  37  -8.430  11.577  -5.275
  292   2HG2  ILE  37          2HG2      ILE  37  -6.816  10.948  -5.609
  293   3HG2  ILE  37          3HG2      ILE  37  -7.032  12.648  -5.191
  294   1HD1  ILE  37          1HD1      ILE  37  -9.860  11.427  -2.671
  295   2HD1  ILE  37          2HD1      ILE  37  -9.631  12.670  -3.900
  296   3HD1  ILE  37          3HD1      ILE  37  -9.860  13.129  -2.213
  297    H    ALA  38           H        ALA  38  -8.421   8.491  -5.243
  298    HA   ALA  38           HA       ALA  38  -6.408   6.505  -5.161
  299   1HB   ALA  38          1HB       ALA  38  -7.294   5.775  -7.307
  300   2HB   ALA  38          2HB       ALA  38  -8.208   7.275  -7.452
  301   3HB   ALA  38          3HB       ALA  38  -8.598   6.125  -6.173
  302    H    GLU  39           H        GLU  39  -6.864   9.248  -7.416
  303    HA   GLU  39           HA       GLU  39  -4.552   8.800  -8.913
  304   1HB   GLU  39          2HB       GLU  39  -4.708  11.296  -9.427
  305   2HB   GLU  39          1HB       GLU  39  -6.091  10.295  -9.845
  306   1HG   GLU  39          2HG       GLU  39  -7.247  11.036  -7.833
  307   2HG   GLU  39          1HG       GLU  39  -5.855  12.025  -7.393
  308    H    GLN  40           H        GLN  40  -4.890  10.000  -5.722
  309    HA   GLN  40           HA       GLN  40  -2.624  11.604  -5.460
  310   1HB   GLN  40          2HB       GLN  40  -4.572  10.666  -3.764
  311   2HB   GLN  40          1HB       GLN  40  -3.136   9.828  -3.185
  312   1HG   GLN  40          2HG       GLN  40  -1.993  12.031  -3.033
  313   2HG   GLN  40          1HG       GLN  40  -3.528  12.796  -3.446
  314   1HE2  GLN  40          1HE2      GLN  40  -5.200  12.793  -1.952
  315   2HE2  GLN  40          2HE2      GLN  40  -4.951  12.415  -0.285
  316    H    VAL  41           H        VAL  41  -2.999   8.117  -5.456
  317    HA   VAL  41           HA       VAL  41  -0.189   7.729  -4.810
  318    HB   VAL  41           HB       VAL  41  -0.639   5.451  -4.521
  319   1HG1  VAL  41          1HG1      VAL  41  -1.643   6.842  -2.783
  320   2HG1  VAL  41          2HG1      VAL  41  -2.572   5.364  -3.038
  321   3HG1  VAL  41          3HG1      VAL  41  -3.153   6.895  -3.695
  322   1HG2  VAL  41          1HG2      VAL  41  -3.130   5.903  -6.144
  323   2HG2  VAL  41          2HG2      VAL  41  -2.806   4.421  -5.251
  324   3HG2  VAL  41          3HG2      VAL  41  -1.733   4.913  -6.560
  325    H    ALA  42           H        ALA  42  -2.243   7.957  -7.522
  326    HA   ALA  42           HA       ALA  42  -0.771   6.312  -9.313
  327   1HB   ALA  42          1HB       ALA  42  -2.691   8.546  -9.932
  328   2HB   ALA  42          2HB       ALA  42  -3.120   6.853  -9.680
  329   3HB   ALA  42          3HB       ALA  42  -2.126   7.316 -11.062
  330    H    ARG  43           H        ARG  43  -0.259   9.507  -8.122
  331    HA   ARG  43           HA       ARG  43   1.176  10.526 -10.361
  332   1HB   ARG  43          2HB       ARG  43   1.995  12.250  -8.770
  333   2HB   ARG  43          1HB       ARG  43   0.248  12.071  -8.771
  334   1HG   ARG  43          2HG       ARG  43   0.683  12.214  -6.530
  335   2HG   ARG  43          1HG       ARG  43   0.691  10.466  -6.768
  336   1HD   ARG  43          2HD       ARG  43   2.570  11.253  -5.375
  337   2HD   ARG  43          1HD       ARG  43   3.104  10.446  -6.849
  338    HE   ARG  43           HE       ARG  43   2.916  13.290  -7.141
  339   1HH1  ARG  43          1HH1      ARG  43   4.936  10.684  -6.012
  340   2HH1  ARG  43          2HH1      ARG  43   6.410  11.576  -6.193
  341   1HH2  ARG  43          1HH2      ARG  43   4.853  14.472  -7.382
  342   2HH2  ARG  43          2HH2      ARG  43   6.362  13.727  -6.972
  343    H    GLU  44           H        GLU  44   1.921   8.111  -8.228
  344    HA   GLU  44           HA       GLU  44   4.803   8.451  -8.717
  345   1HB   GLU  44          2HB       GLU  44   4.870   6.846  -6.577
  346   2HB   GLU  44          1HB       GLU  44   4.918   8.600  -6.465
  347   1HG   GLU  44          2HG       GLU  44   2.571   8.687  -5.996
  348   2HG   GLU  44          1HG       GLU  44   2.415   6.959  -6.282
  349    H    GLN  45           H        GLN  45   2.741   5.802  -7.568
  350    HA   GLN  45           HA       GLN  45   2.743   3.572  -8.103
  351   1HB   GLN  45          2HB       GLN  45   1.378   4.570  -9.913
  352   2HB   GLN  45          1HB       GLN  45   2.826   4.719 -10.899
  353   1HG   GLN  45          2HG       GLN  45   1.490   2.786 -11.539
  354   2HG   GLN  45          1HG       GLN  45   3.079   2.310 -10.942
  355   1HE2  GLN  45          1HE2      GLN  45   3.246   1.241  -8.978
  356   2HE2  GLN  45          2HE2      GLN  45   1.882   0.523  -8.198
  357    HA   PRO  46           HA       PRO  46   7.444   3.644  -8.581
  358   1HB   PRO  46          2HB       PRO  46   6.891   1.436  -6.646
  359   2HB   PRO  46          1HB       PRO  46   8.199   2.626  -6.652
  360   1HG   PRO  46          2HG       PRO  46   6.144   2.901  -4.991
  361   2HG   PRO  46          1HG       PRO  46   6.847   4.313  -5.803
  362   1HD   PRO  46          2HD       PRO  46   4.293   2.882  -6.361
  363   2HD   PRO  46          1HD       PRO  46   4.681   4.607  -6.517
  364    H    GLU  47           H        GLU  47   8.455   2.463 -10.065
  365    HA   GLU  47           HA       GLU  47   7.080   0.218 -11.270
  366   1HB   GLU  47          2HB       GLU  47   8.025   1.078 -13.098
  367   2HB   GLU  47          1HB       GLU  47   8.969   2.192 -12.123
  368   1HG   GLU  47          2HG       GLU  47  10.756   0.616 -11.935
  369   2HG   GLU  47          1HG       GLU  47   9.793  -0.639 -12.714
  370    H    ASN  48           H        ASN  48  10.241   0.802  -9.744
  371    HA   ASN  48           HA       ASN  48  11.237  -1.784  -9.843
  372   1HB   ASN  48          2HB       ASN  48  12.339   0.439  -9.063
  373   2HB   ASN  48          1HB       ASN  48  11.732  -0.004  -7.471
  374   1HD2  ASN  48          1HD2      ASN  48  14.465   0.278  -8.375
  375   2HD2  ASN  48          2HD2      ASN  48  15.231  -1.247  -8.105
  376    H    LEU  49           H        LEU  49   8.465  -0.824  -8.288
  377    HA   LEU  49           HA       LEU  49   8.476  -3.207  -6.605
  378   1HB   LEU  49          2HB       LEU  49   8.222  -0.417  -5.700
  379   2HB   LEU  49          1HB       LEU  49   6.991  -1.499  -5.082
  380    HG   LEU  49           HG       LEU  49   8.728  -1.417  -3.462
  381   1HD1  LEU  49          1HD1      LEU  49   7.782  -3.625  -3.833
  382   2HD1  LEU  49          2HD1      LEU  49   9.481  -3.741  -3.380
  383   3HD1  LEU  49          3HD1      LEU  49   9.000  -3.955  -5.063
  384   1HD2  LEU  49          1HD2      LEU  49  11.018  -1.660  -3.874
  385   2HD2  LEU  49          2HD2      LEU  49  10.447  -0.602  -5.165
  386   3HD2  LEU  49          3HD2      LEU  49  10.751  -2.308  -5.490
  387    H    ARG  50           H        ARG  50   7.225  -2.116  -9.188
  388    HA   ARG  50           HA       ARG  50   4.454  -1.810  -8.752
  389   1HB   ARG  50          2HB       ARG  50   4.201  -2.062 -11.119
  390   2HB   ARG  50          1HB       ARG  50   5.683  -1.159 -10.839
  391   1HG   ARG  50          2HG       ARG  50   7.006  -3.148 -11.243
  392   2HG   ARG  50          1HG       ARG  50   5.538  -4.107 -11.435
  393   1HD   ARG  50          2HD       ARG  50   4.906  -2.662 -13.349
  394   2HD   ARG  50          1HD       ARG  50   6.453  -1.833 -13.189
  395    HE   ARG  50           HE       ARG  50   7.334  -4.274 -13.499
  396   1HH1  ARG  50          1HH1      ARG  50   4.653  -2.752 -15.124
  397   2HH1  ARG  50          2HH1      ARG  50   4.832  -3.688 -16.571
  398   1HH2  ARG  50          1HH2      ARG  50   7.576  -5.510 -15.400
  399   2HH2  ARG  50          2HH2      ARG  50   6.492  -5.256 -16.727
  400    H    THR  51           H        THR  51   6.536  -4.540  -8.819
  401    HA   THR  51           HA       THR  51   4.614  -6.534  -9.462
  402    HB   THR  51           HB       THR  51   7.174  -6.817  -7.871
  403    HG1  THR  51           1HG      THR  51   6.603  -6.861 -10.645
  404   1HG2  THR  51          1HG2      THR  51   7.060  -9.177  -8.607
  405   2HG2  THR  51          2HG2      THR  51   5.466  -8.860  -9.292
  406   3HG2  THR  51          3HG2      THR  51   5.721  -8.727  -7.552
  407    H    TYR  52           H        TYR  52   5.862  -5.199  -6.437
  408    HA   TYR  52           HA       TYR  52   4.421  -6.859  -4.685
  409   1HB   TYR  52          2HB       TYR  52   6.420  -5.402  -4.165
  410   2HB   TYR  52          1HB       TYR  52   5.336  -4.017  -4.192
  411    HD1  TYR  52           1HD      TYR  52   5.198  -3.251  -2.012
  412    HD2  TYR  52           2HD      TYR  52   4.891  -7.429  -2.743
  413    HE1  TYR  52           1HE      TYR  52   4.650  -3.619   0.349
  414    HE2  TYR  52           2HE      TYR  52   4.340  -7.807  -0.386
  415    HH   TYR  52           HH       TYR  52   4.664  -6.692   1.786
  416    H    PHE  53           H        PHE  53   3.764  -3.645  -5.997
  417    HA   PHE  53           HA       PHE  53   1.414  -3.058  -4.686
  418   1HB   PHE  53          2HB       PHE  53   2.066  -1.238  -5.823
  419   2HB   PHE  53          1HB       PHE  53   2.728  -2.161  -7.163
  420    HD1  PHE  53           1HD      PHE  53  -0.022  -0.176  -5.967
  421    HD2  PHE  53           2HD      PHE  53   1.148  -2.992  -8.938
  422    HE1  PHE  53           1HE      PHE  53  -1.961   0.468  -7.337
  423    HE2  PHE  53           2HE      PHE  53  -0.789  -2.346 -10.321
  424    HZ   PHE  53           HZ       PHE  53  -2.286  -0.509  -9.546
  425    H    MET  54           H        MET  54   1.777  -4.936  -7.706
  426    HA   MET  54           HA       MET  54  -1.041  -5.227  -8.046
  427   1HB   MET  54          2HB       MET  54  -0.450  -6.948  -9.728
  428   2HB   MET  54          1HB       MET  54   0.384  -5.423  -9.978
  429   1HG   MET  54          2HG       MET  54   2.399  -6.343  -8.985
  430   2HG   MET  54          1HG       MET  54   1.565  -7.865  -8.679
  431   1HE   MET  54          1HE       MET  54   1.247  -5.560 -11.882
  432   2HE   MET  54          2HE       MET  54   2.527  -6.236 -12.889
  433   3HE   MET  54          3HE       MET  54   2.932  -5.405 -11.387
  434    H    GLU  55           H        GLU  55   1.479  -7.214  -6.588
  435    HA   GLU  55           HA       GLU  55   0.031  -9.525  -6.093
  436   1HB   GLU  55          2HB       GLU  55   2.205  -8.215  -4.450
  437   2HB   GLU  55          1HB       GLU  55   1.598  -9.837  -4.150
  438   1HG   GLU  55          2HG       GLU  55   2.779  -8.966  -6.764
  439   2HG   GLU  55          1HG       GLU  55   3.720  -9.706  -5.467
  440    H    ARG  56           H        ARG  56   0.565  -6.780  -3.896
  441    HA   ARG  56           HA       ARG  56  -1.324  -7.602  -1.976
  442   1HB   ARG  56          2HB       ARG  56   0.442  -5.947  -1.505
  443   2HB   ARG  56          1HB       ARG  56  -0.317  -4.818  -2.618
  444   1HG   ARG  56          2HG       ARG  56  -1.038  -4.056  -0.571
  445   2HG   ARG  56          1HG       ARG  56  -2.386  -5.071  -1.084
  446   1HD   ARG  56          2HD       ARG  56  -0.151  -6.064   0.671
  447   2HD   ARG  56          1HD       ARG  56  -1.627  -5.347   1.311
  448    HE   ARG  56           HE       ARG  56  -2.256  -7.437  -0.486
  449   1HH1  ARG  56          1HH1      ARG  56  -1.014  -6.869   2.722
  450   2HH1  ARG  56          2HH1      ARG  56  -1.574  -8.384   3.345
  451   1HH2  ARG  56          1HH2      ARG  56  -2.998  -9.433   0.332
  452   2HH2  ARG  56          2HH2      ARG  56  -2.699  -9.842   1.988
  453    H    LEU  57           H        LEU  57  -1.498  -5.650  -4.884
  454    HA   LEU  57           HA       LEU  57  -3.982  -4.488  -4.623
  455   1HB   LEU  57          2HB       LEU  57  -2.622  -3.878  -6.466
  456   2HB   LEU  57          1HB       LEU  57  -2.566  -5.525  -7.063
  457    HG   LEU  57           HG       LEU  57  -5.020  -5.367  -7.529
  458   1HD1  LEU  57          1HD1      LEU  57  -4.568  -2.453  -6.903
  459   2HD1  LEU  57          2HD1      LEU  57  -5.580  -3.573  -5.993
  460   3HD1  LEU  57          3HD1      LEU  57  -6.018  -3.130  -7.642
  461   1HD2  LEU  57          1HD2      LEU  57  -3.355  -5.073  -9.291
  462   2HD2  LEU  57          2HD2      LEU  57  -3.257  -3.351  -8.918
  463   3HD2  LEU  57          3HD2      LEU  57  -4.754  -4.031  -9.556
  464    H    ARG  58           H        ARG  58  -3.273  -7.701  -6.035
  465    HA   ARG  58           HA       ARG  58  -6.028  -8.261  -6.497
  466   1HB   ARG  58          2HB       ARG  58  -5.344 -10.346  -7.307
  467   2HB   ARG  58          1HB       ARG  58  -4.008  -9.273  -7.696
  468   1HG   ARG  58          2HG       ARG  58  -2.751 -10.110  -5.797
  469   2HG   ARG  58          1HG       ARG  58  -4.107 -11.138  -5.333
  470   1HD   ARG  58          2HD       ARG  58  -2.535 -12.500  -6.493
  471   2HD   ARG  58          1HD       ARG  58  -3.920 -12.253  -7.552
  472    HE   ARG  58           HE       ARG  58  -2.308 -10.318  -8.390
  473   1HH1  ARG  58          1HH1      ARG  58  -1.622 -13.654  -7.655
  474   2HH1  ARG  58          2HH1      ARG  58  -0.345 -13.781  -8.817
  475   1HH2  ARG  58          1HH2      ARG  58  -0.629 -10.479  -9.925
  476   2HH2  ARG  58          2HH2      ARG  58   0.218 -11.978 -10.109
  477    H    HIS  59           H        HIS  59  -3.757  -9.087  -3.909
  478    HA   HIS  59           HA       HIS  59  -5.608 -10.876  -2.626
  479   1HB   HIS  59          2HB       HIS  59  -2.973  -9.686  -1.796
  480   2HB   HIS  59          1HB       HIS  59  -3.944 -10.621  -0.665
  481    HD1  HIS  59           1HD      HIS  59  -4.139 -13.165  -1.089
  482    HD2  HIS  59           2HD      HIS  59  -1.715 -11.171  -3.810
  483    HE1  HIS  59           1HE      HIS  59  -2.881 -14.965  -2.312
  484    HE2  HIS  59           2HE      HIS  59  -1.515 -13.739  -4.038
  485    H    TYR  60           H        TYR  60  -4.430  -7.631  -1.730
  486    HA   TYR  60           HA       TYR  60  -6.119  -7.303   0.459
  487   1HB   TYR  60          2HB       TYR  60  -5.184  -5.276   0.603
  488   2HB   TYR  60          1HB       TYR  60  -4.199  -5.774  -0.767
  489    HD1  TYR  60           1HD      TYR  60  -4.539  -4.836  -2.924
  490    HD2  TYR  60           2HD      TYR  60  -7.139  -3.888   0.276
  491    HE1  TYR  60           1HE      TYR  60  -5.492  -3.025  -4.255
  492    HE2  TYR  60           2HE      TYR  60  -8.102  -2.075  -1.031
  493    HH   TYR  60           HH       TYR  60  -7.503  -0.642  -2.910
  494    H    ARG  61           H        ARG  61  -6.655  -6.788  -2.966
  495    HA   ARG  61           HA       ARG  61  -9.228  -5.693  -2.823
  496   1HB   ARG  61          2HB       ARG  61  -7.905  -5.810  -4.913
  497   2HB   ARG  61          1HB       ARG  61  -8.156  -7.550  -4.961
  498   1HG   ARG  61          2HG       ARG  61 -10.552  -7.212  -5.204
  499   2HG   ARG  61          1HG       ARG  61 -10.326  -5.465  -5.112
  500   1HD   ARG  61          2HD       ARG  61  -8.914  -5.575  -7.135
  501   2HD   ARG  61          1HD       ARG  61  -9.238  -7.306  -7.240
  502    HE   ARG  61           HE       ARG  61 -11.686  -5.953  -7.156
  503   1HH1  ARG  61          1HH1      ARG  61  -8.943  -6.330  -9.275
  504   2HH1  ARG  61          2HH1      ARG  61  -9.866  -6.080 -10.719
  505   1HH2  ARG  61          1HH2      ARG  61 -12.903  -5.625  -9.051
  506   2HH2  ARG  61          2HH2      ARG  61 -12.116  -5.682 -10.592
  507    H    GLN  62           H        GLN  62  -8.077  -8.917  -2.417
  508    HA   GLN  62           HA       GLN  62 -10.496 -10.349  -2.743
  509   1HB   GLN  62          2HB       GLN  62  -8.199 -10.991  -0.875
  510   2HB   GLN  62          1HB       GLN  62  -9.491 -12.098  -1.320
  511   1HG   GLN  62          2HG       GLN  62  -8.790 -11.869  -3.673
  512   2HG   GLN  62          1HG       GLN  62  -7.415 -10.919  -3.131
  513   1HE2  GLN  62          1HE2      GLN  62  -5.926 -12.371  -3.922
  514   2HE2  GLN  62          2HE2      GLN  62  -5.638 -13.905  -3.185
  515    H    LEU  63           H        LEU  63  -9.187  -8.379  -0.225
  516    HA   LEU  63           HA       LEU  63 -11.206  -9.123   1.691
  517   1HB   LEU  63          2HB       LEU  63  -9.066  -7.012   1.667
  518   2HB   LEU  63          1HB       LEU  63 -10.283  -7.088   2.925
  519    HG   LEU  63           HG       LEU  63  -9.512  -9.434   3.412
  520   1HD1  LEU  63          1HD1      LEU  63  -7.254  -8.633   1.584
  521   2HD1  LEU  63          2HD1      LEU  63  -8.420  -9.928   1.310
  522   3HD1  LEU  63          3HD1      LEU  63  -7.264 -10.047   2.636
  523   1HD2  LEU  63          1HD2      LEU  63  -8.857  -7.503   4.774
  524   2HD2  LEU  63          2HD2      LEU  63  -7.462  -7.245   3.724
  525   3HD2  LEU  63          3HD2      LEU  63  -7.578  -8.715   4.692
  526    H    SER  64           H        SER  64 -10.636  -6.589  -0.668
  527    HA   SER  64           HA       SER  64 -12.522  -4.718   0.093
  528   1HB   SER  64          2HB       SER  64 -11.031  -4.307  -1.785
  529   2HB   SER  64          1HB       SER  64 -11.784  -5.607  -2.708
  530    HG   SER  64           HG       SER  64 -12.558  -3.032  -2.427
  531    H    LEU  65           H        LEU  65 -12.936  -7.852  -1.337
  532    HA   LEU  65           HA       LEU  65 -15.780  -7.468  -1.706
  533   1HB   LEU  65          2HB       LEU  65 -13.884  -9.701  -2.364
  534   2HB   LEU  65          1HB       LEU  65 -15.622  -9.885  -2.513
  535    HG   LEU  65           HG       LEU  65 -15.640  -7.957  -4.069
  536   1HD1  LEU  65          1HD1      LEU  65 -12.658  -8.201  -3.889
  537   2HD1  LEU  65          2HD1      LEU  65 -13.646  -6.843  -3.346
  538   3HD1  LEU  65          3HD1      LEU  65 -13.538  -7.225  -5.066
  539   1HD2  LEU  65          1HD2      LEU  65 -13.882 -10.271  -4.863
  540   2HD2  LEU  65          2HD2      LEU  65 -14.703  -9.179  -5.979
  541   3HD2  LEU  65          3HD2      LEU  65 -15.643 -10.234  -4.925
  542    H    GLN  66           H        GLN  66 -13.659  -9.802   0.025
  543    HA   GLN  66           HA       GLN  66 -15.722 -11.059   1.437
  544   1HB   GLN  66          2HB       GLN  66 -14.097 -12.211   2.588
  545   2HB   GLN  66          1HB       GLN  66 -13.202 -11.687   1.170
  546   1HG   GLN  66          2HG       GLN  66 -11.738 -11.216   2.876
  547   2HG   GLN  66          1HG       GLN  66 -12.544  -9.668   2.633
  548   1HE2  GLN  66          1HE2      GLN  66 -12.274  -8.873   4.662
  549   2HE2  GLN  66          2HE2      GLN  66 -13.029  -9.547   6.065
  550    H    LEU  67           H        LEU  67 -13.734  -8.294   2.444
  551    HA   LEU  67           HA       LEU  67 -14.397  -7.973   5.045
  552   1HB   LEU  67          2HB       LEU  67 -13.924  -5.983   2.871
  553   2HB   LEU  67          1HB       LEU  67 -14.316  -5.432   4.487
  554    HG   LEU  67           HG       LEU  67 -12.015  -7.284   3.874
  555   1HD1  LEU  67          1HD1      LEU  67 -11.982  -4.310   4.308
  556   2HD1  LEU  67          2HD1      LEU  67 -11.681  -5.135   2.778
  557   3HD1  LEU  67          3HD1      LEU  67 -10.570  -5.352   4.131
  558   1HD2  LEU  67          1HD2      LEU  67 -12.791  -7.442   6.156
  559   2HD2  LEU  67          2HD2      LEU  67 -12.746  -5.684   6.319
  560   3HD2  LEU  67          3HD2      LEU  67 -11.247  -6.588   6.105
  561    HA   PRO  68           HA       PRO  68 -18.609  -7.012   5.732
  562   1HB   PRO  68          2HB       PRO  68 -18.616  -4.983   7.478
  563   2HB   PRO  68          1HB       PRO  68 -17.967  -6.577   7.900
  564   1HG   PRO  68          2HG       PRO  68 -16.466  -4.172   6.871
  565   2HG   PRO  68          1HG       PRO  68 -16.163  -5.104   8.362
  566   1HD   PRO  68          2HD       PRO  68 -14.772  -5.628   6.173
  567   2HD   PRO  68          1HD       PRO  68 -15.383  -6.967   7.168
  568    H    LYS  69           H        LYS  69 -18.199  -3.690   6.375
  569    HA   LYS  69           HA       LYS  69 -20.218  -2.832   4.710
  570   1HB   LYS  69          2HB       LYS  69 -17.898  -1.086   5.510
  571   2HB   LYS  69          1HB       LYS  69 -19.571  -0.614   5.242
  572   1HG   LYS  69          2HG       LYS  69 -20.029  -2.289   7.211
  573   2HG   LYS  69          1HG       LYS  69 -18.335  -1.967   7.585
  574   1HD   LYS  69          2HD       LYS  69 -19.455  -0.359   8.829
  575   2HD   LYS  69          1HD       LYS  69 -19.008   0.522   7.368
  576   1HE   LYS  69          2HE       LYS  69 -21.260   0.051   6.450
  577   2HE   LYS  69          1HE       LYS  69 -21.691  -0.707   7.983
  578   1HZ   LYS  69          1HZ       LYS  69 -20.976   2.138   7.538
  579   2HZ   LYS  69          2HZ       LYS  69 -21.174   1.445   9.067
  580   3HZ   LYS  69          3HZ       LYS  69 -22.484   1.522   8.001
  581    H    GLY  70           H        GLY  70 -20.291  -1.663   2.775
  582   1HA   GLY  70          2HA       GLY  70 -19.603  -1.009   0.662
  583   2HA   GLY  70          1HA       GLY  70 -17.951  -1.399   1.120
  584    H    SER  71           H        SER  71 -19.446  -4.033   2.014
  585    HA   SER  71           HA       SER  71 -19.421  -5.321  -0.628
  586   1HB   SER  71          2HB       SER  71 -18.163  -6.322   1.934
  587   2HB   SER  71          1HB       SER  71 -18.352  -7.297   0.477
  588    HG   SER  71           HG       SER  71 -17.217  -5.200  -0.409
  589    H    ASP  72           H        ASP  72 -19.844  -7.913   0.869
  590    HA   ASP  72           HA       ASP  72 -22.603  -8.099   0.637
  591   1HB   ASP  72          2HB       ASP  72 -20.717  -9.771   2.308
  592   2HB   ASP  72          1HB       ASP  72 -22.381 -10.212   1.937
  593    HA   PRO  73           HA       PRO  73 -24.061  -6.243   4.395
  594   1HB   PRO  73          2HB       PRO  73 -26.580  -7.030   4.398
  595   2HB   PRO  73          1HB       PRO  73 -25.975  -5.991   3.097
  596   1HG   PRO  73          2HG       PRO  73 -26.229  -8.962   3.148
  597   2HG   PRO  73          1HG       PRO  73 -26.880  -7.846   1.931
  598   1HD   PRO  73          2HD       PRO  73 -24.552  -9.154   1.565
  599   2HD   PRO  73          1HD       PRO  73 -24.776  -7.487   0.994
  600    H    ALA  74           H        ALA  74 -24.769  -9.662   3.899
  601    HA   ALA  74           HA       ALA  74 -24.948 -10.121   6.768
  602   1HB   ALA  74          1HB       ALA  74 -25.594 -12.396   6.155
  603   2HB   ALA  74          2HB       ALA  74 -25.271 -12.037   4.459
  604   3HB   ALA  74          3HB       ALA  74 -26.575 -11.203   5.303
  605    H    TYR  75           H        TYR  75 -22.425  -9.260   5.799
  606    HA   TYR  75           HA       TYR  75 -20.536 -11.155   5.211
  607   1HB   TYR  75          2HB       TYR  75 -19.762  -8.953   5.237
  608   2HB   TYR  75          1HB       TYR  75 -20.426  -8.631   6.833
  609    HD1  TYR  75           1HD      TYR  75 -19.032  -8.714   8.702
  610    HD2  TYR  75           2HD      TYR  75 -17.792 -10.629   5.110
  611    HE1  TYR  75           1HE      TYR  75 -16.830  -9.156   9.704
  612    HE2  TYR  75           2HE      TYR  75 -15.588 -11.077   6.104
  613    HH   TYR  75           HH       TYR  75 -14.959 -10.769   9.397
  614    H    GLN  76           H        GLN  76 -19.452 -12.727   6.263
  615    HA   GLN  76           HA       GLN  76 -20.586 -13.930   8.520
  616   1HB   GLN  76          2HB       GLN  76 -17.864 -14.277   7.259
  617   2HB   GLN  76          1HB       GLN  76 -18.476 -15.302   8.550
  618   1HG   GLN  76          2HG       GLN  76 -18.832 -16.445   6.508
  619   2HG   GLN  76          1HG       GLN  76 -20.404 -15.878   7.071
  620   1HE2  GLN  76          1HE2      GLN  76 -21.468 -14.267   5.936
  621   2HE2  GLN  76          2HE2      GLN  76 -20.992 -13.784   4.347
  622    H    LYS  77           H        LYS  77 -20.653 -13.038  10.464
  623    HA   LYS  77           HA       LYS  77 -18.823 -11.118  11.433
  624   1HB   LYS  77          2HB       LYS  77 -19.990 -11.436  13.594
  625   2HB   LYS  77          1HB       LYS  77 -21.100 -11.203  12.252
  626   1HG   LYS  77          2HG       LYS  77 -20.995 -13.872  12.253
  627   2HG   LYS  77          1HG       LYS  77 -20.653 -13.571  13.957
  628   1HD   LYS  77          2HD       LYS  77 -22.686 -12.093  14.000
  629   2HD   LYS  77          1HD       LYS  77 -23.060 -12.677  12.379
  630   1HE   LYS  77          2HE       LYS  77 -22.798 -14.361  14.865
  631   2HE   LYS  77          1HE       LYS  77 -24.303 -13.924  14.060
  632   1HZ   LYS  77          1HZ       LYS  77 -23.568 -15.147  12.108
  633   2HZ   LYS  77          2HZ       LYS  77 -23.604 -16.154  13.466
  634   3HZ   LYS  77          3HZ       LYS  77 -22.126 -15.569  12.885
  635    H    ASP  78           H        ASP  78 -17.266 -11.283  13.102
  636    HA   ASP  78           HA       ASP  78 -15.983 -13.915  13.206
  637   1HB   ASP  78          2HB       ASP  78 -14.010 -12.613  14.078
  638   2HB   ASP  78          1HB       ASP  78 -14.502 -12.210  12.437
  639    H    ASP  79           H        ASP  79 -16.508 -11.181  15.453
  640    HA   ASP  79           HA       ASP  79 -17.209 -13.100  17.539
  641   1HB   ASP  79          2HB       ASP  79 -15.031 -11.023  17.843
  642   2HB   ASP  79          1HB       ASP  79 -15.696 -11.984  19.161
  643    H    ALA  80           H        ALA  80 -17.246  -9.879  16.243
  644    HA   ALA  80           HA       ALA  80 -18.634  -8.626  18.379
  645   1HB   ALA  80          1HB       ALA  80 -17.370  -7.382  16.671
  646   2HB   ALA  80          2HB       ALA  80 -19.032  -6.811  16.827
  647   3HB   ALA  80          3HB       ALA  80 -18.577  -7.839  15.468
  648    H    VAL  81           H        VAL  81 -19.592 -10.929  16.135
  649    HA   VAL  81           HA       VAL  81 -21.581 -11.722  15.370
  650    HB   VAL  81           HB       VAL  81 -22.494 -10.758  18.078
  651   1HG1  VAL  81          1HG1      VAL  81 -24.174 -12.536  17.916
  652   2HG1  VAL  81          2HG1      VAL  81 -23.617 -12.910  16.284
  653   3HG1  VAL  81          3HG1      VAL  81 -24.365 -11.350  16.625
  654   1HG2  VAL  81          1HG2      VAL  81 -20.528 -12.159  18.266
  655   2HG2  VAL  81          2HG2      VAL  81 -21.273 -13.383  17.239
  656   3HG2  VAL  81          3HG2      VAL  81 -21.950 -13.036  18.831
  657    H    LYS  82           H        LYS  82 -21.602  -9.924  13.789
  658    HA   LYS  82           HA       LYS  82 -24.052  -8.351  14.096
  659   1HB   LYS  82          2HB       LYS  82 -21.434  -7.235  13.073
  660   2HB   LYS  82          1HB       LYS  82 -22.971  -6.382  13.089
  661   1HG   LYS  82          2HG       LYS  82 -21.477  -7.341  15.520
  662   2HG   LYS  82          1HG       LYS  82 -21.524  -5.683  14.923
  663   1HD   LYS  82          2HD       LYS  82 -23.956  -7.258  15.748
  664   2HD   LYS  82          1HD       LYS  82 -23.092  -6.147  16.813
  665   1HE   LYS  82          2HE       LYS  82 -23.564  -4.300  15.313
  666   2HE   LYS  82          1HE       LYS  82 -24.346  -5.393  14.172
  667   1HZ   LYS  82          1HZ       LYS  82 -25.274  -4.844  16.941
  668   2HZ   LYS  82          2HZ       LYS  82 -26.034  -5.866  15.827
  669   3HZ   LYS  82          3HZ       LYS  82 -25.957  -4.202  15.533
  670    H    LYS  83           H        LYS  83 -25.273  -9.361  12.600
  671    HA   LYS  83           HA       LYS  83 -24.134  -9.680   9.904
  672   1HB   LYS  83          2HB       LYS  83 -25.980 -11.400   9.607
  673   2HB   LYS  83          1HB       LYS  83 -24.669 -11.840  10.689
  674   1HG   LYS  83          2HG       LYS  83 -26.098 -11.157  12.605
  675   2HG   LYS  83          1HG       LYS  83 -27.420 -10.900  11.466
  676   1HD   LYS  83          2HD       LYS  83 -25.968 -13.524  11.659
  677   2HD   LYS  83          1HD       LYS  83 -27.343 -13.140  12.693
  678   1HE   LYS  83          2HE       LYS  83 -28.211 -14.347  10.854
  679   2HE   LYS  83          1HE       LYS  83 -28.642 -12.658  10.586
  680   1HZ   LYS  83          1HZ       LYS  83 -26.273 -13.952   9.359
  681   2HZ   LYS  83          2HZ       LYS  83 -26.931 -12.441   8.979
  682   3HZ   LYS  83          3HZ       LYS  83 -27.780 -13.852   8.597
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1  -6.266  12.026   2.898
    2   2H    MET   1          2HT       MET   1  -6.598  13.615   2.420
    3   3H    MET   1          3HT       MET   1  -7.231  13.021   3.871
    4    HA   MET   1           HA       MET   1  -5.367  14.487   4.275
    5   1HB   MET   1          2HB       MET   1  -4.726  11.590   4.860
    6   2HB   MET   1          1HB       MET   1  -4.094  12.986   5.724
    7   1HG   MET   1          2HG       MET   1  -6.976  12.126   5.619
    8   2HG   MET   1          1HG       MET   1  -5.871  11.893   6.971
    9   1HE   MET   1          1HE       MET   1  -7.720  13.055   8.563
   10   2HE   MET   1          2HE       MET   1  -8.762  13.280   7.157
   11   3HE   MET   1          3HE       MET   1  -8.416  14.640   8.226
   12    H    TYR   2           H        TYR   2  -3.018  14.731   4.231
   13    HA   TYR   2           HA       TYR   2  -2.003  14.269   1.577
   14   1HB   TYR   2          2HB       TYR   2  -1.660  16.317   3.241
   15   2HB   TYR   2          1HB       TYR   2  -0.266  15.365   3.741
   16    HD1  TYR   2           1HD      TYR   2  -1.896  16.663   0.640
   17    HD2  TYR   2           2HD      TYR   2   1.734  15.647   2.612
   18    HE1  TYR   2           1HE      TYR   2  -0.621  17.537  -1.271
   19    HE2  TYR   2           2HE      TYR   2   3.021  16.519   0.705
   20    HH   TYR   2           HH       TYR   2   2.674  16.935  -1.712
   21    H    ASP   3           H        ASP   3   0.581  13.770   1.688
   22    HA   ASP   3           HA       ASP   3   0.781  11.018   2.130
   23   1HB   ASP   3          2HB       ASP   3   2.997  13.066   1.903
   24   2HB   ASP   3          1HB       ASP   3   3.208  11.324   1.760
   25    H    TRP   4           H        TRP   4   2.531  10.011   3.534
   26    HA   TRP   4           HA       TRP   4   2.988  11.336   6.070
   27   1HB   TRP   4          2HB       TRP   4   2.033   9.369   7.341
   28   2HB   TRP   4          1HB       TRP   4   0.847  10.414   6.568
   29    HD1  TRP   4           HD       TRP   4   2.598   7.013   5.927
   30    HE1  TRP   4           1HE      TRP   4   0.965   5.519   4.611
   31    HE3  TRP   4           3HE      TRP   4  -1.202  10.365   5.244
   32    HZ2  TRP   4           2HZ      TRP   4  -1.596   5.733   3.443
   33    HZ3  TRP   4           3HZ      TRP   4  -3.209   9.641   4.020
   34    HH2  TRP   4           HH       TRP   4  -3.401   7.373   3.138
   35    H    ASN   5           H        ASN   5   3.875   9.246   3.636
   36    HA   ASN   5           HA       ASN   5   5.724   7.676   5.241
   37   1HB   ASN   5          2HB       ASN   5   5.310   7.692   2.244
   38   2HB   ASN   5          1HB       ASN   5   6.248   6.515   3.158
   39   1HD2  ASN   5          1HD2      ASN   5   5.180   4.998   4.435
   40   2HD2  ASN   5          2HD2      ASN   5   3.503   4.647   4.222
   41    H    ILE   6           H        ILE   6   6.082  10.512   5.158
   42    HA   ILE   6           HA       ILE   6   8.235  11.149   3.380
   43    HB   ILE   6           HB       ILE   6   7.423  12.652   5.856
   44   1HG1  ILE   6          2HG1      ILE   6   5.478  12.109   4.373
   45   2HG1  ILE   6          1HG1      ILE   6   5.784  13.825   4.577
   46   1HG2  ILE   6          1HG2      ILE   6   8.774  13.489   3.298
   47   2HG2  ILE   6          2HG2      ILE   6   9.486  13.435   4.911
   48   3HG2  ILE   6          3HG2      ILE   6   8.219  14.605   4.546
   49   1HD1  ILE   6          1HD1      ILE   6   6.655  12.192   2.213
   50   2HD1  ILE   6          2HD1      ILE   6   6.823  13.936   2.408
   51   3HD1  ILE   6          3HD1      ILE   6   5.219  13.214   2.269
   52    H    ALA   7           H        ALA   7   8.010   9.422   6.248
   53    HA   ALA   7           HA       ALA   7  10.698  10.097   7.152
   54   1HB   ALA   7          1HB       ALA   7  10.195   8.742   9.106
   55   2HB   ALA   7          2HB       ALA   7   8.678   8.223   8.374
   56   3HB   ALA   7          3HB       ALA   7   8.908   9.913   8.821
   57    H    ALA   8           H        ALA   8  10.286   8.712   4.627
   58    HA   ALA   8           HA       ALA   8  11.565   6.130   5.233
   59   1HB   ALA   8          1HB       ALA   8   9.413   5.874   4.122
   60   2HB   ALA   8          2HB       ALA   8  10.729   5.334   3.078
   61   3HB   ALA   8          3HB       ALA   8   9.965   6.898   2.797
   62    H    LYS   9           H        LYS   9  13.700   6.704   5.221
   63    HA   LYS   9           HA       LYS   9  14.754   8.164   2.911
   64   1HB   LYS   9          2HB       LYS   9  15.810   7.539   5.646
   65   2HB   LYS   9          1HB       LYS   9  16.930   7.932   4.353
   66   1HG   LYS   9          2HG       LYS   9  16.467   9.914   5.607
   67   2HG   LYS   9          1HG       LYS   9  15.728  10.068   4.014
   68   1HD   LYS   9          2HD       LYS   9  13.968   8.889   6.035
   69   2HD   LYS   9          1HD       LYS   9  14.468  10.541   6.397
   70   1HE   LYS   9          2HE       LYS   9  13.165   9.582   3.852
   71   2HE   LYS   9          1HE       LYS   9  12.399  10.534   5.120
   72   1HZ   LYS   9          1HZ       LYS   9  14.674  11.407   3.425
   73   2HZ   LYS   9          2HZ       LYS   9  13.973  12.321   4.663
   74   3HZ   LYS   9          3HZ       LYS   9  13.072  11.932   3.285
   75    H    SER  10           H        SER  10  14.163   5.056   3.815
   76    HA   SER  10           HA       SER  10  16.514   3.699   2.978
   77   1HB   SER  10          2HB       SER  10  14.599   2.814   4.428
   78   2HB   SER  10          1HB       SER  10  13.748   2.543   2.909
   79    HG   SER  10           HG       SER  10  15.979   1.250   3.957
   80    H    GLN  11           H        GLN  11  15.179   1.782   1.273
   81    HA   GLN  11           HA       GLN  11  15.491   3.281  -1.213
   82   1HB   GLN  11          2HB       GLN  11  17.339   1.729  -1.086
   83   2HB   GLN  11          1HB       GLN  11  16.268   0.423  -0.595
   84   1HG   GLN  11          2HG       GLN  11  15.143   0.608  -2.811
   85   2HG   GLN  11          1HG       GLN  11  16.383   1.769  -3.283
   86   1HE2  GLN  11          1HE2      GLN  11  18.478   0.370  -1.802
   87   2HE2  GLN  11          2HE2      GLN  11  18.863  -1.035  -2.730
   88    H    GLU  12           H        GLU  12  14.441   0.288   0.010
   89    HA   GLU  12           HA       GLU  12  12.080   0.072  -1.621
   90   1HB   GLU  12          2HB       GLU  12  13.089  -1.671   0.622
   91   2HB   GLU  12          1HB       GLU  12  11.718  -2.064  -0.406
   92   1HG   GLU  12          2HG       GLU  12  13.174  -2.083  -2.358
   93   2HG   GLU  12          1HG       GLU  12  14.551  -1.662  -1.340
   94    H    GLU  13           H        GLU  13  12.650   0.933   1.763
   95    HA   GLU  13           HA       GLU  13  10.124   0.531   2.792
   96   1HB   GLU  13          2HB       GLU  13  12.006   2.810   3.397
   97   2HB   GLU  13          1HB       GLU  13  10.595   2.391   4.363
   98   1HG   GLU  13          2HG       GLU  13  12.959   0.610   3.852
   99   2HG   GLU  13          1HG       GLU  13  12.657   1.522   5.331
  100    H    ARG  14           H        ARG  14  11.297   3.461   1.200
  101    HA   ARG  14           HA       ARG  14   8.866   4.861   1.313
  102   1HB   ARG  14          2HB       ARG  14   9.851   6.300  -0.445
  103   2HB   ARG  14          1HB       ARG  14  10.939   6.019   0.907
  104   1HG   ARG  14          2HG       ARG  14  12.093   4.286  -0.425
  105   2HG   ARG  14          1HG       ARG  14  11.045   4.685  -1.789
  106   1HD   ARG  14          2HD       ARG  14  12.886   6.617  -0.390
  107   2HD   ARG  14          1HD       ARG  14  13.252   5.793  -1.907
  108    HE   ARG  14           HE       ARG  14  10.819   7.143  -2.202
  109   1HH1  ARG  14          1HH1      ARG  14  14.204   7.843  -1.757
  110   2HH1  ARG  14          2HH1      ARG  14  14.130   9.363  -2.582
  111   1HH2  ARG  14          1HH2      ARG  14  10.712   9.145  -3.289
  112   2HH2  ARG  14          2HH2      ARG  14  12.145  10.104  -3.451
  113    H    ASP  15           H        ASP  15  10.144   2.702  -1.171
  114    HA   ASP  15           HA       ASP  15   7.968   3.227  -2.961
  115   1HB   ASP  15          2HB       ASP  15  10.162   1.165  -2.995
  116   2HB   ASP  15          1HB       ASP  15   8.943   1.292  -4.259
  117    H    LYS  16           H        LYS  16   8.907   0.220  -1.276
  118    HA   LYS  16           HA       LYS  16   6.816  -1.378  -1.980
  119   1HB   LYS  16          2HB       LYS  16   8.156  -1.302   0.720
  120   2HB   LYS  16          1HB       LYS  16   7.204  -2.640   0.092
  121   1HG   LYS  16          2HG       LYS  16   8.925  -2.496  -1.891
  122   2HG   LYS  16          1HG       LYS  16   9.929  -1.727  -0.662
  123   1HD   LYS  16          2HD       LYS  16  10.425  -4.058  -0.631
  124   2HD   LYS  16          1HD       LYS  16   9.475  -3.704   0.813
  125   1HE   LYS  16          2HE       LYS  16   7.475  -4.560  -0.259
  126   2HE   LYS  16          1HE       LYS  16   8.366  -4.833  -1.756
  127   1HZ   LYS  16          1HZ       LYS  16   8.086  -6.871  -0.470
  128   2HZ   LYS  16          2HZ       LYS  16   8.915  -6.182   0.835
  129   3HZ   LYS  16          3HZ       LYS  16   9.723  -6.467  -0.622
  130    H    VAL  17           H        VAL  17   6.817   0.430   1.108
  131    HA   VAL  17           HA       VAL  17   4.205  -0.272   1.787
  132    HB   VAL  17           HB       VAL  17   4.323   1.362   3.486
  133   1HG1  VAL  17          1HG1      VAL  17   7.033   0.146   3.030
  134   2HG1  VAL  17          2HG1      VAL  17   5.664  -0.630   3.830
  135   3HG1  VAL  17          3HG1      VAL  17   6.438   0.772   4.569
  136   1HG2  VAL  17          1HG2      VAL  17   5.036   3.291   2.428
  137   2HG2  VAL  17          2HG2      VAL  17   6.491   2.509   1.821
  138   3HG2  VAL  17          3HG2      VAL  17   6.351   2.896   3.537
  139    H    ASN  18           H        ASN  18   5.416   2.707   0.263
  140    HA   ASN  18           HA       ASN  18   2.924   3.998   0.105
  141   1HB   ASN  18          2HB       ASN  18   5.414   4.293  -1.567
  142   2HB   ASN  18          1HB       ASN  18   4.012   5.343  -1.730
  143   1HD2  ASN  18          1HD2      ASN  18   6.307   4.137   0.671
  144   2HD2  ASN  18          2HD2      ASN  18   6.382   5.593   1.590
  145    H    VAL  19           H        VAL  19   4.196   1.351  -1.606
  146    HA   VAL  19           HA       VAL  19   2.426   1.723  -3.897
  147    HB   VAL  19           HB       VAL  19   4.917   0.481  -3.622
  148   1HG1  VAL  19          1HG1      VAL  19   2.812  -1.611  -4.140
  149   2HG1  VAL  19          2HG1      VAL  19   3.851  -1.518  -2.720
  150   3HG1  VAL  19          3HG1      VAL  19   4.553  -1.830  -4.307
  151   1HG2  VAL  19          1HG2      VAL  19   4.672  -0.011  -5.992
  152   2HG2  VAL  19          2HG2      VAL  19   4.040   1.589  -5.611
  153   3HG2  VAL  19          3HG2      VAL  19   2.932   0.245  -5.876
  154    H    ASP  20           H        ASP  20   2.799  -0.055  -0.953
  155    HA   ASP  20           HA       ASP  20   0.807  -2.027  -1.405
  156   1HB   ASP  20          2HB       ASP  20   2.539  -2.236   0.355
  157   2HB   ASP  20          1HB       ASP  20   1.815  -0.883   1.216
  158    H    LEU  21           H        LEU  21   0.821   1.217  -0.069
  159    HA   LEU  21           HA       LEU  21  -1.999   1.119   0.550
  160   1HB   LEU  21          2HB       LEU  21  -1.727   3.473   1.204
  161   2HB   LEU  21          1HB       LEU  21  -0.599   2.411   2.023
  162    HG   LEU  21           HG       LEU  21   1.015   3.161   0.071
  163   1HD1  LEU  21          1HD1      LEU  21  -1.014   5.377   0.215
  164   2HD1  LEU  21          2HD1      LEU  21  -0.499   4.475  -1.208
  165   3HD1  LEU  21          3HD1      LEU  21   0.619   5.585  -0.417
  166   1HD2  LEU  21          1HD2      LEU  21   0.370   4.994   2.372
  167   2HD2  LEU  21          2HD2      LEU  21   1.916   4.833   1.537
  168   3HD2  LEU  21          3HD2      LEU  21   1.298   3.501   2.515
  169    H    ALA  22           H        ALA  22   0.124   2.262  -1.966
  170    HA   ALA  22           HA       ALA  22  -1.458   4.020  -3.356
  171   1HB   ALA  22          1HB       ALA  22   0.790   3.551  -4.081
  172   2HB   ALA  22          2HB       ALA  22  -0.312   3.196  -5.410
  173   3HB   ALA  22          3HB       ALA  22   0.365   1.881  -4.451
  174    H    ALA  23           H        ALA  23  -1.363   0.501  -3.743
  175    HA   ALA  23           HA       ALA  23  -3.547   0.350  -5.537
  176   1HB   ALA  23          1HB       ALA  23  -3.566  -2.101  -4.681
  177   2HB   ALA  23          2HB       ALA  23  -2.100  -1.635  -3.816
  178   3HB   ALA  23          3HB       ALA  23  -2.164  -1.521  -5.575
  179    H    SER  24           H        SER  24  -3.224  -0.204  -2.068
  180    HA   SER  24           HA       SER  24  -5.715  -1.015  -1.342
  181   1HB   SER  24          2HB       SER  24  -3.894  -0.757   0.259
  182   2HB   SER  24          1HB       SER  24  -3.995   0.997   0.122
  183    HG   SER  24           HG       SER  24  -6.407   0.234   0.711
  184    H    GLY  25           H        GLY  25  -4.794   2.455  -1.375
  185   1HA   GLY  25          2HA       GLY  25  -7.309   3.467  -0.783
  186   2HA   GLY  25          1HA       GLY  25  -6.073   4.325  -1.689
  187    H    VAL  26           H        VAL  26  -5.927   2.652  -3.944
  188    HA   VAL  26           HA       VAL  26  -7.916   3.751  -5.543
  189    HB   VAL  26           HB       VAL  26  -6.200   1.322  -6.046
  190   1HG1  VAL  26          1HG1      VAL  26  -6.701   1.679  -8.429
  191   2HG1  VAL  26          2HG1      VAL  26  -7.864   2.930  -7.986
  192   3HG1  VAL  26          3HG1      VAL  26  -8.143   1.256  -7.507
  193   1HG2  VAL  26          1HG2      VAL  26  -5.053   3.505  -5.637
  194   2HG2  VAL  26          2HG2      VAL  26  -5.897   4.152  -7.043
  195   3HG2  VAL  26          3HG2      VAL  26  -4.757   2.820  -7.235
  196    H    ALA  27           H        ALA  27  -7.694   0.275  -4.624
  197    HA   ALA  27           HA       ALA  27 -10.449  -0.089  -5.479
  198   1HB   ALA  27          1HB       ALA  27  -9.962  -2.514  -4.806
  199   2HB   ALA  27          2HB       ALA  27  -8.291  -1.984  -4.639
  200   3HB   ALA  27          3HB       ALA  27  -9.104  -1.845  -6.193
  201    H    TYR  28           H        TYR  28  -8.630  -0.734  -2.464
  202    HA   TYR  28           HA       TYR  28 -10.630  -1.637  -0.846
  203   1HB   TYR  28          2HB       TYR  28  -8.034  -0.589  -0.466
  204   2HB   TYR  28          1HB       TYR  28  -9.079   0.263   0.659
  205    HD1  TYR  28           1HD      TYR  28  -7.802  -0.709   2.508
  206    HD2  TYR  28           2HD      TYR  28  -9.922  -3.190  -0.215
  207    HE1  TYR  28           1HE      TYR  28  -7.605  -2.586   4.078
  208    HE2  TYR  28           2HE      TYR  28  -9.738  -5.075   1.350
  209    HH   TYR  28           HH       TYR  28  -8.737  -4.692   4.582
  210    H    LYS  29           H        LYS  29 -10.124   1.718  -1.838
  211    HA   LYS  29           HA       LYS  29 -11.932   2.801   0.080
  212   1HB   LYS  29          2HB       LYS  29 -10.279   4.261  -0.849
  213   2HB   LYS  29          1HB       LYS  29 -10.814   3.915  -2.489
  214   1HG   LYS  29          2HG       LYS  29 -12.907   5.063  -2.090
  215   2HG   LYS  29          1HG       LYS  29 -12.455   5.349  -0.408
  216   1HD   LYS  29          2HD       LYS  29 -10.502   6.648  -1.209
  217   2HD   LYS  29          1HD       LYS  29 -11.088   6.446  -2.861
  218   1HE   LYS  29          2HE       LYS  29 -11.769   8.604  -2.021
  219   2HE   LYS  29          1HE       LYS  29 -13.185   7.575  -2.219
  220   1HZ   LYS  29          1HZ       LYS  29 -13.097   7.101   0.170
  221   2HZ   LYS  29          2HZ       LYS  29 -13.299   8.751  -0.137
  222   3HZ   LYS  29          3HZ       LYS  29 -11.787   8.160   0.335
  223    H    GLU  30           H        GLU  30 -12.262   2.456  -3.446
  224    HA   GLU  30           HA       GLU  30 -14.987   3.171  -3.474
  225   1HB   GLU  30          2HB       GLU  30 -13.468   1.559  -5.528
  226   2HB   GLU  30          1HB       GLU  30 -14.988   2.404  -5.790
  227   1HG   GLU  30          2HG       GLU  30 -12.352   3.691  -5.113
  228   2HG   GLU  30          1HG       GLU  30 -13.099   3.635  -6.708
  229    H    ARG  31           H        ARG  31 -13.882   0.636  -1.914
  230    HA   ARG  31           HA       ARG  31 -16.179  -1.050  -2.654
  231   1HB   ARG  31          2HB       ARG  31 -13.368  -1.713  -2.438
  232   2HB   ARG  31          1HB       ARG  31 -14.334  -2.698  -1.350
  233   1HG   ARG  31          2HG       ARG  31 -14.095  -3.852  -3.429
  234   2HG   ARG  31          1HG       ARG  31 -15.771  -3.327  -3.266
  235   1HD   ARG  31          2HD       ARG  31 -15.361  -1.456  -4.751
  236   2HD   ARG  31          1HD       ARG  31 -13.653  -1.877  -4.851
  237    HE   ARG  31           HE       ARG  31 -15.224  -4.072  -5.663
  238   1HH1  ARG  31          1HH1      ARG  31 -14.239  -0.904  -6.733
  239   2HH1  ARG  31          2HH1      ARG  31 -14.367  -1.294  -8.416
  240   1HH2  ARG  31          1HH2      ARG  31 -15.395  -4.591  -7.876
  241   2HH2  ARG  31          2HH2      ARG  31 -15.024  -3.386  -9.065
  242    H    LEU  32           H        LEU  32 -13.876  -0.642   0.038
  243    HA   LEU  32           HA       LEU  32 -16.075  -1.064   1.921
  244   1HB   LEU  32          2HB       LEU  32 -13.215  -0.923   2.756
  245   2HB   LEU  32          1HB       LEU  32 -14.531  -1.827   3.469
  246    HG   LEU  32           HG       LEU  32 -13.136  -3.454   2.574
  247   1HD1  LEU  32          1HD1      LEU  32 -14.305  -4.388   0.618
  248   2HD1  LEU  32          2HD1      LEU  32 -15.260  -2.905   0.541
  249   3HD1  LEU  32          3HD1      LEU  32 -15.361  -3.949   1.957
  250   1HD2  LEU  32          1HD2      LEU  32 -11.918  -1.651   1.151
  251   2HD2  LEU  32          2HD2      LEU  32 -12.964  -2.263  -0.133
  252   3HD2  LEU  32          3HD2      LEU  32 -11.864  -3.355   0.702
  253    H    ASN  33           H        ASN  33 -14.161   0.142   3.980
  254    HA   ASN  33           HA       ASN  33 -14.892   2.942   3.482
  255   1HB   ASN  33          2HB       ASN  33 -16.047   1.921   5.413
  256   2HB   ASN  33          1HB       ASN  33 -14.488   1.539   6.135
  257   1HD2  ASN  33          1HD2      ASN  33 -13.305   3.138   7.109
  258   2HD2  ASN  33          2HD2      ASN  33 -13.925   4.721   7.414
  259    H    ILE  34           H        ILE  34 -12.889   3.038   2.248
  260    HA   ILE  34           HA       ILE  34 -10.565   3.440   4.027
  261    HB   ILE  34           HB       ILE  34 -10.603   2.262   1.259
  262   1HG1  ILE  34          2HG1      ILE  34  -9.037   0.641   2.510
  263   2HG1  ILE  34          1HG1      ILE  34  -9.655   1.396   3.973
  264   1HG2  ILE  34          1HG2      ILE  34  -8.226   3.398   2.721
  265   2HG2  ILE  34          2HG2      ILE  34  -8.898   3.964   1.192
  266   3HG2  ILE  34          3HG2      ILE  34  -8.135   2.377   1.285
  267   1HD1  ILE  34          1HD1      ILE  34 -10.994  -0.474   3.701
  268   2HD1  ILE  34          2HD1      ILE  34 -11.105  -0.263   1.955
  269   3HD1  ILE  34          3HD1      ILE  34 -11.972   0.832   3.030
  270    HA   PRO  35           HA       PRO  35 -11.279   7.487   2.189
  271   1HB   PRO  35          2HB       PRO  35 -10.423   8.965   4.212
  272   2HB   PRO  35          1HB       PRO  35 -11.911   8.019   4.373
  273   1HG   PRO  35          2HG       PRO  35  -9.137   7.337   5.310
  274   2HG   PRO  35          1HG       PRO  35 -10.664   7.265   6.219
  275   1HD   PRO  35          2HD       PRO  35  -9.530   5.098   4.994
  276   2HD   PRO  35          1HD       PRO  35 -11.277   5.269   5.258
  277    H    VAL  36           H        VAL  36  -9.445   6.735   0.660
  278    HA   VAL  36           HA       VAL  36  -7.123   8.450   1.167
  279    HB   VAL  36           HB       VAL  36  -7.006   5.629   0.084
  280   1HG1  VAL  36          1HG1      VAL  36  -4.839   7.701   0.415
  281   2HG1  VAL  36          2HG1      VAL  36  -5.410   6.989  -1.095
  282   3HG1  VAL  36          3HG1      VAL  36  -4.546   5.994   0.080
  283   1HG2  VAL  36          1HG2      VAL  36  -5.679   6.710   2.556
  284   2HG2  VAL  36          2HG2      VAL  36  -5.885   5.026   2.072
  285   3HG2  VAL  36          3HG2      VAL  36  -7.283   5.975   2.588
  286    H    ILE  37           H        ILE  37  -6.125   9.297  -0.722
  287    HA   ILE  37           HA       ILE  37  -7.991   9.431  -2.978
  288    HB   ILE  37           HB       ILE  37  -5.596  11.179  -2.437
  289   1HG1  ILE  37          2HG1      ILE  37  -7.278  11.400  -0.652
  290   2HG1  ILE  37          1HG1      ILE  37  -7.170  12.860  -1.626
  291   1HG2  ILE  37          1HG2      ILE  37  -6.215  11.157  -4.767
  292   2HG2  ILE  37          2HG2      ILE  37  -6.676  12.702  -4.050
  293   3HG2  ILE  37          3HG2      ILE  37  -7.901  11.469  -4.354
  294   1HD1  ILE  37          1HD1      ILE  37  -9.474  12.272  -1.062
  295   2HD1  ILE  37          2HD1      ILE  37  -9.283  10.738  -1.908
  296   3HD1  ILE  37          3HD1      ILE  37  -9.193  12.255  -2.802
  297    H    ALA  38           H        ALA  38  -7.548   8.574  -4.891
  298    HA   ALA  38           HA       ALA  38  -5.262   6.902  -5.237
  299   1HB   ALA  38          1HB       ALA  38  -7.464   6.344  -6.164
  300   2HB   ALA  38          2HB       ALA  38  -6.206   6.363  -7.401
  301   3HB   ALA  38          3HB       ALA  38  -7.334   7.712  -7.269
  302    H    GLU  39           H        GLU  39  -6.274   9.978  -6.703
  303    HA   GLU  39           HA       GLU  39  -4.351  10.297  -8.638
  304   1HB   GLU  39          2HB       GLU  39  -4.885  12.699  -6.998
  305   2HB   GLU  39          1HB       GLU  39  -4.955  12.492  -8.739
  306   1HG   GLU  39          2HG       GLU  39  -7.019  11.579  -6.752
  307   2HG   GLU  39          1HG       GLU  39  -7.150  12.959  -7.841
  308    H    GLN  40           H        GLN  40  -3.931  10.340  -5.230
  309    HA   GLN  40           HA       GLN  40  -1.412  11.754  -5.207
  310   1HB   GLN  40          2HB       GLN  40  -2.447   9.879  -3.098
  311   2HB   GLN  40          1HB       GLN  40  -1.282  11.181  -2.894
  312   1HG   GLN  40          2HG       GLN  40  -3.044  12.818  -3.391
  313   2HG   GLN  40          1HG       GLN  40  -4.207  11.501  -3.510
  314   1HE2  GLN  40          1HE2      GLN  40  -4.245  13.741  -1.706
  315   2HE2  GLN  40          2HE2      GLN  40  -4.197  13.096  -0.105
  316    H    VAL  41           H        VAL  41  -2.496   8.408  -5.068
  317    HA   VAL  41           HA       VAL  41   0.168   7.377  -4.873
  318    HB   VAL  41           HB       VAL  41  -0.762   5.294  -4.625
  319   1HG1  VAL  41          1HG1      VAL  41  -3.010   7.159  -3.879
  320   2HG1  VAL  41          2HG1      VAL  41  -1.635   6.708  -2.869
  321   3HG1  VAL  41          3HG1      VAL  41  -2.836   5.496  -3.315
  322   1HG2  VAL  41          1HG2      VAL  41  -1.786   5.080  -6.788
  323   2HG2  VAL  41          2HG2      VAL  41  -3.072   6.196  -6.334
  324   3HG2  VAL  41          3HG2      VAL  41  -2.962   4.620  -5.557
  325    H    ALA  42           H        ALA  42  -1.882   8.424  -7.367
  326    HA   ALA  42           HA       ALA  42  -0.750   6.718  -9.390
  327   1HB   ALA  42          1HB       ALA  42  -3.105   7.302  -9.505
  328   2HB   ALA  42          2HB       ALA  42  -2.241   7.862 -10.937
  329   3HB   ALA  42          3HB       ALA  42  -2.680   9.006  -9.669
  330    H    ARG  43           H        ARG  43  -0.414  10.065  -8.341
  331    HA   ARG  43           HA       ARG  43   1.033  10.999 -10.566
  332   1HB   ARG  43          2HB       ARG  43   1.894  12.755  -8.967
  333   2HB   ARG  43          1HB       ARG  43   0.147  12.629  -9.096
  334   1HG   ARG  43          2HG       ARG  43   0.494  12.863  -6.826
  335   2HG   ARG  43          1HG       ARG  43   0.318  11.120  -7.020
  336   1HD   ARG  43          2HD       ARG  43   2.191  11.761  -5.529
  337   2HD   ARG  43          1HD       ARG  43   2.702  10.816  -6.927
  338    HE   ARG  43           HE       ARG  43   2.881  13.635  -7.381
  339   1HH1  ARG  43          1HH1      ARG  43   4.497  10.900  -5.950
  340   2HH1  ARG  43          2HH1      ARG  43   6.075  11.598  -6.083
  341   1HH2  ARG  43          1HH2      ARG  43   4.957  14.561  -7.565
  342   2HH2  ARG  43          2HH2      ARG  43   6.336  13.679  -7.001
  343    H    GLU  44           H        GLU  44   1.839   8.606  -8.486
  344    HA   GLU  44           HA       GLU  44   4.720   9.016  -8.917
  345   1HB   GLU  44          2HB       GLU  44   4.752   7.301  -6.858
  346   2HB   GLU  44          1HB       GLU  44   4.774   9.046  -6.654
  347   1HG   GLU  44          2HG       GLU  44   2.466   9.108  -6.162
  348   2HG   GLU  44          1HG       GLU  44   2.243   7.441  -6.678
  349    H    GLN  45           H        GLN  45   2.666   6.288  -7.950
  350    HA   GLN  45           HA       GLN  45   2.565   4.119  -8.680
  351   1HB   GLN  45          2HB       GLN  45   2.966   5.569 -11.295
  352   2HB   GLN  45          1HB       GLN  45   2.657   3.841 -11.203
  353   1HG   GLN  45          2HG       GLN  45   0.528   4.279 -10.088
  354   2HG   GLN  45          1HG       GLN  45   0.839   6.012 -10.183
  355   1HE2  GLN  45          1HE2      GLN  45  -1.015   6.367 -11.400
  356   2HE2  GLN  45          2HE2      GLN  45  -1.123   5.915 -13.064
  357    HA   PRO  46           HA       PRO  46   7.210   3.841  -8.531
  358   1HB   PRO  46          2HB       PRO  46   6.467   1.704  -6.619
  359   2HB   PRO  46          1HB       PRO  46   7.649   3.008  -6.450
  360   1HG   PRO  46          2HG       PRO  46   5.341   3.102  -5.129
  361   2HG   PRO  46          1HG       PRO  46   6.030   4.570  -5.849
  362   1HD   PRO  46          2HD       PRO  46   3.819   2.824  -6.870
  363   2HD   PRO  46          1HD       PRO  46   3.919   4.599  -6.816
  364    H    GLU  47           H        GLU  47   8.040   2.799 -10.173
  365    HA   GLU  47           HA       GLU  47   6.888   0.417 -11.286
  366   1HB   GLU  47          2HB       GLU  47   7.899   1.937 -12.818
  367   2HB   GLU  47          1HB       GLU  47   9.407   1.952 -11.912
  368   1HG   GLU  47          2HG       GLU  47   9.721   0.640 -13.878
  369   2HG   GLU  47          1HG       GLU  47   9.715  -0.438 -12.482
  370    H    ASN  48           H        ASN  48   9.899   1.144  -9.553
  371    HA   ASN  48           HA       ASN  48  11.069  -1.359  -9.582
  372   1HB   ASN  48          2HB       ASN  48  11.126   0.726  -7.393
  373   2HB   ASN  48          1HB       ASN  48  12.213  -0.658  -7.480
  374   1HD2  ASN  48          1HD2      ASN  48  14.019   0.660  -7.619
  375   2HD2  ASN  48          2HD2      ASN  48  14.410   1.538  -9.054
  376    H    LEU  49           H        LEU  49   8.141  -0.523  -8.164
  377    HA   LEU  49           HA       LEU  49   8.106  -3.033  -6.658
  378   1HB   LEU  49          2HB       LEU  49   7.619  -0.311  -5.579
  379   2HB   LEU  49          1HB       LEU  49   6.534  -1.576  -5.044
  380    HG   LEU  49           HG       LEU  49   8.250  -1.401  -3.415
  381   1HD1  LEU  49          1HD1      LEU  49   7.594  -3.684  -3.985
  382   2HD1  LEU  49          2HD1      LEU  49   9.277  -3.602  -3.468
  383   3HD1  LEU  49          3HD1      LEU  49   8.887  -3.758  -5.181
  384   1HD2  LEU  49          1HD2      LEU  49  10.533  -1.257  -3.810
  385   2HD2  LEU  49          2HD2      LEU  49   9.841  -0.268  -5.097
  386   3HD2  LEU  49          3HD2      LEU  49  10.392  -1.906  -5.442
  387    H    ARG  50           H        ARG  50   7.038  -2.036  -9.237
  388    HA   ARG  50           HA       ARG  50   4.268  -1.623  -9.114
  389   1HB   ARG  50          2HB       ARG  50   5.635  -1.209 -11.123
  390   2HB   ARG  50          1HB       ARG  50   5.892  -2.937 -11.302
  391   1HG   ARG  50          2HG       ARG  50   4.197  -2.186 -12.845
  392   2HG   ARG  50          1HG       ARG  50   3.476  -3.246 -11.633
  393   1HD   ARG  50          2HD       ARG  50   2.620  -1.330 -10.423
  394   2HD   ARG  50          1HD       ARG  50   3.418  -0.231 -11.547
  395    HE   ARG  50           HE       ARG  50   1.832  -1.710 -13.161
  396   1HH1  ARG  50          1HH1      ARG  50   1.238   0.084 -10.232
  397   2HH1  ARG  50          2HH1      ARG  50  -0.396   0.478 -10.654
  398   1HH2  ARG  50          1HH2      ARG  50  -0.318  -1.198 -13.721
  399   2HH2  ARG  50          2HH2      ARG  50  -1.280  -0.250 -12.636
  400    H    THR  51           H        THR  51   6.224  -4.463  -8.855
  401    HA   THR  51           HA       THR  51   4.164  -6.371  -9.364
  402    HB   THR  51           HB       THR  51   6.638  -6.872  -7.713
  403    HG1  THR  51           1HG      THR  51   6.602  -5.938 -10.174
  404   1HG2  THR  51          1HG2      THR  51   4.989  -8.675  -7.795
  405   2HG2  THR  51          2HG2      THR  51   6.455  -9.122  -8.670
  406   3HG2  THR  51          3HG2      THR  51   5.014  -8.626  -9.557
  407    H    TYR  52           H        TYR  52   5.600  -4.997  -6.425
  408    HA   TYR  52           HA       TYR  52   4.221  -6.501  -4.534
  409   1HB   TYR  52          2HB       TYR  52   6.166  -5.003  -4.097
  410   2HB   TYR  52          1HB       TYR  52   5.107  -3.616  -4.311
  411    HD1  TYR  52           1HD      TYR  52   5.433  -2.704  -2.117
  412    HD2  TYR  52           2HD      TYR  52   4.079  -6.702  -2.604
  413    HE1  TYR  52           1HE      TYR  52   4.849  -2.789   0.261
  414    HE2  TYR  52           2HE      TYR  52   3.490  -6.807  -0.223
  415    HH   TYR  52           HH       TYR  52   4.110  -5.683   1.877
  416    H    PHE  53           H        PHE  53   3.428  -3.293  -5.852
  417    HA   PHE  53           HA       PHE  53   1.077  -2.779  -4.560
  418   1HB   PHE  53          2HB       PHE  53   1.719  -1.019  -5.829
  419   2HB   PHE  53          1HB       PHE  53   2.264  -2.018  -7.165
  420    HD1  PHE  53           1HD      PHE  53  -0.117   0.297  -6.071
  421    HD2  PHE  53           2HD      PHE  53   0.307  -3.125  -8.566
  422    HE1  PHE  53           1HE      PHE  53  -2.103   0.987  -7.347
  423    HE2  PHE  53           2HE      PHE  53  -1.684  -2.447  -9.838
  424    HZ   PHE  53           HZ       PHE  53  -2.892  -0.388  -9.232
  425    H    MET  54           H        MET  54   1.628  -5.021  -7.174
  426    HA   MET  54           HA       MET  54  -1.174  -5.523  -7.648
  427   1HB   MET  54          2HB       MET  54   1.285  -7.046  -8.537
  428   2HB   MET  54          1HB       MET  54  -0.354  -7.344  -9.104
  429   1HG   MET  54          2HG       MET  54   1.022  -4.698  -9.405
  430   2HG   MET  54          1HG       MET  54   1.123  -5.977 -10.616
  431   1HE   MET  54          1HE       MET  54  -1.311  -3.458 -12.335
  432   2HE   MET  54          2HE       MET  54   0.176  -4.396 -12.488
  433   3HE   MET  54          3HE       MET  54   0.086  -3.064 -11.334
  434    H    GLU  55           H        GLU  55   1.478  -7.111  -5.936
  435    HA   GLU  55           HA       GLU  55   0.183  -9.476  -5.218
  436   1HB   GLU  55          2HB       GLU  55   2.215  -7.898  -3.619
  437   2HB   GLU  55          1HB       GLU  55   1.786  -9.580  -3.339
  438   1HG   GLU  55          2HG       GLU  55   2.609 -10.120  -5.608
  439   2HG   GLU  55          1HG       GLU  55   3.127  -8.446  -5.780
  440    H    ARG  56           H        ARG  56   0.398  -6.392  -3.490
  441    HA   ARG  56           HA       ARG  56  -1.398  -7.166  -1.430
  442   1HB   ARG  56          2HB       ARG  56   0.256  -5.368  -1.126
  443   2HB   ARG  56          1HB       ARG  56  -0.560  -4.406  -2.350
  444   1HG   ARG  56          2HG       ARG  56  -1.130  -3.629  -0.131
  445   2HG   ARG  56          1HG       ARG  56  -2.548  -4.297  -0.935
  446   1HD   ARG  56          2HD       ARG  56  -2.230  -6.405   0.294
  447   2HD   ARG  56          1HD       ARG  56  -0.845  -5.696   1.121
  448    HE   ARG  56           HE       ARG  56  -3.224  -4.140   1.429
  449   1HH1  ARG  56          1HH1      ARG  56  -1.487  -6.913   2.628
  450   2HH1  ARG  56          2HH1      ARG  56  -2.212  -6.848   4.201
  451   1HH2  ARG  56          1HH2      ARG  56  -4.185  -4.049   3.494
  452   2HH2  ARG  56          2HH2      ARG  56  -3.747  -5.222   4.691
  453    H    LEU  57           H        LEU  57  -1.693  -5.490  -4.512
  454    HA   LEU  57           HA       LEU  57  -4.248  -4.509  -4.423
  455   1HB   LEU  57          2HB       LEU  57  -2.921  -4.100  -6.347
  456   2HB   LEU  57          1HB       LEU  57  -2.754  -5.812  -6.680
  457    HG   LEU  57           HG       LEU  57  -5.206  -5.883  -7.170
  458   1HD1  LEU  57          1HD1      LEU  57  -5.919  -3.923  -5.950
  459   2HD1  LEU  57          2HD1      LEU  57  -6.319  -3.738  -7.657
  460   3HD1  LEU  57          3HD1      LEU  57  -4.931  -2.888  -6.978
  461   1HD2  LEU  57          1HD2      LEU  57  -3.521  -4.025  -8.843
  462   2HD2  LEU  57          2HD2      LEU  57  -4.993  -4.837  -9.380
  463   3HD2  LEU  57          3HD2      LEU  57  -3.565  -5.785  -8.957
  464    H    ARG  58           H        ARG  58  -3.349  -7.762  -5.527
  465    HA   ARG  58           HA       ARG  58  -6.007  -8.688  -5.794
  466   1HB   ARG  58          2HB       ARG  58  -4.947 -10.927  -5.959
  467   2HB   ARG  58          1HB       ARG  58  -4.221  -9.728  -7.012
  468   1HG   ARG  58          2HG       ARG  58  -2.344  -9.478  -5.541
  469   2HG   ARG  58          1HG       ARG  58  -3.082 -10.555  -4.357
  470   1HD   ARG  58          2HD       ARG  58  -2.908 -12.418  -5.852
  471   2HD   ARG  58          1HD       ARG  58  -2.382 -11.372  -7.170
  472    HE   ARG  58           HE       ARG  58  -0.550 -11.037  -5.127
  473   1HH1  ARG  58          1HH1      ARG  58  -1.687 -13.639  -7.146
  474   2HH1  ARG  58          2HH1      ARG  58  -0.180 -14.493  -7.118
  475   1HH2  ARG  58          1HH2      ARG  58   1.440 -12.149  -5.086
  476   2HH2  ARG  58          2HH2      ARG  58   1.599 -13.645  -5.946
  477    H    HIS  59           H        HIS  59  -3.662  -8.815  -3.179
  478    HA   HIS  59           HA       HIS  59  -4.999 -10.697  -1.578
  479   1HB   HIS  59          2HB       HIS  59  -2.641 -10.046  -1.265
  480   2HB   HIS  59          1HB       HIS  59  -3.165  -8.463  -0.700
  481    HD1  HIS  59           1HD      HIS  59  -2.780 -11.998   0.373
  482    HD2  HIS  59           2HD      HIS  59  -4.308  -8.445   1.893
  483    HE1  HIS  59           1HE      HIS  59  -3.104 -12.404   2.834
  484    HE2  HIS  59           2HE      HIS  59  -4.091 -10.262   3.722
  485    H    TYR  60           H        TYR  60  -4.991  -7.127  -1.227
  486    HA   TYR  60           HA       TYR  60  -6.937  -7.263   0.836
  487   1HB   TYR  60          2HB       TYR  60  -6.962  -4.909   0.896
  488   2HB   TYR  60          1HB       TYR  60  -5.299  -5.383   0.586
  489    HD1  TYR  60           1HD      TYR  60  -4.160  -4.261  -1.032
  490    HD2  TYR  60           2HD      TYR  60  -8.380  -4.497  -1.298
  491    HE1  TYR  60           1HE      TYR  60  -4.104  -2.811  -2.970
  492    HE2  TYR  60           2HE      TYR  60  -8.344  -3.035  -3.256
  493    HH   TYR  60           HH       TYR  60  -6.893  -1.338  -4.257
  494    H    ARG  61           H        ARG  61  -7.078  -7.171  -2.615
  495    HA   ARG  61           HA       ARG  61  -9.726  -6.281  -2.929
  496   1HB   ARG  61          2HB       ARG  61  -8.117  -6.575  -4.799
  497   2HB   ARG  61          1HB       ARG  61  -8.237  -8.318  -4.603
  498   1HG   ARG  61          2HG       ARG  61 -10.525  -8.308  -5.278
  499   2HG   ARG  61          1HG       ARG  61 -10.577  -6.544  -5.259
  500   1HD   ARG  61          2HD       ARG  61  -8.963  -6.460  -7.077
  501   2HD   ARG  61          1HD       ARG  61  -8.847  -8.220  -7.076
  502    HE   ARG  61           HE       ARG  61 -11.384  -8.022  -7.583
  503   1HH1  ARG  61          1HH1      ARG  61  -8.870  -5.908  -8.748
  504   2HH1  ARG  61          2HH1      ARG  61  -9.701  -5.521 -10.218
  505   1HH2  ARG  61          1HH2      ARG  61 -12.483  -7.518  -9.516
  506   2HH2  ARG  61          2HH2      ARG  61 -11.753  -6.436 -10.654
  507    H    GLN  62           H        GLN  62  -8.327  -9.370  -2.122
  508    HA   GLN  62           HA       GLN  62 -10.663 -10.960  -2.326
  509   1HB   GLN  62          2HB       GLN  62  -8.198 -11.259  -0.594
  510   2HB   GLN  62          1HB       GLN  62  -9.477 -12.464  -0.667
  511   1HG   GLN  62          2HG       GLN  62  -9.065 -12.712  -3.083
  512   2HG   GLN  62          1HG       GLN  62  -7.735 -11.563  -2.949
  513   1HE2  GLN  62          1HE2      GLN  62  -6.205 -13.050  -3.613
  514   2HE2  GLN  62          2HE2      GLN  62  -5.692 -14.366  -2.618
  515    H    LEU  63           H        LEU  63  -9.332  -8.835   0.079
  516    HA   LEU  63           HA       LEU  63 -11.357  -9.469   2.047
  517   1HB   LEU  63          2HB       LEU  63  -9.222  -7.332   1.992
  518   2HB   LEU  63          1HB       LEU  63 -10.300  -7.638   3.341
  519    HG   LEU  63           HG       LEU  63  -8.309  -9.635   2.263
  520   1HD1  LEU  63          1HD1      LEU  63  -8.170  -7.848   4.684
  521   2HD1  LEU  63          2HD1      LEU  63  -7.152  -7.753   3.250
  522   3HD1  LEU  63          3HD1      LEU  63  -7.046  -9.154   4.316
  523   1HD2  LEU  63          1HD2      LEU  63  -9.975  -9.657   4.777
  524   2HD2  LEU  63          2HD2      LEU  63  -8.804 -10.883   4.288
  525   3HD2  LEU  63          3HD2      LEU  63 -10.272 -10.638   3.342
  526    H    SER  64           H        SER  64 -10.883  -7.340  -0.607
  527    HA   SER  64           HA       SER  64 -12.579  -5.229   0.176
  528   1HB   SER  64          2HB       SER  64 -11.932  -6.273  -2.597
  529   2HB   SER  64          1HB       SER  64 -12.780  -4.762  -2.270
  530    HG   SER  64           HG       SER  64 -10.917  -3.870  -1.961
  531    H    LEU  65           H        LEU  65 -13.099  -8.453  -0.768
  532    HA   LEU  65           HA       LEU  65 -15.905  -8.083  -1.418
  533   1HB   LEU  65          2HB       LEU  65 -14.429 -10.687  -1.055
  534   2HB   LEU  65          1HB       LEU  65 -15.931 -10.419  -1.918
  535    HG   LEU  65           HG       LEU  65 -13.225  -9.386  -2.774
  536   1HD1  LEU  65          1HD1      LEU  65 -13.395 -11.814  -2.964
  537   2HD1  LEU  65          2HD1      LEU  65 -13.380 -11.045  -4.552
  538   3HD1  LEU  65          3HD1      LEU  65 -14.895 -11.642  -3.874
  539   1HD2  LEU  65          1HD2      LEU  65 -15.013  -7.919  -3.498
  540   2HD2  LEU  65          2HD2      LEU  65 -15.915  -9.296  -4.134
  541   3HD2  LEU  65          3HD2      LEU  65 -14.383  -8.826  -4.872
  542    H    GLN  66           H        GLN  66 -13.957  -9.735   1.083
  543    HA   GLN  66           HA       GLN  66 -16.200 -10.511   2.637
  544   1HB   GLN  66          2HB       GLN  66 -14.703 -11.509   4.036
  545   2HB   GLN  66          1HB       GLN  66 -13.658 -11.299   2.642
  546   1HG   GLN  66          2HG       GLN  66 -12.362 -10.610   4.441
  547   2HG   GLN  66          1HG       GLN  66 -12.944  -9.104   3.733
  548   1HE2  GLN  66          1HE2      GLN  66 -13.004  -7.796   5.448
  549   2HE2  GLN  66          2HE2      GLN  66 -13.939  -8.067   6.872
  550    H    LEU  67           H        LEU  67 -13.926  -7.794   2.987
  551    HA   LEU  67           HA       LEU  67 -14.789  -6.657   5.322
  552   1HB   LEU  67          2HB       LEU  67 -13.367  -5.755   2.965
  553   2HB   LEU  67          1HB       LEU  67 -14.347  -4.476   3.642
  554    HG   LEU  67           HG       LEU  67 -13.188  -5.213   5.896
  555   1HD1  LEU  67          1HD1      LEU  67 -12.041  -7.117   4.694
  556   2HD1  LEU  67          2HD1      LEU  67 -11.015  -6.073   5.678
  557   3HD1  LEU  67          3HD1      LEU  67 -11.033  -5.894   3.922
  558   1HD2  LEU  67          1HD2      LEU  67 -13.049  -3.007   4.800
  559   2HD2  LEU  67          2HD2      LEU  67 -11.734  -3.612   3.793
  560   3HD2  LEU  67          3HD2      LEU  67 -11.525  -3.495   5.541
  561    HA   PRO  68           HA       PRO  68 -18.786  -4.857   4.708
  562   1HB   PRO  68          2HB       PRO  68 -18.705  -2.461   5.832
  563   2HB   PRO  68          1HB       PRO  68 -18.381  -3.911   6.805
  564   1HG   PRO  68          2HG       PRO  68 -16.399  -2.103   5.440
  565   2HG   PRO  68          1HG       PRO  68 -16.462  -2.554   7.165
  566   1HD   PRO  68          2HD       PRO  68 -14.877  -3.855   5.457
  567   2HD   PRO  68          1HD       PRO  68 -15.747  -4.735   6.730
  568    H    LYS  69           H        LYS  69 -19.954  -2.773   3.980
  569    HA   LYS  69           HA       LYS  69 -20.536  -1.429   2.257
  570   1HB   LYS  69          2HB       LYS  69 -17.734  -0.759   2.855
  571   2HB   LYS  69          1HB       LYS  69 -18.318  -0.212   1.287
  572   1HG   LYS  69          2HG       LYS  69 -20.149   0.968   2.366
  573   2HG   LYS  69          1HG       LYS  69 -19.601   0.392   3.941
  574   1HD   LYS  69          2HD       LYS  69 -17.445   1.560   3.562
  575   2HD   LYS  69          1HD       LYS  69 -18.100   2.209   2.057
  576   1HE   LYS  69          2HE       LYS  69 -18.296   3.856   3.816
  577   2HE   LYS  69          1HE       LYS  69 -19.898   3.297   3.338
  578   1HZ   LYS  69          1HZ       LYS  69 -19.917   1.832   5.263
  579   2HZ   LYS  69          2HZ       LYS  69 -19.706   3.443   5.734
  580   3HZ   LYS  69          3HZ       LYS  69 -18.387   2.385   5.726
  581    H    GLY  70           H        GLY  70 -21.025  -1.717   0.183
  582   1HA   GLY  70          2HA       GLY  70 -20.859  -2.385  -2.021
  583   2HA   GLY  70          1HA       GLY  70 -19.167  -2.754  -1.739
  584    H    SER  71           H        SER  71 -19.672  -4.594   0.463
  585    HA   SER  71           HA       SER  71 -21.373  -6.678  -0.538
  586   1HB   SER  71          2HB       SER  71 -19.464  -6.967  -2.040
  587   2HB   SER  71          1HB       SER  71 -18.370  -7.052  -0.659
  588    HG   SER  71           HG       SER  71 -20.343  -8.830  -0.336
  589    H    ASP  72           H        ASP  72 -21.923  -8.103   1.026
  590    HA   ASP  72           HA       ASP  72 -20.281  -8.339   3.427
  591   1HB   ASP  72          2HB       ASP  72 -23.218  -7.716   3.679
  592   2HB   ASP  72          1HB       ASP  72 -22.004  -7.772   4.947
  593    HA   PRO  73           HA       PRO  73 -21.832 -12.438   2.345
  594   1HB   PRO  73          2HB       PRO  73 -19.605 -13.367   3.989
  595   2HB   PRO  73          1HB       PRO  73 -19.905 -13.638   2.272
  596   1HG   PRO  73          2HG       PRO  73 -17.911 -12.047   3.123
  597   2HG   PRO  73          1HG       PRO  73 -18.823 -11.708   1.637
  598   1HD   PRO  73          2HD       PRO  73 -19.164 -10.500   4.366
  599   2HD   PRO  73          1HD       PRO  73 -19.107  -9.692   2.791
  600    H    ALA  74           H        ALA  74 -20.489 -11.692   5.496
  601    HA   ALA  74           HA       ALA  74 -22.896 -12.742   6.780
  602   1HB   ALA  74          1HB       ALA  74 -21.225 -14.565   6.814
  603   2HB   ALA  74          2HB       ALA  74 -21.593 -13.968   8.431
  604   3HB   ALA  74          3HB       ALA  74 -20.094 -13.489   7.635
  605    H    TYR  75           H        TYR  75 -21.216 -10.236   6.108
  606    HA   TYR  75           HA       TYR  75 -20.480  -9.134   8.652
  607   1HB   TYR  75          2HB       TYR  75 -19.856  -8.476   6.107
  608   2HB   TYR  75          1HB       TYR  75 -21.103  -7.277   6.432
  609    HD1  TYR  75           1HD      TYR  75 -20.813  -5.719   8.383
  610    HD2  TYR  75           2HD      TYR  75 -17.681  -8.249   7.011
  611    HE1  TYR  75           1HE      TYR  75 -19.174  -4.323   9.572
  612    HE2  TYR  75           2HE      TYR  75 -16.034  -6.861   8.196
  613    HH   TYR  75           HH       TYR  75 -15.848  -4.532   9.035
  614    H    GLN  76           H        GLN  76 -21.485  -7.320   9.700
  615    HA   GLN  76           HA       GLN  76 -24.392  -7.531   9.609
  616   1HB   GLN  76          2HB       GLN  76 -22.570  -6.223  11.627
  617   2HB   GLN  76          1HB       GLN  76 -24.323  -6.315  11.760
  618   1HG   GLN  76          2HG       GLN  76 -22.482  -8.679  11.603
  619   2HG   GLN  76          1HG       GLN  76 -23.149  -8.022  13.096
  620   1HE2  GLN  76          1HE2      GLN  76 -23.800  -9.790  10.179
  621   2HE2  GLN  76          2HE2      GLN  76 -25.363 -10.372  10.636
  622    H    LYS  77           H        LYS  77 -25.739  -5.910   9.093
  623    HA   LYS  77           HA       LYS  77 -24.619  -3.640   7.698
  624   1HB   LYS  77          2HB       LYS  77 -26.976  -3.142   7.133
  625   2HB   LYS  77          1HB       LYS  77 -26.507  -4.784   6.711
  626   1HG   LYS  77          2HG       LYS  77 -27.500  -5.305   9.101
  627   2HG   LYS  77          1HG       LYS  77 -28.397  -3.819   8.785
  628   1HD   LYS  77          2HD       LYS  77 -29.207  -4.759   6.675
  629   2HD   LYS  77          1HD       LYS  77 -28.309  -6.243   6.994
  630   1HE   LYS  77          2HE       LYS  77 -30.557  -5.127   8.664
  631   2HE   LYS  77          1HE       LYS  77 -30.660  -6.507   7.573
  632   1HZ   LYS  77          1HZ       LYS  77 -30.399  -7.223   9.858
  633   2HZ   LYS  77          2HZ       LYS  77 -28.965  -6.340  10.007
  634   3HZ   LYS  77          3HZ       LYS  77 -29.039  -7.662   8.954
  635    H    ASP  78           H        ASP  78 -24.842  -1.493   8.232
  636    HA   ASP  78           HA       ASP  78 -25.483  -0.969  11.045
  637   1HB   ASP  78          2HB       ASP  78 -23.948   0.699   9.040
  638   2HB   ASP  78          1HB       ASP  78 -24.220   1.134  10.725
  639    H    ASP  79           H        ASP  79 -26.596  -0.401   7.852
  640    HA   ASP  79           HA       ASP  79 -28.568   1.529   8.881
  641   1HB   ASP  79          2HB       ASP  79 -28.694   2.301   6.435
  642   2HB   ASP  79          1HB       ASP  79 -27.274   2.774   7.361
  643    H    ALA  80           H        ALA  80 -28.284  -0.413   5.900
  644    HA   ALA  80           HA       ALA  80 -30.336  -2.230   6.576
  645   1HB   ALA  80          1HB       ALA  80 -32.134  -1.442   5.148
  646   2HB   ALA  80          2HB       ALA  80 -31.190  -0.017   4.714
  647   3HB   ALA  80          3HB       ALA  80 -31.749  -0.234   6.372
  648    H    VAL  81           H        VAL  81 -28.451  -3.403   5.726
  649    HA   VAL  81           HA       VAL  81 -28.837  -3.965   2.901
  650    HB   VAL  81           HB       VAL  81 -27.084  -2.350   2.740
  651   1HG1  VAL  81          1HG1      VAL  81 -26.370  -2.469   5.114
  652   2HG1  VAL  81          2HG1      VAL  81 -25.030  -2.424   3.972
  653   3HG1  VAL  81          3HG1      VAL  81 -25.487  -3.946   4.735
  654   1HG2  VAL  81          1HG2      VAL  81 -25.893  -5.117   2.563
  655   2HG2  VAL  81          2HG2      VAL  81 -25.282  -3.672   1.757
  656   3HG2  VAL  81          3HG2      VAL  81 -26.860  -4.325   1.318
  657    H    LYS  82           H        LYS  82 -29.616  -5.972   3.418
  658    HA   LYS  82           HA       LYS  82 -27.765  -7.791   4.812
  659   1HB   LYS  82          2HB       LYS  82 -29.751  -9.166   5.326
  660   2HB   LYS  82          1HB       LYS  82 -29.864  -7.545   5.998
  661   1HG   LYS  82          2HG       LYS  82 -31.227  -6.951   3.938
  662   2HG   LYS  82          1HG       LYS  82 -31.320  -8.686   3.636
  663   1HD   LYS  82          2HD       LYS  82 -32.220  -7.306   6.163
  664   2HD   LYS  82          1HD       LYS  82 -33.283  -7.832   4.859
  665   1HE   LYS  82          2HE       LYS  82 -31.527  -9.608   6.552
  666   2HE   LYS  82          1HE       LYS  82 -33.276  -9.443   6.691
  667   1HZ   LYS  82          1HZ       LYS  82 -33.530 -10.359   4.494
  668   2HZ   LYS  82          2HZ       LYS  82 -32.611 -11.421   5.436
  669   3HZ   LYS  82          3HZ       LYS  82 -31.854 -10.443   4.284
  670    H    LYS  83           H        LYS  83 -27.229  -9.739   3.904
  671    HA   LYS  83           HA       LYS  83 -28.362 -10.390   1.277
  672   1HB   LYS  83          2HB       LYS  83 -25.402 -10.349   1.898
  673   2HB   LYS  83          1HB       LYS  83 -26.128 -10.884   0.388
  674   1HG   LYS  83          2HG       LYS  83 -27.029  -8.599   0.067
  675   2HG   LYS  83          1HG       LYS  83 -26.162  -8.094   1.518
  676   1HD   LYS  83          2HD       LYS  83 -24.042  -8.742   0.472
  677   2HD   LYS  83          1HD       LYS  83 -24.914  -9.237  -0.980
  678   1HE   LYS  83          2HE       LYS  83 -25.752  -6.918  -1.212
  679   2HE   LYS  83          1HE       LYS  83 -24.763  -6.454   0.172
  680   1HZ   LYS  83          1HZ       LYS  83 -22.797  -7.165  -1.077
  681   2HZ   LYS  83          2HZ       LYS  83 -23.633  -5.929  -1.872
  682   3HZ   LYS  83          3HZ       LYS  83 -23.769  -7.525  -2.415
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1   0.882  21.715   0.359
    2   2H    MET   1          2HT       MET   1  -0.653  21.757  -0.352
    3   3H    MET   1          3HT       MET   1   0.707  22.208  -1.251
    4    HA   MET   1           HA       MET   1  -0.060  20.008  -1.870
    5   1HB   MET   1          2HB       MET   1   2.581  20.046  -0.390
    6   2HB   MET   1          1HB       MET   1   2.101  18.835  -1.573
    7   1HG   MET   1          2HG       MET   1   2.471  21.772  -2.109
    8   2HG   MET   1          1HG       MET   1   3.600  20.489  -2.538
    9   1HE   MET   1          1HE       MET   1   2.543  22.624  -4.619
   10   2HE   MET   1          2HE       MET   1   2.164  21.613  -6.013
   11   3HE   MET   1          3HE       MET   1   3.631  21.315  -5.079
   12    H    TYR   2           H        TYR   2  -0.657  17.934  -1.321
   13    HA   TYR   2           HA       TYR   2  -1.464  17.563   1.433
   14   1HB   TYR   2          2HB       TYR   2  -1.872  15.853  -1.027
   15   2HB   TYR   2          1HB       TYR   2  -2.538  15.484   0.560
   16    HD1  TYR   2           1HD      TYR   2  -4.241  17.019   1.559
   17    HD2  TYR   2           2HD      TYR   2  -2.914  17.427  -2.464
   18    HE1  TYR   2           1HE      TYR   2  -6.219  18.389   1.051
   19    HE2  TYR   2           2HE      TYR   2  -4.888  18.801  -2.982
   20    HH   TYR   2           HH       TYR   2  -6.908  20.094  -0.587
   21    H    ASP   3           H        ASP   3  -0.964  15.663   2.673
   22    HA   ASP   3           HA       ASP   3   1.797  14.843   2.309
   23   1HB   ASP   3          2HB       ASP   3  -0.162  14.401   4.564
   24   2HB   ASP   3          1HB       ASP   3   1.485  13.775   4.559
   25    H    TRP   4           H        TRP   4   2.294  12.518   2.944
   26    HA   TRP   4           HA       TRP   4   0.609  10.379   2.644
   27   1HB   TRP   4          2HB       TRP   4   0.660  11.626   0.215
   28   2HB   TRP   4          1HB       TRP   4   1.963  10.458   0.028
   29    HD1  TRP   4           HD       TRP   4   0.984   8.483  -1.291
   30    HE1  TRP   4           1HE      TRP   4  -1.139   7.039  -1.123
   31    HE3  TRP   4           3HE      TRP   4  -1.392  10.979   2.474
   32    HZ2  TRP   4           2HZ      TRP   4  -3.516   6.970   0.413
   33    HZ3  TRP   4           3HZ      TRP   4  -3.571  10.171   3.241
   34    HH2  TRP   4           HH       TRP   4  -4.619   8.204   2.232
   35    H    ASN   5           H        ASN   5   1.701   8.377   2.593
   36    HA   ASN   5           HA       ASN   5   3.388   7.065   3.413
   37   1HB   ASN   5          2HB       ASN   5   5.397   7.070   1.855
   38   2HB   ASN   5          1HB       ASN   5   3.827   6.779   1.123
   39   1HD2  ASN   5          1HD2      ASN   5   2.927   8.319  -0.215
   40   2HD2  ASN   5          2HD2      ASN   5   3.841   9.632  -0.866
   41    H    ILE   6           H        ILE   6   3.233   9.427   4.892
   42    HA   ILE   6           HA       ILE   6   5.730  10.721   5.212
   43    HB   ILE   6           HB       ILE   6   3.648  10.386   7.365
   44   1HG1  ILE   6          2HG1      ILE   6   3.718  12.546   5.249
   45   2HG1  ILE   6          1HG1      ILE   6   2.635  11.158   5.203
   46   1HG2  ILE   6          1HG2      ILE   6   5.671  12.550   6.810
   47   2HG2  ILE   6          2HG2      ILE   6   5.747  11.349   8.100
   48   3HG2  ILE   6          3HG2      ILE   6   4.478  12.576   8.109
   49   1HD1  ILE   6          1HD1      ILE   6   2.226  12.224   7.715
   50   2HD1  ILE   6          2HD1      ILE   6   1.186  12.424   6.306
   51   3HD1  ILE   6          3HD1      ILE   6   2.412  13.637   6.678
   52    H    ALA   7           H        ALA   7   4.475   7.695   6.224
   53    HA   ALA   7           HA       ALA   7   6.370   7.364   8.373
   54   1HB   ALA   7          1HB       ALA   7   5.360   5.171   8.682
   55   2HB   ALA   7          2HB       ALA   7   4.446   5.369   7.186
   56   3HB   ALA   7          3HB       ALA   7   4.117   6.417   8.567
   57    H    ALA   8           H        ALA   8   7.206   7.724   5.519
   58    HA   ALA   8           HA       ALA   8   8.763   5.251   5.223
   59   1HB   ALA   8          1HB       ALA   8   8.872   5.688   2.846
   60   2HB   ALA   8          2HB       ALA   8   7.998   7.203   3.060
   61   3HB   ALA   8          3HB       ALA   8   7.191   5.668   3.376
   62    H    LYS   9           H        LYS   9  10.837   5.457   5.747
   63    HA   LYS   9           HA       LYS   9  12.114   8.094   5.429
   64   1HB   LYS   9          2HB       LYS   9  12.367   5.966   7.489
   65   2HB   LYS   9          1HB       LYS   9  13.830   6.842   7.060
   66   1HG   LYS   9          2HG       LYS   9  12.854   7.916   8.945
   67   2HG   LYS   9          1HG       LYS   9  12.622   8.964   7.547
   68   1HD   LYS   9          2HD       LYS   9  10.570   8.969   8.723
   69   2HD   LYS   9          1HD       LYS   9  10.325   7.933   7.316
   70   1HE   LYS   9          2HE       LYS   9  10.724   5.959   8.727
   71   2HE   LYS   9          1HE       LYS   9  10.924   7.011  10.126
   72   1HZ   LYS   9          1HZ       LYS   9   8.642   7.775   9.815
   73   2HZ   LYS   9          2HZ       LYS   9   8.702   6.101  10.052
   74   3HZ   LYS   9          3HZ       LYS   9   8.455   6.728   8.500
   75    H    SER  10           H        SER  10  13.283   4.734   5.674
   76    HA   SER  10           HA       SER  10  15.518   5.131   4.023
   77   1HB   SER  10          2HB       SER  10  14.031   2.567   4.636
   78   2HB   SER  10          1HB       SER  10  15.641   2.661   3.922
   79    HG   SER  10           HG       SER  10  15.771   4.134   6.057
   80    H    GLN  11           H        GLN  11  15.899   3.966   1.941
   81    HA   GLN  11           HA       GLN  11  13.967   4.835   0.026
   82   1HB   GLN  11          2HB       GLN  11  16.384   4.917  -0.409
   83   2HB   GLN  11          1HB       GLN  11  16.457   3.163  -0.341
   84   1HG   GLN  11          2HG       GLN  11  14.987   3.028  -2.289
   85   2HG   GLN  11          1HG       GLN  11  14.922   4.788  -2.357
   86   1HE2  GLN  11          1HE2      GLN  11  15.805   4.869  -4.409
   87   2HE2  GLN  11          2HE2      GLN  11  17.471   4.530  -4.717
   88    H    GLU  12           H        GLU  12  15.162   1.641   1.041
   89    HA   GLU  12           HA       GLU  12  13.537   0.116  -0.655
   90   1HB   GLU  12          2HB       GLU  12  15.573  -0.485   0.943
   91   2HB   GLU  12          1HB       GLU  12  14.271  -0.927   2.038
   92   1HG   GLU  12          2HG       GLU  12  13.354  -2.377   0.219
   93   2HG   GLU  12          1HG       GLU  12  14.826  -2.040  -0.690
   94    H    GLU  13           H        GLU  13  12.841   1.750   2.318
   95    HA   GLU  13           HA       GLU  13  10.455   0.216   2.872
   96   1HB   GLU  13          2HB       GLU  13  11.444   2.787   4.113
   97   2HB   GLU  13          1HB       GLU  13  10.117   1.804   4.713
   98   1HG   GLU  13          2HG       GLU  13  11.717  -0.057   5.043
   99   2HG   GLU  13          1HG       GLU  13  13.019   1.035   4.579
  100    H    ARG  14           H        ARG  14  11.217   3.443   1.610
  101    HA   ARG  14           HA       ARG  14   8.513   4.297   1.479
  102   1HB   ARG  14          2HB       ARG  14   9.353   6.153   0.137
  103   2HB   ARG  14          1HB       ARG  14  10.362   5.891   1.550
  104   1HG   ARG  14          2HG       ARG  14  12.008   4.737   0.167
  105   2HG   ARG  14          1HG       ARG  14  10.992   4.998  -1.254
  106   1HD   ARG  14          2HD       ARG  14  11.203   7.400  -0.993
  107   2HD   ARG  14          1HD       ARG  14  12.145   7.177   0.482
  108    HE   ARG  14           HE       ARG  14  13.437   5.813  -1.584
  109   1HH1  ARG  14          1HH1      ARG  14  12.644   9.083  -0.681
  110   2HH1  ARG  14          2HH1      ARG  14  14.017   9.772  -1.480
  111   1HH2  ARG  14          1HH2      ARG  14  15.248   6.712  -2.638
  112   2HH2  ARG  14          2HH2      ARG  14  15.500   8.425  -2.587
  113    H    ASP  15           H        ASP  15  10.673   2.790  -0.881
  114    HA   ASP  15           HA       ASP  15   8.935   3.142  -3.083
  115   1HB   ASP  15          2HB       ASP  15  11.173   1.168  -2.638
  116   2HB   ASP  15          1HB       ASP  15  10.337   1.384  -4.170
  117    H    LYS  16           H        LYS  16   9.387   0.428  -0.840
  118    HA   LYS  16           HA       LYS  16   7.518  -1.224  -2.257
  119   1HB   LYS  16          2HB       LYS  16   8.768  -1.597   0.461
  120   2HB   LYS  16          1HB       LYS  16   7.861  -2.818  -0.424
  121   1HG   LYS  16          2HG       LYS  16   9.675  -2.244  -2.284
  122   2HG   LYS  16          1HG       LYS  16  10.609  -1.810  -0.853
  123   1HD   LYS  16          2HD       LYS  16  11.071  -4.096  -1.339
  124   2HD   LYS  16          1HD       LYS  16  10.035  -4.059   0.089
  125   1HE   LYS  16          2HE       LYS  16   8.106  -4.620  -1.231
  126   2HE   LYS  16          1HE       LYS  16   9.035  -4.485  -2.723
  127   1HZ   LYS  16          1HZ       LYS  16  10.366  -6.371  -2.033
  128   2HZ   LYS  16          2HZ       LYS  16   8.728  -6.792  -2.050
  129   3HZ   LYS  16          3HZ       LYS  16   9.507  -6.490  -0.580
  130    H    VAL  17           H        VAL  17   7.360   0.825   0.614
  131    HA   VAL  17           HA       VAL  17   4.762  -0.169   1.352
  132    HB   VAL  17           HB       VAL  17   6.219   2.274   2.364
  133   1HG1  VAL  17          1HG1      VAL  17   4.609   2.069   4.267
  134   2HG1  VAL  17          2HG1      VAL  17   3.720   0.879   3.313
  135   3HG1  VAL  17          3HG1      VAL  17   3.867   2.540   2.737
  136   1HG2  VAL  17          1HG2      VAL  17   7.366   0.132   2.814
  137   2HG2  VAL  17          2HG2      VAL  17   5.901  -0.467   3.594
  138   3HG2  VAL  17          3HG2      VAL  17   6.774   0.900   4.287
  139    H    ASN  18           H        ASN  18   5.966   2.788  -0.232
  140    HA   ASN  18           HA       ASN  18   3.511   4.128  -0.396
  141   1HB   ASN  18          2HB       ASN  18   5.839   4.193  -2.318
  142   2HB   ASN  18          1HB       ASN  18   4.490   5.314  -2.357
  143   1HD2  ASN  18          1HD2      ASN  18   5.701   4.200   0.696
  144   2HD2  ASN  18          2HD2      ASN  18   6.514   5.655   1.135
  145    H    VAL  19           H        VAL  19   4.619   1.318  -1.955
  146    HA   VAL  19           HA       VAL  19   2.735   1.546  -4.173
  147    HB   VAL  19           HB       VAL  19   5.222   0.333  -3.959
  148   1HG1  VAL  19          1HG1      VAL  19   4.882  -2.034  -4.328
  149   2HG1  VAL  19          2HG1      VAL  19   3.141  -1.840  -4.135
  150   3HG1  VAL  19          3HG1      VAL  19   4.216  -1.564  -2.764
  151   1HG2  VAL  19          1HG2      VAL  19   3.031   0.041  -5.995
  152   2HG2  VAL  19          2HG2      VAL  19   4.665  -0.573  -6.239
  153   3HG2  VAL  19          3HG2      VAL  19   4.395   1.154  -6.016
  154    H    ASP  20           H        ASP  20   3.202  -0.005  -1.111
  155    HA   ASP  20           HA       ASP  20   1.153  -1.970  -1.366
  156   1HB   ASP  20          2HB       ASP  20   2.975  -2.182   0.285
  157   2HB   ASP  20          1HB       ASP  20   2.386  -0.747   1.120
  158    H    LEU  21           H        LEU  21   1.359   1.302  -0.073
  159    HA   LEU  21           HA       LEU  21  -1.389   1.350   0.752
  160   1HB   LEU  21          2HB       LEU  21  -0.970   3.748   1.191
  161   2HB   LEU  21          1HB       LEU  21   0.180   2.689   1.983
  162    HG   LEU  21           HG       LEU  21   1.599   3.218  -0.205
  163   1HD1  LEU  21          1HD1      LEU  21  -0.010   4.596  -1.305
  164   2HD1  LEU  21          2HD1      LEU  21   1.327   5.615  -0.770
  165   3HD1  LEU  21          3HD1      LEU  21  -0.192   5.609   0.127
  166   1HD2  LEU  21          1HD2      LEU  21   1.348   5.049   2.177
  167   2HD2  LEU  21          2HD2      LEU  21   2.727   4.970   1.081
  168   3HD2  LEU  21          3HD2      LEU  21   2.323   3.582   2.090
  169    H    ALA  22           H        ALA  22   0.490   2.294  -2.042
  170    HA   ALA  22           HA       ALA  22  -1.239   3.967  -3.370
  171   1HB   ALA  22          1HB       ALA  22  -0.278   2.993  -5.475
  172   2HB   ALA  22          2HB       ALA  22   0.551   1.808  -4.467
  173   3HB   ALA  22          3HB       ALA  22   0.916   3.524  -4.294
  174    H    ALA  23           H        ALA  23  -1.175   0.423  -3.477
  175    HA   ALA  23           HA       ALA  23  -3.477   0.137  -5.077
  176   1HB   ALA  23          1HB       ALA  23  -3.403  -2.205  -4.442
  177   2HB   ALA  23          2HB       ALA  23  -2.286  -1.837  -3.128
  178   3HB   ALA  23          3HB       ALA  23  -1.777  -1.630  -4.803
  179    H    SER  24           H        SER  24  -2.910   0.192  -1.602
  180    HA   SER  24           HA       SER  24  -5.369  -0.641  -0.675
  181   1HB   SER  24          2HB       SER  24  -3.718   1.586   0.517
  182   2HB   SER  24          1HB       SER  24  -4.930   0.612   1.347
  183    HG   SER  24           HG       SER  24  -3.024  -0.339   1.825
  184    H    GLY  25           H        GLY  25  -4.479   2.660  -1.647
  185   1HA   GLY  25          2HA       GLY  25  -6.953   3.800  -0.871
  186   2HA   GLY  25          1HA       GLY  25  -5.760   4.542  -1.921
  187    H    VAL  26           H        VAL  26  -5.724   2.717  -4.017
  188    HA   VAL  26           HA       VAL  26  -7.773   3.702  -5.579
  189    HB   VAL  26           HB       VAL  26  -7.194   1.751  -7.123
  190   1HG1  VAL  26          1HG1      VAL  26  -4.919   2.814  -7.590
  191   2HG1  VAL  26          2HG1      VAL  26  -5.282   3.876  -6.226
  192   3HG1  VAL  26          3HG1      VAL  26  -6.333   3.869  -7.644
  193   1HG2  VAL  26          1HG2      VAL  26  -5.012   1.435  -5.104
  194   2HG2  VAL  26          2HG2      VAL  26  -5.086   0.652  -6.683
  195   3HG2  VAL  26          3HG2      VAL  26  -6.284   0.265  -5.450
  196    H    ALA  27           H        ALA  27  -7.619   0.248  -4.499
  197    HA   ALA  27           HA       ALA  27 -10.421  -0.011  -5.254
  198   1HB   ALA  27          1HB       ALA  27 -10.159  -2.279  -5.272
  199   2HB   ALA  27          2HB       ALA  27  -8.934  -2.264  -4.002
  200   3HB   ALA  27          3HB       ALA  27  -8.516  -1.755  -5.639
  201    H    TYR  28           H        TYR  28  -8.507  -0.530  -2.292
  202    HA   TYR  28           HA       TYR  28 -10.461  -1.432  -0.589
  203   1HB   TYR  28          2HB       TYR  28  -7.867  -0.560  -0.295
  204   2HB   TYR  28          1HB       TYR  28  -8.767   0.610   0.660
  205    HD1  TYR  28           1HD      TYR  28  -7.932  -0.027   2.811
  206    HD2  TYR  28           2HD      TYR  28  -9.697  -2.938   0.266
  207    HE1  TYR  28           1HE      TYR  28  -7.994  -1.615   4.675
  208    HE2  TYR  28           2HE      TYR  28  -9.759  -4.540   2.129
  209    HH   TYR  28           HH       TYR  28  -9.236  -3.625   5.355
  210    H    LYS  29           H        LYS  29  -9.911   1.879  -1.656
  211    HA   LYS  29           HA       LYS  29 -11.753   3.030   0.184
  212   1HB   LYS  29          2HB       LYS  29 -10.013   4.423  -0.684
  213   2HB   LYS  29          1HB       LYS  29 -10.464   4.048  -2.340
  214   1HG   LYS  29          2HG       LYS  29 -12.706   5.170  -1.778
  215   2HG   LYS  29          1HG       LYS  29 -11.854   5.842  -0.391
  216   1HD   LYS  29          2HD       LYS  29 -10.177   6.800  -1.911
  217   2HD   LYS  29          1HD       LYS  29 -11.072   6.152  -3.287
  218   1HE   LYS  29          2HE       LYS  29 -13.001   7.510  -2.693
  219   2HE   LYS  29          1HE       LYS  29 -12.150   8.131  -1.280
  220   1HZ   LYS  29          1HZ       LYS  29 -10.524   9.146  -2.746
  221   2HZ   LYS  29          2HZ       LYS  29 -12.079   9.692  -3.122
  222   3HZ   LYS  29          3HZ       LYS  29 -11.328   8.537  -4.105
  223    H    GLU  30           H        GLU  30 -11.960   2.635  -3.359
  224    HA   GLU  30           HA       GLU  30 -14.660   3.458  -3.486
  225   1HB   GLU  30          2HB       GLU  30 -13.011   1.880  -5.462
  226   2HB   GLU  30          1HB       GLU  30 -14.587   2.577  -5.806
  227   1HG   GLU  30          2HG       GLU  30 -12.128   4.126  -5.027
  228   2HG   GLU  30          1HG       GLU  30 -12.752   3.944  -6.665
  229    H    ARG  31           H        ARG  31 -13.671   0.832  -1.936
  230    HA   ARG  31           HA       ARG  31 -16.007  -0.740  -2.798
  231   1HB   ARG  31          2HB       ARG  31 -13.226  -1.582  -2.187
  232   2HB   ARG  31          1HB       ARG  31 -14.516  -2.644  -1.645
  233   1HG   ARG  31          2HG       ARG  31 -13.831  -3.421  -3.767
  234   2HG   ARG  31          1HG       ARG  31 -15.387  -2.625  -3.999
  235   1HD   ARG  31          2HD       ARG  31 -14.187  -0.591  -4.739
  236   2HD   ARG  31          1HD       ARG  31 -12.666  -1.470  -4.596
  237    HE   ARG  31           HE       ARG  31 -14.332  -2.962  -6.245
  238   1HH1  ARG  31          1HH1      ARG  31 -12.769   0.152  -6.266
  239   2HH1  ARG  31          2HH1      ARG  31 -12.631   0.214  -7.991
  240   1HH2  ARG  31          1HH2      ARG  31 -14.156  -2.888  -8.515
  241   2HH2  ARG  31          2HH2      ARG  31 -13.420  -1.515  -9.270
  242    H    LEU  32           H        LEU  32 -13.793  -0.579  -0.008
  243    HA   LEU  32           HA       LEU  32 -16.008  -1.161   1.772
  244   1HB   LEU  32          2HB       LEU  32 -13.148  -0.730   2.569
  245   2HB   LEU  32          1HB       LEU  32 -14.379  -1.645   3.411
  246    HG   LEU  32           HG       LEU  32 -13.095  -3.331   2.545
  247   1HD1  LEU  32          1HD1      LEU  32 -14.199  -4.355   0.713
  248   2HD1  LEU  32          2HD1      LEU  32 -14.885  -2.802   0.214
  249   3HD1  LEU  32          3HD1      LEU  32 -15.402  -3.548   1.727
  250   1HD2  LEU  32          1HD2      LEU  32 -11.692  -3.247   0.782
  251   2HD2  LEU  32          2HD2      LEU  32 -11.787  -1.522   1.171
  252   3HD2  LEU  32          3HD2      LEU  32 -12.744  -2.186  -0.153
  253    H    ASN  33           H        ASN  33 -14.048   0.320   3.777
  254    HA   ASN  33           HA       ASN  33 -15.188   2.990   3.371
  255   1HB   ASN  33          2HB       ASN  33 -16.434   1.811   5.143
  256   2HB   ASN  33          1HB       ASN  33 -14.928   1.526   6.009
  257   1HD2  ASN  33          1HD2      ASN  33 -13.933   3.215   7.083
  258   2HD2  ASN  33          2HD2      ASN  33 -14.734   4.713   7.398
  259    H    ILE  34           H        ILE  34 -13.183   3.505   2.407
  260    HA   ILE  34           HA       ILE  34 -11.076   4.005   4.399
  261    HB   ILE  34           HB       ILE  34 -10.622   2.880   1.640
  262   1HG1  ILE  34          2HG1      ILE  34  -9.224   1.270   3.125
  263   2HG1  ILE  34          1HG1      ILE  34 -10.200   1.901   4.445
  264   1HG2  ILE  34          1HG2      ILE  34  -9.030   4.658   1.990
  265   2HG2  ILE  34          2HG2      ILE  34  -8.216   3.099   2.121
  266   3HG2  ILE  34          3HG2      ILE  34  -8.614   4.012   3.577
  267   1HD1  ILE  34          1HD1      ILE  34 -10.963   0.140   2.195
  268   2HD1  ILE  34          2HD1      ILE  34 -12.163   1.293   2.775
  269   3HD1  ILE  34          3HD1      ILE  34 -11.468   0.112   3.885
  270    HA   PRO  35           HA       PRO  35 -11.870   7.977   2.409
  271   1HB   PRO  35          2HB       PRO  35 -11.175   9.533   4.449
  272   2HB   PRO  35          1HB       PRO  35 -12.655   8.563   4.528
  273   1HG   PRO  35          2HG       PRO  35  -9.941   7.946   5.664
  274   2HG   PRO  35          1HG       PRO  35 -11.521   7.884   6.478
  275   1HD   PRO  35          2HD       PRO  35 -10.321   5.685   5.430
  276   2HD   PRO  35          1HD       PRO  35 -12.085   5.874   5.493
  277    H    VAL  36           H        VAL  36 -10.122   7.637   0.888
  278    HA   VAL  36           HA       VAL  36  -7.794   9.261   1.519
  279    HB   VAL  36           HB       VAL  36  -6.194   7.614   0.666
  280   1HG1  VAL  36          1HG1      VAL  36  -6.308   6.018   2.596
  281   2HG1  VAL  36          2HG1      VAL  36  -7.868   6.730   3.015
  282   3HG1  VAL  36          3HG1      VAL  36  -6.409   7.721   3.041
  283   1HG2  VAL  36          1HG2      VAL  36  -7.631   6.327  -0.769
  284   2HG2  VAL  36          2HG2      VAL  36  -8.579   5.776   0.614
  285   3HG2  VAL  36          3HG2      VAL  36  -6.903   5.257   0.429
  286    H    ILE  37           H        ILE  37  -6.475   9.730  -0.433
  287    HA   ILE  37           HA       ILE  37  -8.249  10.113  -2.719
  288    HB   ILE  37           HB       ILE  37  -5.450  11.176  -2.339
  289   1HG1  ILE  37          2HG1      ILE  37  -6.860  11.964  -0.513
  290   2HG1  ILE  37          1HG1      ILE  37  -6.525  13.282  -1.629
  291   1HG2  ILE  37          1HG2      ILE  37  -7.682  12.064  -4.160
  292   2HG2  ILE  37          2HG2      ILE  37  -6.246  11.166  -4.647
  293   3HG2  ILE  37          3HG2      ILE  37  -6.090  12.810  -4.029
  294   1HD1  ILE  37          1HD1      ILE  37  -9.076  11.702  -1.422
  295   2HD1  ILE  37          2HD1      ILE  37  -8.748  12.933  -2.642
  296   3HD1  ILE  37          3HD1      ILE  37  -8.817  13.378  -0.937
  297    H    ALA  38           H        ALA  38  -8.168   8.856  -4.477
  298    HA   ALA  38           HA       ALA  38  -6.201   6.775  -4.699
  299   1HB   ALA  38          1HB       ALA  38  -7.439   6.076  -6.672
  300   2HB   ALA  38          2HB       ALA  38  -8.366   7.578  -6.643
  301   3HB   ALA  38          3HB       ALA  38  -8.541   6.408  -5.335
  302    H    GLU  39           H        GLU  39  -7.108   9.502  -6.826
  303    HA   GLU  39           HA       GLU  39  -5.086   9.244  -8.690
  304   1HB   GLU  39          2HB       GLU  39  -5.364  11.692  -9.093
  305   2HB   GLU  39          1HB       GLU  39  -6.869  10.785  -9.080
  306   1HG   GLU  39          2HG       GLU  39  -7.310  11.540  -6.803
  307   2HG   GLU  39          1HG       GLU  39  -5.792  12.436  -6.805
  308    H    GLN  40           H        GLN  40  -4.819  10.054  -5.433
  309    HA   GLN  40           HA       GLN  40  -2.499  11.712  -5.514
  310   1HB   GLN  40          2HB       GLN  40  -4.219  10.657  -3.518
  311   2HB   GLN  40          1HB       GLN  40  -2.582  10.155  -3.117
  312   1HG   GLN  40          2HG       GLN  40  -1.876  12.535  -3.323
  313   2HG   GLN  40          1HG       GLN  40  -3.573  12.967  -3.531
  314   1HE2  GLN  40          1HE2      GLN  40  -3.623  14.212  -1.677
  315   2HE2  GLN  40          2HE2      GLN  40  -3.574  13.528  -0.092
  316    H    VAL  41           H        VAL  41  -2.940   8.301  -4.623
  317    HA   VAL  41           HA       VAL  41  -0.206   7.647  -4.540
  318    HB   VAL  41           HB       VAL  41  -0.843   5.418  -4.312
  319   1HG1  VAL  41          1HG1      VAL  41  -3.211   7.047  -3.404
  320   2HG1  VAL  41          2HG1      VAL  41  -1.726   6.758  -2.497
  321   3HG1  VAL  41          3HG1      VAL  41  -2.819   5.421  -2.849
  322   1HG2  VAL  41          1HG2      VAL  41  -3.110   4.599  -5.060
  323   2HG2  VAL  41          2HG2      VAL  41  -1.978   5.013  -6.346
  324   3HG2  VAL  41          3HG2      VAL  41  -3.278   6.124  -5.926
  325    H    ALA  42           H        ALA  42  -2.338   8.182  -7.116
  326    HA   ALA  42           HA       ALA  42  -1.088   6.521  -9.053
  327   1HB   ALA  42          1HB       ALA  42  -2.994   8.827  -9.338
  328   2HB   ALA  42          2HB       ALA  42  -3.392   7.108  -9.298
  329   3HB   ALA  42          3HB       ALA  42  -2.488   7.772 -10.660
  330    H    ARG  43           H        ARG  43  -0.218   9.505  -7.672
  331    HA   ARG  43           HA       ARG  43   1.041  10.658  -9.957
  332   1HB   ARG  43          2HB       ARG  43   1.257  12.461  -8.642
  333   2HB   ARG  43          1HB       ARG  43   0.317  11.570  -7.457
  334   1HG   ARG  43          2HG       ARG  43   3.280  11.259  -7.521
  335   2HG   ARG  43          1HG       ARG  43   2.566  12.689  -6.785
  336   1HD   ARG  43          2HD       ARG  43   1.676   9.922  -6.041
  337   2HD   ARG  43          1HD       ARG  43   3.083  10.671  -5.285
  338    HE   ARG  43           HE       ARG  43   0.558  12.139  -5.243
  339   1HH1  ARG  43          1HH1      ARG  43   2.947  10.253  -3.546
  340   2HH1  ARG  43          2HH1      ARG  43   2.384  10.716  -1.975
  341   1HH2  ARG  43          1HH2      ARG  43  -0.190  12.753  -3.182
  342   2HH2  ARG  43          2HH2      ARG  43   0.598  12.135  -1.768
  343    H    GLU  44           H        GLU  44   1.814   7.995  -8.138
  344    HA   GLU  44           HA       GLU  44   4.670   8.291  -8.778
  345   1HB   GLU  44          2HB       GLU  44   4.847   6.489  -6.827
  346   2HB   GLU  44          1HB       GLU  44   4.908   8.219  -6.526
  347   1HG   GLU  44          2HG       GLU  44   2.637   8.259  -5.836
  348   2HG   GLU  44          1HG       GLU  44   2.385   6.606  -6.382
  349    H    GLN  45           H        GLN  45   2.561   5.609  -7.789
  350    HA   GLN  45           HA       GLN  45   2.377   3.468  -8.577
  351   1HB   GLN  45          2HB       GLN  45   1.849   5.293 -10.704
  352   2HB   GLN  45          1HB       GLN  45   2.696   3.908 -11.380
  353   1HG   GLN  45          2HG       GLN  45   0.222   3.741  -9.677
  354   2HG   GLN  45          1HG       GLN  45   0.241   3.693 -11.438
  355   1HE2  GLN  45          1HE2      GLN  45   2.716   2.158 -11.535
  356   2HE2  GLN  45          2HE2      GLN  45   2.296   0.542 -11.087
  357    HA   PRO  46           HA       PRO  46   7.123   3.418  -8.928
  358   1HB   PRO  46          2HB       PRO  46   6.420   1.170  -7.084
  359   2HB   PRO  46          1HB       PRO  46   7.800   2.275  -7.035
  360   1HG   PRO  46          2HG       PRO  46   5.745   2.634  -5.395
  361   2HG   PRO  46          1HG       PRO  46   6.535   4.022  -6.166
  362   1HD   PRO  46          2HD       PRO  46   3.911   2.754  -6.782
  363   2HD   PRO  46          1HD       PRO  46   4.400   4.456  -6.901
  364    H    GLU  47           H        GLU  47   8.093   2.303 -10.455
  365    HA   GLU  47           HA       GLU  47   6.710   0.164 -11.820
  366   1HB   GLU  47          2HB       GLU  47   7.852   1.799 -13.171
  367   2HB   GLU  47          1HB       GLU  47   9.365   1.510 -12.324
  368   1HG   GLU  47          2HG       GLU  47   9.400   0.454 -14.494
  369   2HG   GLU  47          1HG       GLU  47   9.434  -0.762 -13.216
  370    H    ASN  48           H        ASN  48   9.837   0.524 -10.168
  371    HA   ASN  48           HA       ASN  48  10.629  -2.164 -10.386
  372   1HB   ASN  48          2HB       ASN  48  11.394  -0.152  -8.259
  373   2HB   ASN  48          1HB       ASN  48  12.266  -1.635  -8.640
  374   1HD2  ASN  48          1HD2      ASN  48  13.415  -1.776 -10.581
  375   2HD2  ASN  48          2HD2      ASN  48  13.867  -0.365 -11.472
  376    H    LEU  49           H        LEU  49   8.115  -0.848  -8.653
  377    HA   LEU  49           HA       LEU  49   8.005  -3.199  -6.889
  378   1HB   LEU  49          2HB       LEU  49   7.382  -0.338  -6.191
  379   2HB   LEU  49          1HB       LEU  49   6.733  -1.678  -5.268
  380    HG   LEU  49           HG       LEU  49   8.611  -0.932  -4.065
  381   1HD1  LEU  49          1HD1      LEU  49   9.541  -3.284  -5.701
  382   2HD1  LEU  49          2HD1      LEU  49   8.491  -3.363  -4.288
  383   3HD1  LEU  49          3HD1      LEU  49  10.154  -2.802  -4.119
  384   1HD2  LEU  49          1HD2      LEU  49  10.752  -0.445  -4.976
  385   2HD2  LEU  49          2HD2      LEU  49   9.560   0.392  -5.969
  386   3HD2  LEU  49          3HD2      LEU  49  10.304  -1.098  -6.548
  387    H    ARG  50           H        ARG  50   6.782  -2.121  -9.534
  388    HA   ARG  50           HA       ARG  50   4.030  -1.769  -9.162
  389   1HB   ARG  50          2HB       ARG  50   5.320  -1.321 -11.268
  390   2HB   ARG  50          1HB       ARG  50   5.376  -3.057 -11.541
  391   1HG   ARG  50          2HG       ARG  50   2.977  -3.155 -11.723
  392   2HG   ARG  50          1HG       ARG  50   2.847  -1.442 -11.312
  393   1HD   ARG  50          2HD       ARG  50   4.222  -0.938 -13.336
  394   2HD   ARG  50          1HD       ARG  50   4.106  -2.643 -13.772
  395    HE   ARG  50           HE       ARG  50   1.520  -1.901 -13.446
  396   1HH1  ARG  50          1HH1      ARG  50   4.167  -0.631 -15.326
  397   2HH1  ARG  50          2HH1      ARG  50   3.146  -0.006 -16.577
  398   1HH2  ARG  50          1HH2      ARG  50   0.171  -1.083 -15.090
  399   2HH2  ARG  50          2HH2      ARG  50   0.874  -0.262 -16.444
  400    H    THR  51           H        THR  51   6.048  -4.554  -9.071
  401    HA   THR  51           HA       THR  51   4.026  -6.517  -9.512
  402    HB   THR  51           HB       THR  51   6.703  -6.772  -8.123
  403    HG1  THR  51           1HG      THR  51   6.336  -7.826 -10.654
  404   1HG2  THR  51          1HG2      THR  51   6.488  -9.167  -8.601
  405   2HG2  THR  51          2HG2      THR  51   4.871  -8.891  -9.249
  406   3HG2  THR  51          3HG2      THR  51   5.198  -8.603  -7.541
  407    H    TYR  52           H        TYR  52   5.601  -5.170  -6.636
  408    HA   TYR  52           HA       TYR  52   4.299  -6.669  -4.688
  409   1HB   TYR  52          2HB       TYR  52   6.283  -5.045  -4.481
  410   2HB   TYR  52          1HB       TYR  52   5.077  -3.774  -4.350
  411    HD1  TYR  52           1HD      TYR  52   5.200  -3.021  -2.148
  412    HD2  TYR  52           2HD      TYR  52   5.104  -7.205  -2.905
  413    HE1  TYR  52           1HE      TYR  52   5.045  -3.445   0.260
  414    HE2  TYR  52           2HE      TYR  52   4.943  -7.642  -0.497
  415    HH   TYR  52           HH       TYR  52   4.269  -5.205   1.780
  416    H    PHE  53           H        PHE  53   3.461  -3.441  -5.956
  417    HA   PHE  53           HA       PHE  53   1.138  -3.007  -4.538
  418   1HB   PHE  53          2HB       PHE  53   1.691  -1.147  -5.692
  419   2HB   PHE  53          1HB       PHE  53   2.265  -2.034  -7.094
  420    HD1  PHE  53           1HD      PHE  53  -0.288   0.046  -5.787
  421    HD2  PHE  53           2HD      PHE  53   0.425  -3.058  -8.615
  422    HE1  PHE  53           1HE      PHE  53  -2.349   0.658  -6.976
  423    HE2  PHE  53           2HE      PHE  53  -1.643  -2.448  -9.814
  424    HZ   PHE  53           HZ       PHE  53  -2.950  -0.462  -9.053
  425    H    MET  54           H        MET  54   1.658  -5.127  -7.269
  426    HA   MET  54           HA       MET  54  -1.139  -5.572  -7.779
  427   1HB   MET  54          2HB       MET  54   1.338  -7.076  -8.649
  428   2HB   MET  54          1HB       MET  54  -0.289  -7.472  -9.184
  429   1HG   MET  54          2HG       MET  54   0.950  -4.773  -9.594
  430   2HG   MET  54          1HG       MET  54   1.111  -6.086 -10.755
  431   1HE   MET  54          1HE       MET  54  -2.576  -6.674 -11.881
  432   2HE   MET  54          2HE       MET  54  -1.700  -7.522 -10.605
  433   3HE   MET  54          3HE       MET  54  -0.886  -7.119 -12.117
  434    H    GLU  55           H        GLU  55   1.462  -7.235  -6.083
  435    HA   GLU  55           HA       GLU  55   0.135  -9.578  -5.363
  436   1HB   GLU  55          2HB       GLU  55   2.188  -8.018  -3.776
  437   2HB   GLU  55          1HB       GLU  55   1.737  -9.688  -3.472
  438   1HG   GLU  55          2HG       GLU  55   2.501 -10.205  -5.810
  439   2HG   GLU  55          1HG       GLU  55   3.159  -8.572  -5.867
  440    H    ARG  56           H        ARG  56   0.315  -6.459  -3.716
  441    HA   ARG  56           HA       ARG  56  -1.491  -7.227  -1.640
  442   1HB   ARG  56          2HB       ARG  56   0.255  -5.085  -2.096
  443   2HB   ARG  56          1HB       ARG  56  -1.350  -4.363  -2.104
  444   1HG   ARG  56          2HG       ARG  56  -0.475  -4.264   0.116
  445   2HG   ARG  56          1HG       ARG  56  -1.788  -5.445   0.086
  446   1HD   ARG  56          2HD       ARG  56  -0.157  -7.258  -0.064
  447   2HD   ARG  56          1HD       ARG  56   1.158  -6.083  -0.049
  448    HE   ARG  56           HE       ARG  56  -0.432  -5.689   2.225
  449   1HH1  ARG  56          1HH1      ARG  56   1.780  -8.025   0.888
  450   2HH1  ARG  56          2HH1      ARG  56   2.299  -8.609   2.434
  451   1HH2  ARG  56          1HH2      ARG  56   0.244  -6.451   4.261
  452   2HH2  ARG  56          2HH2      ARG  56   1.425  -7.716   4.350
  453    H    LEU  57           H        LEU  57  -1.701  -5.629  -4.747
  454    HA   LEU  57           HA       LEU  57  -4.257  -4.608  -4.678
  455   1HB   LEU  57          2HB       LEU  57  -2.876  -4.136  -6.548
  456   2HB   LEU  57          1HB       LEU  57  -2.712  -5.836  -6.942
  457    HG   LEU  57           HG       LEU  57  -5.170  -5.865  -7.463
  458   1HD1  LEU  57          1HD1      LEU  57  -6.169  -3.630  -7.978
  459   2HD1  LEU  57          2HD1      LEU  57  -4.820  -2.896  -7.111
  460   3HD1  LEU  57          3HD1      LEU  57  -5.940  -3.959  -6.262
  461   1HD2  LEU  57          1HD2      LEU  57  -4.902  -4.774  -9.646
  462   2HD2  LEU  57          2HD2      LEU  57  -3.504  -5.764  -9.226
  463   3HD2  LEU  57          3HD2      LEU  57  -3.420  -4.009  -9.072
  464    H    ARG  58           H        ARG  58  -3.248  -7.910  -5.436
  465    HA   ARG  58           HA       ARG  58  -5.938  -8.784  -5.943
  466   1HB   ARG  58          2HB       ARG  58  -4.913 -11.032  -6.099
  467   2HB   ARG  58          1HB       ARG  58  -4.121  -9.841  -7.114
  468   1HG   ARG  58          2HG       ARG  58  -2.312  -9.630  -5.522
  469   2HG   ARG  58          1HG       ARG  58  -3.108 -10.778  -4.446
  470   1HD   ARG  58          2HD       ARG  58  -2.957 -12.494  -6.210
  471   2HD   ARG  58          1HD       ARG  58  -2.096 -11.341  -7.231
  472    HE   ARG  58           HE       ARG  58  -0.686 -11.481  -4.859
  473   1HH1  ARG  58          1HH1      ARG  58  -1.611 -13.665  -7.416
  474   2HH1  ARG  58          2HH1      ARG  58  -0.223 -14.683  -7.219
  475   1HH2  ARG  58          1HH2      ARG  58   1.140 -12.816  -4.598
  476   2HH2  ARG  58          2HH2      ARG  58   1.340 -14.201  -5.620
  477    H    HIS  59           H        HIS  59  -3.662  -8.917  -3.293
  478    HA   HIS  59           HA       HIS  59  -5.076 -10.743  -1.672
  479   1HB   HIS  59          2HB       HIS  59  -2.692 -10.137  -1.357
  480   2HB   HIS  59          1HB       HIS  59  -3.196  -8.551  -0.784
  481    HD1  HIS  59           1HD      HIS  59  -3.085 -12.155   0.219
  482    HD2  HIS  59           2HD      HIS  59  -4.158  -8.480   1.835
  483    HE1  HIS  59           1HE      HIS  59  -3.383 -12.564   2.684
  484    HE2  HIS  59           2HE      HIS  59  -4.107 -10.343   3.628
  485    H    TYR  60           H        TYR  60  -4.973  -7.168  -1.474
  486    HA   TYR  60           HA       TYR  60  -6.947  -7.178   0.573
  487   1HB   TYR  60          2HB       TYR  60  -6.748  -4.894   0.730
  488   2HB   TYR  60          1HB       TYR  60  -5.153  -5.382   0.177
  489    HD1  TYR  60           1HD      TYR  60  -5.916  -5.860  -2.716
  490    HD2  TYR  60           2HD      TYR  60  -6.738  -2.687  -0.029
  491    HE1  TYR  60           1HE      TYR  60  -6.124  -4.321  -4.604
  492    HE2  TYR  60           2HE      TYR  60  -6.939  -1.150  -1.889
  493    HH   TYR  60           HH       TYR  60  -6.352  -0.888  -4.156
  494    H    ARG  61           H        ARG  61  -7.010  -7.228  -2.855
  495    HA   ARG  61           HA       ARG  61  -9.651  -6.303  -3.212
  496   1HB   ARG  61          2HB       ARG  61  -8.161  -6.614  -5.121
  497   2HB   ARG  61          1HB       ARG  61  -8.072  -8.341  -4.805
  498   1HG   ARG  61          2HG       ARG  61 -10.453  -8.556  -5.310
  499   2HG   ARG  61          1HG       ARG  61 -10.540  -6.822  -5.628
  500   1HD   ARG  61          2HD       ARG  61  -8.928  -7.077  -7.449
  501   2HD   ARG  61          1HD       ARG  61  -8.836  -8.807  -7.128
  502    HE   ARG  61           HE       ARG  61 -11.496  -8.297  -7.557
  503   1HH1  ARG  61          1HH1      ARG  61  -8.548  -7.849  -9.362
  504   2HH1  ARG  61          2HH1      ARG  61  -9.312  -8.042 -10.904
  505   1HH2  ARG  61          1HH2      ARG  61 -12.509  -8.551  -9.584
  506   2HH2  ARG  61          2HH2      ARG  61 -11.563  -8.434 -11.031
  507    H    GLN  62           H        GLN  62  -8.245  -9.311  -2.225
  508    HA   GLN  62           HA       GLN  62 -10.435 -11.031  -2.453
  509   1HB   GLN  62          2HB       GLN  62  -8.237 -11.084  -0.393
  510   2HB   GLN  62          1HB       GLN  62  -9.361 -12.397  -0.706
  511   1HG   GLN  62          2HG       GLN  62  -7.095 -11.408  -2.359
  512   2HG   GLN  62          1HG       GLN  62  -7.516 -13.042  -1.876
  513   1HE2  GLN  62          1HE2      GLN  62  -6.895 -11.857  -4.506
  514   2HE2  GLN  62          2HE2      GLN  62  -8.224 -12.280  -5.521
  515    H    LEU  63           H        LEU  63  -9.392  -9.056   0.354
  516    HA   LEU  63           HA       LEU  63 -11.875  -9.760   1.652
  517   1HB   LEU  63          2HB       LEU  63 -11.018  -8.355   3.558
  518   2HB   LEU  63          1HB       LEU  63 -10.229  -9.870   3.217
  519    HG   LEU  63           HG       LEU  63  -8.750  -7.908   3.836
  520   1HD1  LEU  63          1HD1      LEU  63  -7.008  -8.558   2.271
  521   2HD1  LEU  63          2HD1      LEU  63  -8.206  -9.328   1.234
  522   3HD1  LEU  63          3HD1      LEU  63  -7.890  -9.974   2.843
  523   1HD2  LEU  63          1HD2      LEU  63  -9.702  -6.170   2.617
  524   2HD2  LEU  63          2HD2      LEU  63  -9.709  -7.117   1.133
  525   3HD2  LEU  63          3HD2      LEU  63  -8.180  -6.521   1.792
  526    H    SER  64           H        SER  64 -10.811  -7.478  -0.414
  527    HA   SER  64           HA       SER  64 -12.396  -5.256   0.411
  528   1HB   SER  64          2HB       SER  64 -11.181  -6.065  -2.228
  529   2HB   SER  64          1HB       SER  64 -12.307  -4.710  -2.146
  530    HG   SER  64           HG       SER  64 -10.432  -3.737  -1.773
  531    H    LEU  65           H        LEU  65 -12.952  -8.267  -0.961
  532    HA   LEU  65           HA       LEU  65 -15.607  -7.677  -1.985
  533   1HB   LEU  65          2HB       LEU  65 -14.209 -10.338  -1.659
  534   2HB   LEU  65          1HB       LEU  65 -15.706 -10.063  -2.530
  535    HG   LEU  65           HG       LEU  65 -13.016  -8.937  -3.303
  536   1HD1  LEU  65          1HD1      LEU  65 -14.618 -11.160  -4.554
  537   2HD1  LEU  65          2HD1      LEU  65 -13.159 -11.369  -3.585
  538   3HD1  LEU  65          3HD1      LEU  65 -13.077 -10.525  -5.130
  539   1HD2  LEU  65          1HD2      LEU  65 -14.131  -8.271  -5.366
  540   2HD2  LEU  65          2HD2      LEU  65 -14.874  -7.499  -3.964
  541   3HD2  LEU  65          3HD2      LEU  65 -15.666  -8.872  -4.736
  542    H    GLN  66           H        GLN  66 -14.133  -9.627   0.606
  543    HA   GLN  66           HA       GLN  66 -16.617 -10.288   1.801
  544   1HB   GLN  66          2HB       GLN  66 -15.415 -11.502   3.326
  545   2HB   GLN  66          1HB       GLN  66 -14.263 -11.406   2.006
  546   1HG   GLN  66          2HG       GLN  66 -12.950 -10.963   3.839
  547   2HG   GLN  66          1HG       GLN  66 -13.352  -9.341   3.277
  548   1HE2  GLN  66          1HE2      GLN  66 -14.177  -7.978   4.691
  549   2HE2  GLN  66          2HE2      GLN  66 -14.866  -8.385   6.223
  550    H    LEU  67           H        LEU  67 -14.386  -7.612   2.349
  551    HA   LEU  67           HA       LEU  67 -15.321  -6.742   4.822
  552   1HB   LEU  67          2HB       LEU  67 -13.731  -5.612   2.668
  553   2HB   LEU  67          1HB       LEU  67 -14.710  -4.398   3.467
  554    HG   LEU  67           HG       LEU  67 -13.742  -5.384   5.666
  555   1HD1  LEU  67          1HD1      LEU  67 -11.540  -6.350   5.466
  556   2HD1  LEU  67          2HD1      LEU  67 -11.649  -6.293   3.706
  557   3HD1  LEU  67          3HD1      LEU  67 -12.724  -7.349   4.625
  558   1HD2  LEU  67          1HD2      LEU  67 -13.254  -3.141   4.768
  559   2HD2  LEU  67          2HD2      LEU  67 -11.937  -3.828   3.815
  560   3HD2  LEU  67          3HD2      LEU  67 -11.866  -3.866   5.578
  561    HA   PRO  68           HA       PRO  68 -19.278  -4.931   4.389
  562   1HB   PRO  68          2HB       PRO  68 -19.118  -2.423   5.360
  563   2HB   PRO  68          1HB       PRO  68 -18.948  -3.855   6.393
  564   1HG   PRO  68          2HG       PRO  68 -16.780  -2.242   5.074
  565   2HG   PRO  68          1HG       PRO  68 -16.953  -2.642   6.803
  566   1HD   PRO  68          2HD       PRO  68 -15.372  -4.101   5.283
  567   2HD   PRO  68          1HD       PRO  68 -16.461  -4.915   6.425
  568    H    LYS  69           H        LYS  69 -20.280  -2.510   3.849
  569    HA   LYS  69           HA       LYS  69 -20.957  -1.202   2.121
  570   1HB   LYS  69          2HB       LYS  69 -17.998  -1.146   1.508
  571   2HB   LYS  69          1HB       LYS  69 -19.195  -0.031   0.863
  572   1HG   LYS  69          2HG       LYS  69 -18.485  -0.343   3.774
  573   2HG   LYS  69          1HG       LYS  69 -17.928   0.948   2.708
  574   1HD   LYS  69          2HD       LYS  69 -20.307   1.586   2.340
  575   2HD   LYS  69          1HD       LYS  69 -20.772   0.381   3.541
  576   1HE   LYS  69          2HE       LYS  69 -19.413   1.550   5.221
  577   2HE   LYS  69          1HE       LYS  69 -18.982   2.763   4.016
  578   1HZ   LYS  69          1HZ       LYS  69 -21.347   3.318   3.824
  579   2HZ   LYS  69          2HZ       LYS  69 -20.770   3.559   5.396
  580   3HZ   LYS  69          3HZ       LYS  69 -21.713   2.200   5.041
  581    H    GLY  70           H        GLY  70 -18.583  -1.726  -0.191
  582   1HA   GLY  70          2HA       GLY  70 -20.396  -3.050  -1.945
  583   2HA   GLY  70          1HA       GLY  70 -18.701  -2.710  -2.271
  584    H    SER  71           H        SER  71 -20.985  -5.034  -1.046
  585    HA   SER  71           HA       SER  71 -19.133  -7.177  -1.551
  586   1HB   SER  71          2HB       SER  71 -19.212  -8.114   0.726
  587   2HB   SER  71          1HB       SER  71 -18.444  -6.526   0.707
  588    HG   SER  71           HG       SER  71 -19.847  -6.186   2.257
  589    H    ASP  72           H        ASP  72 -20.354  -9.230  -0.220
  590    HA   ASP  72           HA       ASP  72 -22.597  -9.756  -1.833
  591   1HB   ASP  72          2HB       ASP  72 -21.731 -11.143   0.713
  592   2HB   ASP  72          1HB       ASP  72 -22.857 -11.790  -0.475
  593    HA   PRO  73           HA       PRO  73 -25.924  -7.700   0.247
  594   1HB   PRO  73          2HB       PRO  73 -27.530 -10.088  -0.452
  595   2HB   PRO  73          1HB       PRO  73 -27.800  -8.394  -0.833
  596   1HG   PRO  73          2HG       PRO  73 -26.969 -10.131  -2.685
  597   2HG   PRO  73          1HG       PRO  73 -26.454  -8.434  -2.681
  598   1HD   PRO  73          2HD       PRO  73 -24.950 -10.872  -1.892
  599   2HD   PRO  73          1HD       PRO  73 -24.378  -9.358  -2.612
  600    H    ALA  74           H        ALA  74 -25.514 -11.178   0.829
  601    HA   ALA  74           HA       ALA  74 -26.934 -11.045   3.337
  602   1HB   ALA  74          1HB       ALA  74 -25.365 -13.335   2.165
  603   2HB   ALA  74          2HB       ALA  74 -27.081 -13.033   1.901
  604   3HB   ALA  74          3HB       ALA  74 -26.494 -13.419   3.518
  605    H    TYR  75           H        TYR  75 -24.100  -9.829   2.644
  606    HA   TYR  75           HA       TYR  75 -22.732 -10.810   5.052
  607   1HB   TYR  75          2HB       TYR  75 -21.713 -10.486   2.579
  608   2HB   TYR  75          1HB       TYR  75 -21.355  -8.917   3.278
  609    HD1  TYR  75           1HD      TYR  75 -19.752  -8.683   5.084
  610    HD2  TYR  75           2HD      TYR  75 -20.671 -12.511   3.468
  611    HE1  TYR  75           1HE      TYR  75 -17.781  -9.629   6.222
  612    HE2  TYR  75           2HE      TYR  75 -18.711 -13.467   4.602
  613    HH   TYR  75           HH       TYR  75 -16.564 -12.723   5.509
  614    H    GLN  76           H        GLN  76 -24.977  -9.197   5.243
  615    HA   GLN  76           HA       GLN  76 -24.601  -6.468   5.479
  616   1HB   GLN  76          2HB       GLN  76 -26.303  -8.119   7.341
  617   2HB   GLN  76          1HB       GLN  76 -26.548  -6.444   6.866
  618   1HG   GLN  76          2HG       GLN  76 -26.924  -7.218   4.541
  619   2HG   GLN  76          1HG       GLN  76 -26.823  -8.877   5.124
  620   1HE2  GLN  76          1HE2      GLN  76 -29.002  -7.331   3.866
  621   2HE2  GLN  76          2HE2      GLN  76 -30.350  -7.489   4.936
  622    H    LYS  77           H        LYS  77 -24.721  -5.259   7.605
  623    HA   LYS  77           HA       LYS  77 -22.742  -6.355   9.489
  624   1HB   LYS  77          2HB       LYS  77 -22.138  -3.872   9.849
  625   2HB   LYS  77          1HB       LYS  77 -21.537  -4.677   8.408
  626   1HG   LYS  77          2HG       LYS  77 -24.099  -3.145   8.302
  627   2HG   LYS  77          1HG       LYS  77 -22.552  -2.300   8.232
  628   1HD   LYS  77          2HD       LYS  77 -21.903  -3.690   6.304
  629   2HD   LYS  77          1HD       LYS  77 -23.475  -4.487   6.365
  630   1HE   LYS  77          2HE       LYS  77 -23.525  -2.787   4.665
  631   2HE   LYS  77          1HE       LYS  77 -24.556  -2.289   6.006
  632   1HZ   LYS  77          1HZ       LYS  77 -23.222  -0.450   5.246
  633   2HZ   LYS  77          2HZ       LYS  77 -21.797  -1.331   5.470
  634   3HZ   LYS  77          3HZ       LYS  77 -22.735  -0.887   6.806
  635    H    ASP  78           H        ASP  78 -22.959  -5.763  11.681
  636    HA   ASP  78           HA       ASP  78 -25.700  -5.421  12.498
  637   1HB   ASP  78          2HB       ASP  78 -24.025  -6.977  13.599
  638   2HB   ASP  78          1HB       ASP  78 -23.268  -5.542  14.285
  639    H    ASP  79           H        ASP  79 -23.681  -3.224  11.395
  640    HA   ASP  79           HA       ASP  79 -23.573  -1.245  13.414
  641   1HB   ASP  79          2HB       ASP  79 -23.394  -1.043  10.403
  642   2HB   ASP  79          1HB       ASP  79 -23.138   0.322  11.486
  643    H    ALA  80           H        ALA  80 -25.487  -1.087  10.405
  644    HA   ALA  80           HA       ALA  80 -27.954  -0.602  11.697
  645   1HB   ALA  80          1HB       ALA  80 -26.887   1.510  12.316
  646   2HB   ALA  80          2HB       ALA  80 -28.240   1.772  11.215
  647   3HB   ALA  80          3HB       ALA  80 -26.584   1.858  10.614
  648    H    VAL  81           H        VAL  81 -25.940  -0.720   8.931
  649    HA   VAL  81           HA       VAL  81 -28.227  -0.471   7.111
  650    HB   VAL  81           HB       VAL  81 -25.282  -0.647   6.450
  651   1HG1  VAL  81          1HG1      VAL  81 -27.660   0.002   4.710
  652   2HG1  VAL  81          2HG1      VAL  81 -26.695  -1.473   4.647
  653   3HG1  VAL  81          3HG1      VAL  81 -25.970   0.075   4.211
  654   1HG2  VAL  81          1HG2      VAL  81 -25.800   1.409   7.643
  655   2HG2  VAL  81          2HG2      VAL  81 -27.127   1.740   6.530
  656   3HG2  VAL  81          3HG2      VAL  81 -25.462   1.749   5.945
  657    H    LYS  82           H        LYS  82 -28.920  -2.114   5.831
  658    HA   LYS  82           HA       LYS  82 -27.865  -4.784   6.453
  659   1HB   LYS  82          2HB       LYS  82 -30.509  -4.013   5.205
  660   2HB   LYS  82          1HB       LYS  82 -30.022  -5.632   5.685
  661   1HG   LYS  82          2HG       LYS  82 -30.148  -5.119   7.965
  662   2HG   LYS  82          1HG       LYS  82 -30.169  -3.380   7.658
  663   1HD   LYS  82          2HD       LYS  82 -32.387  -3.948   8.217
  664   2HD   LYS  82          1HD       LYS  82 -32.377  -3.771   6.463
  665   1HE   LYS  82          2HE       LYS  82 -32.052  -6.427   7.840
  666   2HE   LYS  82          1HE       LYS  82 -33.626  -5.770   7.392
  667   1HZ   LYS  82          1HZ       LYS  82 -32.887  -7.230   5.677
  668   2HZ   LYS  82          2HZ       LYS  82 -31.393  -6.448   5.559
  669   3HZ   LYS  82          3HZ       LYS  82 -32.804  -5.652   5.075
  670    H    LYS  83           H        LYS  83 -26.287  -5.241   5.010
  671    HA   LYS  83           HA       LYS  83 -26.844  -5.953   2.389
  672   1HB   LYS  83          2HB       LYS  83 -27.121  -3.533   1.991
  673   2HB   LYS  83          1HB       LYS  83 -25.486  -3.254   2.574
  674   1HG   LYS  83          2HG       LYS  83 -24.571  -4.506   0.722
  675   2HG   LYS  83          1HG       LYS  83 -26.194  -4.918   0.165
  676   1HD   LYS  83          2HD       LYS  83 -25.358  -3.106  -1.174
  677   2HD   LYS  83          1HD       LYS  83 -26.645  -2.491  -0.136
  678   1HE   LYS  83          2HE       LYS  83 -24.974  -1.606   1.414
  679   2HE   LYS  83          1HE       LYS  83 -23.683  -2.237   0.391
  680   1HZ   LYS  83          1HZ       LYS  83 -25.673  -0.186  -0.419
  681   2HZ   LYS  83          2HZ       LYS  83 -24.413  -0.774  -1.380
  682   3HZ   LYS  83          3HZ       LYS  83 -24.067   0.122   0.012
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1  -6.957  13.267   4.734
    2   2H    MET   1          2HT       MET   1  -5.396  13.509   5.338
    3   3H    MET   1          3HT       MET   1  -5.713  12.200   4.317
    4    HA   MET   1           HA       MET   1  -6.186  13.668   2.489
    5   1HB   MET   1          2HB       MET   1  -5.414  15.865   4.422
    6   2HB   MET   1          1HB       MET   1  -5.799  16.078   2.719
    7   1HG   MET   1          2HG       MET   1  -7.688  15.105   4.849
    8   2HG   MET   1          1HG       MET   1  -7.663  16.717   4.139
    9   1HE   MET   1          1HE       MET   1 -10.255  14.781   4.302
   10   2HE   MET   1          2HE       MET   1 -10.960  15.096   2.717
   11   3HE   MET   1          3HE       MET   1 -10.284  16.423   3.661
   12    H    TYR   2           H        TYR   2  -3.655  14.274   4.911
   13    HA   TYR   2           HA       TYR   2  -1.614  14.456   2.868
   14   1HB   TYR   2          2HB       TYR   2  -1.730  14.842   5.815
   15   2HB   TYR   2          1HB       TYR   2  -0.174  14.400   5.122
   16    HD1  TYR   2           1HD      TYR   2  -2.952  16.710   4.141
   17    HD2  TYR   2           2HD      TYR   2   1.216  16.212   4.834
   18    HE1  TYR   2           1HE      TYR   2  -2.575  19.057   3.518
   19    HE2  TYR   2           2HE      TYR   2   1.605  18.558   4.216
   20    HH   TYR   2           HH       TYR   2  -0.915  20.817   3.889
   21    H    ASP   3           H        ASP   3   0.537  13.183   3.966
   22    HA   ASP   3           HA       ASP   3   0.122  10.505   3.140
   23   1HB   ASP   3          2HB       ASP   3   2.466  11.659   4.665
   24   2HB   ASP   3          1HB       ASP   3   2.454  10.148   3.761
   25    H    TRP   4           H        TRP   4   0.897   8.624   4.534
   26    HA   TRP   4           HA       TRP   4   0.318   8.879   7.363
   27   1HB   TRP   4          2HB       TRP   4  -1.372   7.046   7.312
   28   2HB   TRP   4          1HB       TRP   4  -1.914   8.523   6.522
   29    HD1  TRP   4           HD       TRP   4  -0.969   4.901   5.780
   30    HE1  TRP   4           1HE      TRP   4  -1.743   4.314   3.396
   31    HE3  TRP   4           3HE      TRP   4  -2.390   9.553   4.217
   32    HZ2  TRP   4           2HZ      TRP   4  -2.814   5.645   1.151
   33    HZ3  TRP   4           3HZ      TRP   4  -3.280   9.812   1.937
   34    HH2  TRP   4           HH       TRP   4  -3.487   7.896   0.436
   35    H    ASN   5           H        ASN   5   1.653   7.247   4.671
   36    HA   ASN   5           HA       ASN   5   2.558   4.954   6.207
   37   1HB   ASN   5          2HB       ASN   5   2.660   5.768   3.337
   38   2HB   ASN   5          1HB       ASN   5   3.854   4.611   3.918
   39   1HD2  ASN   5          1HD2      ASN   5   3.170   2.601   4.671
   40   2HD2  ASN   5          2HD2      ASN   5   1.619   1.961   4.265
   41    H    ILE   6           H        ILE   6   3.443   7.365   7.259
   42    HA   ILE   6           HA       ILE   6   6.116   7.930   6.362
   43    HB   ILE   6           HB       ILE   6   4.923   8.789   8.988
   44   1HG1  ILE   6          2HG1      ILE   6   4.626  10.206   6.333
   45   2HG1  ILE   6          1HG1      ILE   6   3.355   9.249   7.085
   46   1HG2  ILE   6          1HG2      ILE   6   7.290   9.234   8.704
   47   2HG2  ILE   6          2HG2      ILE   6   6.379  10.743   8.658
   48   3HG2  ILE   6          3HG2      ILE   6   6.977  10.027   7.161
   49   1HD1  ILE   6          1HD1      ILE   6   2.979  11.581   7.511
   50   2HD1  ILE   6          2HD1      ILE   6   4.600  11.756   8.181
   51   3HD1  ILE   6          3HD1      ILE   6   3.402  10.771   9.020
   52    H    ALA   7           H        ALA   7   4.764   5.504   8.217
   53    HA   ALA   7           HA       ALA   7   6.587   5.147  10.305
   54   1HB   ALA   7          1HB       ALA   7   4.471   3.934  10.160
   55   2HB   ALA   7          2HB       ALA   7   5.830   2.828  10.358
   56   3HB   ALA   7          3HB       ALA   7   5.082   3.031   8.775
   57    H    ALA   8           H        ALA   8   6.890   4.564   6.919
   58    HA   ALA   8           HA       ALA   8   8.916   2.657   6.895
   59   1HB   ALA   8          1HB       ALA   8   9.386   3.429   4.623
   60   2HB   ALA   8          2HB       ALA   8   8.391   4.857   4.907
   61   3HB   ALA   8          3HB       ALA   8   7.653   3.256   4.905
   62    H    LYS   9           H        LYS   9  11.103   2.746   7.071
   63    HA   LYS   9           HA       LYS   9  12.265   5.367   7.762
   64   1HB   LYS   9          2HB       LYS   9  12.326   2.853   9.130
   65   2HB   LYS   9          1HB       LYS   9  13.961   3.263   8.635
   66   1HG   LYS   9          2HG       LYS   9  13.598   4.104  10.839
   67   2HG   LYS   9          1HG       LYS   9  13.686   5.474   9.730
   68   1HD   LYS   9          2HD       LYS   9  10.984   4.397  10.181
   69   2HD   LYS   9          1HD       LYS   9  11.744   5.128  11.594
   70   1HE   LYS   9          2HE       LYS   9  12.162   7.170  10.305
   71   2HE   LYS   9          1HE       LYS   9  11.394   6.435   8.896
   72   1HZ   LYS   9          1HZ       LYS   9  10.062   6.987  11.493
   73   2HZ   LYS   9          2HZ       LYS   9   9.328   6.303  10.130
   74   3HZ   LYS   9          3HZ       LYS   9   9.881   7.901  10.079
   75    H    SER  10           H        SER  10  13.168   2.195   6.403
   76    HA   SER  10           HA       SER  10  15.423   3.335   5.007
   77   1HB   SER  10          2HB       SER  10  15.616   1.067   5.867
   78   2HB   SER  10          1HB       SER  10  14.209   0.562   4.930
   79    HG   SER  10           HG       SER  10  16.749   1.366   3.965
   80    H    GLN  11           H        GLN  11  15.420   4.151   3.034
   81    HA   GLN  11           HA       GLN  11  13.241   4.802   1.553
   82   1HB   GLN  11          2HB       GLN  11  15.474   5.676   1.100
   83   2HB   GLN  11          1HB       GLN  11  15.982   4.108   0.490
   84   1HG   GLN  11          2HG       GLN  11  14.253   4.317  -1.292
   85   2HG   GLN  11          1HG       GLN  11  13.947   5.960  -0.727
   86   1HE2  GLN  11          1HE2      GLN  11  14.587   6.894  -2.651
   87   2HE2  GLN  11          2HE2      GLN  11  16.237   6.947  -3.160
   88    H    GLU  12           H        GLU  12  15.006   1.751   1.429
   89    HA   GLU  12           HA       GLU  12  13.800   0.680  -0.867
   90   1HB   GLU  12          2HB       GLU  12  14.765  -0.784   1.601
   91   2HB   GLU  12          1HB       GLU  12  14.443  -1.519   0.038
   92   1HG   GLU  12          2HG       GLU  12  16.541   0.567   0.589
   93   2HG   GLU  12          1HG       GLU  12  16.829  -1.165   0.422
   94    H    GLU  13           H        GLU  13  12.859   0.595   2.535
   95    HA   GLU  13           HA       GLU  13  10.516  -0.973   2.121
   96   1HB   GLU  13          2HB       GLU  13  11.092   0.891   4.429
   97   2HB   GLU  13          1HB       GLU  13   9.987  -0.478   4.418
   98   1HG   GLU  13          2HG       GLU  13  11.874  -2.002   4.159
   99   2HG   GLU  13          1HG       GLU  13  12.982  -0.633   4.165
  100    H    ARG  14           H        ARG  14  11.290   2.385   1.838
  101    HA   ARG  14           HA       ARG  14   8.676   3.441   2.152
  102   1HB   ARG  14          2HB       ARG  14  11.043   4.576   0.653
  103   2HB   ARG  14          1HB       ARG  14   9.596   5.466   1.101
  104   1HG   ARG  14          2HG       ARG  14  10.128   5.067   3.473
  105   2HG   ARG  14          1HG       ARG  14  11.614   4.260   2.978
  106   1HD   ARG  14          2HD       ARG  14  12.351   6.312   1.874
  107   2HD   ARG  14          1HD       ARG  14  10.872   7.121   2.388
  108    HE   ARG  14           HE       ARG  14  12.082   6.131   4.677
  109   1HH1  ARG  14          1HH1      ARG  14  12.823   8.424   2.159
  110   2HH1  ARG  14          2HH1      ARG  14  13.798   9.425   3.181
  111   1HH2  ARG  14          1HH2      ARG  14  13.362   7.448   6.030
  112   2HH2  ARG  14          2HH2      ARG  14  14.101   8.874   5.381
  113    H    ASP  15           H        ASP  15  10.581   2.557  -0.710
  114    HA   ASP  15           HA       ASP  15   8.723   3.396  -2.638
  115   1HB   ASP  15          2HB       ASP  15  10.833   1.234  -2.744
  116   2HB   ASP  15          1HB       ASP  15   9.906   1.764  -4.145
  117    H    LYS  16           H        LYS  16   9.243   0.173  -1.218
  118    HA   LYS  16           HA       LYS  16   7.197  -1.135  -2.622
  119   1HB   LYS  16          2HB       LYS  16   8.050  -1.851   0.176
  120   2HB   LYS  16          1HB       LYS  16   7.454  -2.923  -1.083
  121   1HG   LYS  16          2HG       LYS  16   9.543  -2.302  -2.386
  122   2HG   LYS  16          1HG       LYS  16  10.132  -1.595  -0.884
  123   1HD   LYS  16          2HD       LYS  16  10.987  -3.821  -1.026
  124   2HD   LYS  16          1HD       LYS  16   9.737  -3.799   0.221
  125   1HE   LYS  16          2HE       LYS  16   8.150  -4.800  -1.260
  126   2HE   LYS  16          1HE       LYS  16   9.247  -4.641  -2.631
  127   1HZ   LYS  16          1HZ       LYS  16  10.734  -6.220  -1.604
  128   2HZ   LYS  16          2HZ       LYS  16   9.191  -6.902  -1.738
  129   3HZ   LYS  16          3HZ       LYS  16   9.737  -6.337  -0.241
  130    H    VAL  17           H        VAL  17   7.177   0.136   0.684
  131    HA   VAL  17           HA       VAL  17   4.504  -0.436   1.262
  132    HB   VAL  17           HB       VAL  17   6.403   0.320   2.814
  133   1HG1  VAL  17          1HG1      VAL  17   6.678   2.422   1.581
  134   2HG1  VAL  17          2HG1      VAL  17   6.473   2.632   3.321
  135   3HG1  VAL  17          3HG1      VAL  17   5.129   2.947   2.220
  136   1HG2  VAL  17          1HG2      VAL  17   3.560   1.251   3.178
  137   2HG2  VAL  17          2HG2      VAL  17   4.755   1.139   4.470
  138   3HG2  VAL  17          3HG2      VAL  17   4.221  -0.320   3.634
  139    H    ASN  18           H        ASN  18   5.973   2.360  -0.257
  140    HA   ASN  18           HA       ASN  18   3.720   4.043  -0.304
  141   1HB   ASN  18          2HB       ASN  18   6.170   3.840  -2.043
  142   2HB   ASN  18          1HB       ASN  18   4.906   5.008  -2.400
  143   1HD2  ASN  18          1HD2      ASN  18   5.667   4.089   0.865
  144   2HD2  ASN  18          2HD2      ASN  18   6.445   5.562   1.316
  145    H    VAL  19           H        VAL  19   4.761   1.427  -2.371
  146    HA   VAL  19           HA       VAL  19   2.710   1.871  -4.343
  147    HB   VAL  19           HB       VAL  19   5.100   0.524  -4.385
  148   1HG1  VAL  19          1HG1      VAL  19   4.062  -1.357  -3.135
  149   2HG1  VAL  19          2HG1      VAL  19   4.699  -1.811  -4.714
  150   3HG1  VAL  19          3HG1      VAL  19   2.964  -1.595  -4.493
  151   1HG2  VAL  19          1HG2      VAL  19   4.369  -0.256  -6.635
  152   2HG2  VAL  19          2HG2      VAL  19   4.057   1.451  -6.326
  153   3HG2  VAL  19          3HG2      VAL  19   2.738   0.286  -6.237
  154    H    ASP  20           H        ASP  20   2.996   0.316  -1.321
  155    HA   ASP  20           HA       ASP  20   0.994  -1.693  -1.657
  156   1HB   ASP  20          2HB       ASP  20   2.807  -1.770   0.071
  157   2HB   ASP  20          1HB       ASP  20   2.007  -0.442   0.905
  158    H    LEU  21           H        LEU  21   1.078   1.609  -0.397
  159    HA   LEU  21           HA       LEU  21  -1.658   1.592   0.436
  160   1HB   LEU  21          2HB       LEU  21  -1.365   4.014   0.737
  161   2HB   LEU  21          1HB       LEU  21  -0.079   3.101   1.502
  162    HG   LEU  21           HG       LEU  21   1.201   3.586  -0.732
  163   1HD1  LEU  21          1HD1      LEU  21   0.613   5.865  -1.577
  164   2HD1  LEU  21          2HD1      LEU  21  -0.907   5.730  -0.693
  165   3HD1  LEU  21          3HD1      LEU  21  -0.539   4.598  -1.992
  166   1HD2  LEU  21          1HD2      LEU  21   2.099   5.642   0.262
  167   2HD2  LEU  21          2HD2      LEU  21   1.914   4.354   1.453
  168   3HD2  LEU  21          3HD2      LEU  21   0.745   5.673   1.391
  169    H    ALA  22           H        ALA  22   0.108   2.274  -2.456
  170    HA   ALA  22           HA       ALA  22  -1.742   3.787  -3.878
  171   1HB   ALA  22          1HB       ALA  22   0.092   1.689  -5.028
  172   2HB   ALA  22          2HB       ALA  22   0.604   3.312  -4.564
  173   3HB   ALA  22          3HB       ALA  22  -0.575   3.096  -5.857
  174    H    ALA  23           H        ALA  23  -1.404   0.275  -3.591
  175    HA   ALA  23           HA       ALA  23  -3.611  -0.313  -5.306
  176   1HB   ALA  23          1HB       ALA  23  -2.351  -2.116  -3.244
  177   2HB   ALA  23          2HB       ALA  23  -1.709  -1.867  -4.866
  178   3HB   ALA  23          3HB       ALA  23  -3.300  -2.596  -4.653
  179    H    SER  24           H        SER  24  -3.232   0.418  -1.946
  180    HA   SER  24           HA       SER  24  -5.697  -0.726  -1.062
  181   1HB   SER  24          2HB       SER  24  -3.795  -0.242   0.468
  182   2HB   SER  24          1HB       SER  24  -4.102   1.481   0.249
  183    HG   SER  24           HG       SER  24  -6.399   0.367   0.891
  184    H    GLY  25           H        GLY  25  -4.762   2.723  -1.425
  185   1HA   GLY  25          2HA       GLY  25  -7.306   3.760  -0.956
  186   2HA   GLY  25          1HA       GLY  25  -6.040   4.562  -1.873
  187    H    VAL  26           H        VAL  26  -5.763   2.899  -4.032
  188    HA   VAL  26           HA       VAL  26  -7.767   3.789  -5.730
  189    HB   VAL  26           HB       VAL  26  -5.817   1.512  -6.064
  190   1HG1  VAL  26          1HG1      VAL  26  -7.708   1.102  -7.532
  191   2HG1  VAL  26          2HG1      VAL  26  -6.317   1.636  -8.474
  192   3HG1  VAL  26          3HG1      VAL  26  -7.632   2.759  -8.129
  193   1HG2  VAL  26          1HG2      VAL  26  -5.848   4.322  -7.160
  194   2HG2  VAL  26          2HG2      VAL  26  -4.611   3.102  -7.468
  195   3HG2  VAL  26          3HG2      VAL  26  -4.836   3.740  -5.839
  196    H    ALA  27           H        ALA  27  -7.297   0.413  -4.599
  197    HA   ALA  27           HA       ALA  27  -9.936  -0.282  -5.591
  198   1HB   ALA  27          1HB       ALA  27  -8.035  -1.787  -5.957
  199   2HB   ALA  27          2HB       ALA  27  -9.350  -2.565  -5.077
  200   3HB   ALA  27          3HB       ALA  27  -7.907  -2.028  -4.215
  201    H    TYR  28           H        TYR  28  -8.290  -0.592  -2.428
  202    HA   TYR  28           HA       TYR  28 -10.390  -1.571  -0.960
  203   1HB   TYR  28          2HB       TYR  28  -7.836  -0.532  -0.397
  204   2HB   TYR  28          1HB       TYR  28  -8.952   0.329   0.658
  205    HD1  TYR  28           1HD      TYR  28  -7.854  -0.723   2.638
  206    HD2  TYR  28           2HD      TYR  28  -9.769  -3.059  -0.365
  207    HE1  TYR  28           1HE      TYR  28  -7.841  -2.659   4.152
  208    HE2  TYR  28           2HE      TYR  28  -9.768  -4.999   1.143
  209    HH   TYR  28           HH       TYR  28  -9.133  -4.770   4.445
  210    H    LYS  29           H        LYS  29  -9.704   1.913  -1.497
  211    HA   LYS  29           HA       LYS  29 -11.800   2.845   0.120
  212   1HB   LYS  29          2HB       LYS  29 -10.221   4.457  -0.566
  213   2HB   LYS  29          1HB       LYS  29 -10.406   4.041  -2.260
  214   1HG   LYS  29          2HG       LYS  29 -11.402   6.229  -1.606
  215   2HG   LYS  29          1HG       LYS  29 -12.517   5.115  -2.394
  216   1HD   LYS  29          2HD       LYS  29 -13.543   4.563  -0.298
  217   2HD   LYS  29          1HD       LYS  29 -12.318   5.455   0.596
  218   1HE   LYS  29          2HE       LYS  29 -14.252   6.683  -1.363
  219   2HE   LYS  29          1HE       LYS  29 -14.473   6.665   0.387
  220   1HZ   LYS  29          1HZ       LYS  29 -13.531   8.757  -0.361
  221   2HZ   LYS  29          2HZ       LYS  29 -12.219   7.950  -1.060
  222   3HZ   LYS  29          3HZ       LYS  29 -12.425   7.932   0.619
  223    H    GLU  30           H        GLU  30 -11.768   2.121  -3.364
  224    HA   GLU  30           HA       GLU  30 -14.487   2.822  -3.766
  225   1HB   GLU  30          2HB       GLU  30 -12.647   1.076  -5.408
  226   2HB   GLU  30          1HB       GLU  30 -14.236   1.616  -5.932
  227   1HG   GLU  30          2HG       GLU  30 -13.455   3.958  -5.711
  228   2HG   GLU  30          1HG       GLU  30 -11.845   3.344  -5.339
  229    H    ARG  31           H        ARG  31 -13.482   0.566  -1.781
  230    HA   ARG  31           HA       ARG  31 -15.647  -1.305  -2.471
  231   1HB   ARG  31          2HB       ARG  31 -13.006  -1.874  -1.118
  232   2HB   ARG  31          1HB       ARG  31 -14.330  -3.026  -1.200
  233   1HG   ARG  31          2HG       ARG  31 -12.848  -1.860  -3.548
  234   2HG   ARG  31          1HG       ARG  31 -12.658  -3.488  -2.897
  235   1HD   ARG  31          2HD       ARG  31 -15.016  -3.950  -3.425
  236   2HD   ARG  31          1HD       ARG  31 -15.164  -2.338  -4.120
  237    HE   ARG  31           HE       ARG  31 -13.061  -3.915  -5.285
  238   1HH1  ARG  31          1HH1      ARG  31 -16.457  -3.140  -5.387
  239   2HH1  ARG  31          2HH1      ARG  31 -16.647  -3.612  -7.042
  240   1HH2  ARG  31          1HH2      ARG  31 -13.303  -4.542  -7.467
  241   2HH2  ARG  31          2HH2      ARG  31 -14.855  -4.408  -8.224
  242    H    LEU  32           H        LEU  32 -13.664  -0.546   0.404
  243    HA   LEU  32           HA       LEU  32 -16.028  -0.770   2.084
  244   1HB   LEU  32          2HB       LEU  32 -13.234  -0.239   3.034
  245   2HB   LEU  32          1HB       LEU  32 -14.548  -1.002   3.905
  246    HG   LEU  32           HG       LEU  32 -13.363  -2.866   3.515
  247   1HD1  LEU  32          1HD1      LEU  32 -13.807  -4.044   1.420
  248   2HD1  LEU  32          2HD1      LEU  32 -14.471  -2.559   0.739
  249   3HD1  LEU  32          3HD1      LEU  32 -15.265  -3.326   2.110
  250   1HD2  LEU  32          1HD2      LEU  32 -11.768  -3.048   1.557
  251   2HD2  LEU  32          2HD2      LEU  32 -11.383  -1.884   2.825
  252   3HD2  LEU  32          3HD2      LEU  32 -12.079  -1.331   1.301
  253    H    ASN  33           H        ASN  33 -14.078   1.048   3.871
  254    HA   ASN  33           HA       ASN  33 -14.911   3.625   2.759
  255   1HB   ASN  33          2HB       ASN  33 -16.432   2.910   4.626
  256   2HB   ASN  33          1HB       ASN  33 -15.033   2.902   5.697
  257   1HD2  ASN  33          1HD2      ASN  33 -14.078   4.853   6.279
  258   2HD2  ASN  33          2HD2      ASN  33 -14.884   6.366   6.072
  259    H    ILE  34           H        ILE  34 -12.730   3.638   1.971
  260    HA   ILE  34           HA       ILE  34 -10.705   4.137   4.066
  261    HB   ILE  34           HB       ILE  34 -10.395   3.009   1.292
  262   1HG1  ILE  34          2HG1      ILE  34  -9.096   1.275   2.543
  263   2HG1  ILE  34          1HG1      ILE  34  -9.570   2.074   4.039
  264   1HG2  ILE  34          1HG2      ILE  34  -8.677   4.588   1.316
  265   2HG2  ILE  34          2HG2      ILE  34  -7.916   3.064   1.767
  266   3HG2  ILE  34          3HG2      ILE  34  -8.286   4.265   3.006
  267   1HD1  ILE  34          1HD1      ILE  34 -11.529   0.990   2.042
  268   2HD1  ILE  34          2HD1      ILE  34 -11.853   1.556   3.680
  269   3HD1  ILE  34          3HD1      ILE  34 -10.924   0.079   3.425
  270    HA   PRO  35           HA       PRO  35 -11.583   8.243   2.204
  271   1HB   PRO  35          2HB       PRO  35 -10.904   9.667   4.397
  272   2HB   PRO  35          1HB       PRO  35 -12.474   8.866   4.240
  273   1HG   PRO  35          2HG       PRO  35  -9.989   7.872   5.613
  274   2HG   PRO  35          1HG       PRO  35 -11.648   7.955   6.253
  275   1HD   PRO  35          2HD       PRO  35 -10.681   5.672   5.270
  276   2HD   PRO  35          1HD       PRO  35 -12.362   6.152   4.951
  277    H    VAL  36           H        VAL  36  -9.676   7.729   0.833
  278    HA   VAL  36           HA       VAL  36  -7.456   9.462   1.581
  279    HB   VAL  36           HB       VAL  36  -5.751   7.867   0.956
  280   1HG1  VAL  36          1HG1      VAL  36  -6.255   7.849   3.274
  281   2HG1  VAL  36          2HG1      VAL  36  -6.095   6.164   2.781
  282   3HG1  VAL  36          3HG1      VAL  36  -7.696   6.864   3.026
  283   1HG2  VAL  36          1HG2      VAL  36  -6.888   6.592  -0.712
  284   2HG2  VAL  36          2HG2      VAL  36  -8.054   5.995   0.465
  285   3HG2  VAL  36          3HG2      VAL  36  -6.369   5.485   0.558
  286    H    ILE  37           H        ILE  37  -6.111  10.063  -0.260
  287    HA   ILE  37           HA       ILE  37  -7.722  10.382  -2.646
  288    HB   ILE  37           HB       ILE  37  -4.907  11.358  -2.169
  289   1HG1  ILE  37          2HG1      ILE  37  -6.373  12.184  -0.391
  290   2HG1  ILE  37          1HG1      ILE  37  -5.913  13.490  -1.476
  291   1HG2  ILE  37          1HG2      ILE  37  -5.565  13.076  -3.849
  292   2HG2  ILE  37          2HG2      ILE  37  -7.054  12.171  -4.116
  293   3HG2  ILE  37          3HG2      ILE  37  -5.495  11.433  -4.484
  294   1HD1  ILE  37          1HD1      ILE  37  -8.237  13.678  -0.872
  295   2HD1  ILE  37          2HD1      ILE  37  -8.547  12.039  -1.445
  296   3HD1  ILE  37          3HD1      ILE  37  -8.092  13.301  -2.590
  297    H    ALA  38           H        ALA  38  -7.619   9.083  -4.374
  298    HA   ALA  38           HA       ALA  38  -5.650   6.991  -4.506
  299   1HB   ALA  38          1HB       ALA  38  -7.785   7.731  -6.505
  300   2HB   ALA  38          2HB       ALA  38  -7.986   6.603  -5.164
  301   3HB   ALA  38          3HB       ALA  38  -6.860   6.230  -6.468
  302    H    GLU  39           H        GLU  39  -6.563   9.624  -6.733
  303    HA   GLU  39           HA       GLU  39  -4.497   9.409  -8.519
  304   1HB   GLU  39          2HB       GLU  39  -4.729  11.922  -8.831
  305   2HB   GLU  39          1HB       GLU  39  -6.177  10.950  -9.045
  306   1HG   GLU  39          2HG       GLU  39  -6.891  11.544  -6.772
  307   2HG   GLU  39          1HG       GLU  39  -5.453  12.549  -6.598
  308    H    GLN  40           H        GLN  40  -4.249  10.296  -5.240
  309    HA   GLN  40           HA       GLN  40  -1.857  11.849  -5.371
  310   1HB   GLN  40          2HB       GLN  40  -3.638  10.977  -3.354
  311   2HB   GLN  40          1HB       GLN  40  -2.053  10.345  -2.930
  312   1HG   GLN  40          2HG       GLN  40  -1.113  12.578  -3.013
  313   2HG   GLN  40          1HG       GLN  40  -2.669  13.234  -3.522
  314   1HE2  GLN  40          1HE2      GLN  40  -2.837  14.596  -1.758
  315   2HE2  GLN  40          2HE2      GLN  40  -3.149  14.019  -0.160
  316    H    VAL  41           H        VAL  41  -2.661   8.492  -5.224
  317    HA   VAL  41           HA       VAL  41   0.101   7.649  -4.916
  318    HB   VAL  41           HB       VAL  41  -0.668   5.553  -4.399
  319   1HG1  VAL  41          1HG1      VAL  41  -1.723   7.159  -2.853
  320   2HG1  VAL  41          2HG1      VAL  41  -2.660   5.677  -3.044
  321   3HG1  VAL  41          3HG1      VAL  41  -3.168   7.151  -3.867
  322   1HG2  VAL  41          1HG2      VAL  41  -2.859   4.638  -5.236
  323   2HG2  VAL  41          2HG2      VAL  41  -1.643   4.943  -6.474
  324   3HG2  VAL  41          3HG2      VAL  41  -2.979   6.070  -6.256
  325    H    ALA  42           H        ALA  42  -2.173   8.304  -7.360
  326    HA   ALA  42           HA       ALA  42  -1.110   6.488  -9.314
  327   1HB   ALA  42          1HB       ALA  42  -2.693   7.538 -10.852
  328   2HB   ALA  42          2HB       ALA  42  -3.092   8.727  -9.612
  329   3HB   ALA  42          3HB       ALA  42  -3.460   7.021  -9.350
  330    H    ARG  43           H        ARG  43  -0.229   9.615  -8.239
  331    HA   ARG  43           HA       ARG  43   0.876  10.440 -10.774
  332   1HB   ARG  43          2HB       ARG  43   0.992  12.489  -9.866
  333   2HB   ARG  43          1HB       ARG  43   0.054  11.815  -8.547
  334   1HG   ARG  43          2HG       ARG  43   3.035  11.682  -8.476
  335   2HG   ARG  43          1HG       ARG  43   2.201  13.173  -8.050
  336   1HD   ARG  43          2HD       ARG  43   0.931  11.977  -6.346
  337   2HD   ARG  43          1HD       ARG  43   1.741  10.477  -6.785
  338    HE   ARG  43           HE       ARG  43   3.849  11.821  -6.135
  339   1HH1  ARG  43          1HH1      ARG  43   0.726  12.052  -4.606
  340   2HH1  ARG  43          2HH1      ARG  43   1.369  12.520  -3.068
  341   1HH2  ARG  43          1HH2      ARG  43   4.704  12.434  -4.111
  342   2HH2  ARG  43          2HH2      ARG  43   3.630  12.737  -2.787
  343    H    GLU  44           H        GLU  44   1.750   8.234  -8.530
  344    HA   GLU  44           HA       GLU  44   4.606   8.529  -9.161
  345   1HB   GLU  44          2HB       GLU  44   4.796   7.094  -6.924
  346   2HB   GLU  44          1HB       GLU  44   4.798   8.852  -6.927
  347   1HG   GLU  44          2HG       GLU  44   2.481   8.915  -6.340
  348   2HG   GLU  44          1HG       GLU  44   2.345   7.172  -6.522
  349    H    GLN  45           H        GLN  45   2.571   5.992  -7.750
  350    HA   GLN  45           HA       GLN  45   2.607   3.715  -8.076
  351   1HB   GLN  45          2HB       GLN  45   2.190   4.864 -10.827
  352   2HB   GLN  45          1HB       GLN  45   2.116   3.135 -10.523
  353   1HG   GLN  45          2HG       GLN  45   0.336   3.561  -8.848
  354   2HG   GLN  45          1HG       GLN  45   0.354   5.258  -9.327
  355   1HE2  GLN  45          1HE2      GLN  45  -1.776   5.193 -10.028
  356   2HE2  GLN  45          2HE2      GLN  45  -2.247   4.386 -11.482
  357    HA   PRO  46           HA       PRO  46   7.252   3.783  -8.949
  358   1HB   PRO  46          2HB       PRO  46   6.748   1.545  -7.022
  359   2HB   PRO  46          1HB       PRO  46   8.113   2.666  -7.108
  360   1HG   PRO  46          2HG       PRO  46   6.182   3.019  -5.310
  361   2HG   PRO  46          1HG       PRO  46   6.920   4.402  -6.137
  362   1HD   PRO  46          2HD       PRO  46   4.239   3.190  -6.508
  363   2HD   PRO  46          1HD       PRO  46   4.769   4.863  -6.762
  364    H    GLU  47           H        GLU  47   8.202   2.590 -10.493
  365    HA   GLU  47           HA       GLU  47   6.706   0.460 -11.744
  366   1HB   GLU  47          2HB       GLU  47   7.834   2.071 -13.157
  367   2HB   GLU  47          1HB       GLU  47   9.379   1.710 -12.399
  368   1HG   GLU  47          2HG       GLU  47   9.245  -0.584 -13.283
  369   2HG   GLU  47          1HG       GLU  47   7.744  -0.154 -14.104
  370    H    ASN  48           H        ASN  48   9.966   0.765 -10.330
  371    HA   ASN  48           HA       ASN  48  10.583  -1.976 -10.418
  372   1HB   ASN  48          2HB       ASN  48  12.239  -0.132 -10.160
  373   2HB   ASN  48          1HB       ASN  48  11.673   0.105  -8.510
  374   1HD2  ASN  48          1HD2      ASN  48  12.274  -1.323  -6.926
  375   2HD2  ASN  48          2HD2      ASN  48  13.468  -2.549  -7.164
  376    H    LEU  49           H        LEU  49   8.028  -0.908  -8.950
  377    HA   LEU  49           HA       LEU  49   8.058  -2.941  -6.914
  378   1HB   LEU  49          2HB       LEU  49   8.164  -0.074  -6.272
  379   2HB   LEU  49          1HB       LEU  49   6.857  -0.930  -5.485
  380    HG   LEU  49           HG       LEU  49   8.484  -1.100  -3.891
  381   1HD1  LEU  49          1HD1      LEU  49   7.772  -3.359  -4.473
  382   2HD1  LEU  49          2HD1      LEU  49   9.430  -3.326  -3.876
  383   3HD1  LEU  49          3HD1      LEU  49   9.121  -3.492  -5.603
  384   1HD2  LEU  49          1HD2      LEU  49  10.898  -1.467  -4.401
  385   2HD2  LEU  49          2HD2      LEU  49  10.243   0.053  -5.004
  386   3HD2  LEU  49          3HD2      LEU  49  10.506  -1.292  -6.109
  387    H    ARG  50           H        ARG  50   6.681  -1.690  -9.462
  388    HA   ARG  50           HA       ARG  50   3.989  -1.248  -8.786
  389   1HB   ARG  50          2HB       ARG  50   5.086  -0.667 -10.971
  390   2HB   ARG  50          1HB       ARG  50   5.050  -2.375 -11.382
  391   1HG   ARG  50          2HG       ARG  50   2.652  -2.389 -11.362
  392   2HG   ARG  50          1HG       ARG  50   2.607  -0.733 -10.752
  393   1HD   ARG  50          2HD       ARG  50   2.165  -0.660 -13.096
  394   2HD   ARG  50          1HD       ARG  50   3.784  -0.015 -12.825
  395    HE   ARG  50           HE       ARG  50   3.835  -2.802 -13.414
  396   1HH1  ARG  50          1HH1      ARG  50   3.560   0.359 -14.857
  397   2HH1  ARG  50          2HH1      ARG  50   4.184  -0.145 -16.391
  398   1HH2  ARG  50          1HH2      ARG  50   4.658  -3.474 -15.433
  399   2HH2  ARG  50          2HH2      ARG  50   4.808  -2.324 -16.720
  400    H    THR  51           H        THR  51   5.910  -4.058  -8.915
  401    HA   THR  51           HA       THR  51   3.861  -5.975  -9.422
  402    HB   THR  51           HB       THR  51   6.498  -6.379  -7.987
  403    HG1  THR  51           1HG      THR  51   5.906  -5.891 -10.606
  404   1HG2  THR  51          1HG2      THR  51   4.719  -8.346  -9.430
  405   2HG2  THR  51          2HG2      THR  51   4.869  -8.203  -7.679
  406   3HG2  THR  51          3HG2      THR  51   6.256  -8.709  -8.644
  407    H    TYR  52           H        TYR  52   5.492  -4.843  -6.463
  408    HA   TYR  52           HA       TYR  52   4.151  -6.356  -4.593
  409   1HB   TYR  52          2HB       TYR  52   6.104  -4.872  -4.158
  410   2HB   TYR  52          1HB       TYR  52   5.051  -3.473  -4.305
  411    HD1  TYR  52           1HD      TYR  52   5.327  -2.590  -2.130
  412    HD2  TYR  52           2HD      TYR  52   4.149  -6.663  -2.603
  413    HE1  TYR  52           1HE      TYR  52   4.807  -2.715   0.258
  414    HE2  TYR  52           2HE      TYR  52   3.632  -6.785  -0.214
  415    HH   TYR  52           HH       TYR  52   4.278  -5.634   1.881
  416    H    PHE  53           H        PHE  53   3.258  -3.245  -6.016
  417    HA   PHE  53           HA       PHE  53   0.929  -2.732  -4.613
  418   1HB   PHE  53          2HB       PHE  53   1.446  -0.951  -5.901
  419   2HB   PHE  53          1HB       PHE  53   2.056  -1.931  -7.225
  420    HD1  PHE  53           1HD      PHE  53  -0.639   0.056  -5.991
  421    HD2  PHE  53           2HD      PHE  53   0.349  -2.986  -8.800
  422    HE1  PHE  53           1HE      PHE  53  -2.661   0.600  -7.283
  423    HE2  PHE  53           2HE      PHE  53  -1.676  -2.454 -10.092
  424    HZ   PHE  53           HZ       PHE  53  -3.185  -0.660  -9.334
  425    H    MET  54           H        MET  54   1.449  -4.942  -7.306
  426    HA   MET  54           HA       MET  54  -1.341  -5.469  -7.714
  427   1HB   MET  54          2HB       MET  54   0.936  -7.281  -8.511
  428   2HB   MET  54          1HB       MET  54  -0.652  -7.148  -9.253
  429   1HG   MET  54          2HG       MET  54   0.068  -4.713  -9.748
  430   2HG   MET  54          1HG       MET  54   1.694  -5.327  -9.471
  431   1HE   MET  54          1HE       MET  54   1.521  -8.323 -10.632
  432   2HE   MET  54          2HE       MET  54   2.841  -7.175 -10.861
  433   3HE   MET  54          3HE       MET  54   2.130  -7.989 -12.255
  434    H    GLU  55           H        GLU  55   1.311  -7.035  -6.008
  435    HA   GLU  55           HA       GLU  55   0.055  -9.363  -5.182
  436   1HB   GLU  55          2HB       GLU  55   1.953  -7.775  -3.459
  437   2HB   GLU  55          1HB       GLU  55   1.735  -9.519  -3.492
  438   1HG   GLU  55          2HG       GLU  55   2.545  -9.373  -5.921
  439   2HG   GLU  55          1HG       GLU  55   3.102  -7.761  -5.485
  440    H    ARG  56           H        ARG  56   0.278  -6.262  -3.488
  441    HA   ARG  56           HA       ARG  56  -1.504  -6.993  -1.412
  442   1HB   ARG  56          2HB       ARG  56   0.217  -4.928  -1.768
  443   2HB   ARG  56          1HB       ARG  56  -1.309  -4.126  -2.111
  444   1HG   ARG  56          2HG       ARG  56  -0.761  -3.852   0.211
  445   2HG   ARG  56          1HG       ARG  56  -2.174  -4.900   0.064
  446   1HD   ARG  56          2HD       ARG  56  -0.781  -6.863   0.386
  447   2HD   ARG  56          1HD       ARG  56   0.662  -5.851   0.456
  448    HE   ARG  56           HE       ARG  56  -1.316  -5.164   2.421
  449   1HH1  ARG  56          1HH1      ARG  56   1.387  -7.240   1.687
  450   2HH1  ARG  56          2HH1      ARG  56   1.776  -7.535   3.348
  451   1HH2  ARG  56          1HH2      ARG  56  -0.808  -5.550   4.610
  452   2HH2  ARG  56          2HH2      ARG  56   0.526  -6.578   5.009
  453    H    LEU  57           H        LEU  57  -1.895  -5.522  -4.564
  454    HA   LEU  57           HA       LEU  57  -4.506  -4.596  -4.380
  455   1HB   LEU  57          2HB       LEU  57  -3.230  -4.042  -6.301
  456   2HB   LEU  57          1HB       LEU  57  -2.950  -5.725  -6.693
  457    HG   LEU  57           HG       LEU  57  -5.308  -5.992  -7.301
  458   1HD1  LEU  57          1HD1      LEU  57  -6.291  -4.357  -5.795
  459   2HD1  LEU  57          2HD1      LEU  57  -6.766  -4.031  -7.462
  460   3HD1  LEU  57          3HD1      LEU  57  -5.522  -3.047  -6.692
  461   1HD2  LEU  57          1HD2      LEU  57  -3.719  -5.364  -9.026
  462   2HD2  LEU  57          2HD2      LEU  57  -3.954  -3.659  -8.647
  463   3HD2  LEU  57          3HD2      LEU  57  -5.281  -4.603  -9.323
  464    H    ARG  58           H        ARG  58  -3.461  -7.782  -5.641
  465    HA   ARG  58           HA       ARG  58  -6.035  -8.845  -5.909
  466   1HB   ARG  58          2HB       ARG  58  -4.991 -10.993  -6.115
  467   2HB   ARG  58          1HB       ARG  58  -3.939  -9.816  -6.886
  468   1HG   ARG  58          2HG       ARG  58  -2.534  -9.789  -4.867
  469   2HG   ARG  58          1HG       ARG  58  -3.561 -11.037  -4.163
  470   1HD   ARG  58          2HD       ARG  58  -1.656 -12.121  -5.095
  471   2HD   ARG  58          1HD       ARG  58  -3.029 -12.466  -6.145
  472    HE   ARG  58           HE       ARG  58  -1.804 -10.229  -7.195
  473   1HH1  ARG  58          1HH1      ARG  58  -0.914 -13.532  -6.525
  474   2HH1  ARG  58          2HH1      ARG  58   0.221 -13.626  -7.829
  475   1HH2  ARG  58          1HH2      ARG  58  -0.311 -10.346  -8.917
  476   2HH2  ARG  58          2HH2      ARG  58   0.560 -11.818  -9.188
  477    H    HIS  59           H        HIS  59  -3.807  -8.726  -3.202
  478    HA   HIS  59           HA       HIS  59  -5.220 -10.411  -1.448
  479   1HB   HIS  59          2HB       HIS  59  -3.143  -8.308  -1.162
  480   2HB   HIS  59          1HB       HIS  59  -4.064  -8.709   0.284
  481    HD1  HIS  59           1HD      HIS  59  -2.345  -9.995   1.571
  482    HD2  HIS  59           2HD      HIS  59  -2.766 -11.367  -2.327
  483    HE1  HIS  59           1HE      HIS  59  -0.970 -12.096   1.447
  484    HE2  HIS  59           2HE      HIS  59  -1.344 -12.975  -0.885
  485    H    TYR  60           H        TYR  60  -5.395  -6.916  -1.986
  486    HA   TYR  60           HA       TYR  60  -7.317  -6.361  -0.012
  487   1HB   TYR  60          2HB       TYR  60  -6.498  -4.943  -2.542
  488   2HB   TYR  60          1HB       TYR  60  -7.808  -4.334  -1.536
  489    HD1  TYR  60           1HD      TYR  60  -4.679  -3.541  -2.293
  490    HD2  TYR  60           2HD      TYR  60  -6.866  -4.689   1.171
  491    HE1  TYR  60           1HE      TYR  60  -3.047  -2.365  -0.877
  492    HE2  TYR  60           2HE      TYR  60  -5.242  -3.515   2.594
  493    HH   TYR  60           HH       TYR  60  -2.952  -1.348   1.372
  494    H    ARG  61           H        ARG  61  -7.535  -7.538  -3.288
  495    HA   ARG  61           HA       ARG  61 -10.269  -7.092  -3.749
  496   1HB   ARG  61          2HB       ARG  61  -8.594  -7.800  -5.472
  497   2HB   ARG  61          1HB       ARG  61  -8.606  -9.409  -4.763
  498   1HG   ARG  61          2HG       ARG  61 -10.993  -9.608  -5.279
  499   2HG   ARG  61          1HG       ARG  61 -10.955  -8.009  -6.023
  500   1HD   ARG  61          2HD       ARG  61 -10.789  -9.665  -7.752
  501   2HD   ARG  61          1HD       ARG  61  -9.237  -8.841  -7.605
  502    HE   ARG  61           HE       ARG  61  -9.049 -11.064  -5.999
  503   1HH1  ARG  61          1HH1      ARG  61  -9.683 -10.444  -9.369
  504   2HH1  ARG  61          2HH1      ARG  61  -8.970 -11.928  -9.909
  505   1HH2  ARG  61          1HH2      ARG  61  -8.112 -13.019  -6.700
  506   2HH2  ARG  61          2HH2      ARG  61  -8.077 -13.392  -8.390
  507    H    GLN  62           H        GLN  62  -8.533  -9.676  -2.119
  508    HA   GLN  62           HA       GLN  62 -10.720 -11.428  -1.765
  509   1HB   GLN  62          2HB       GLN  62  -8.250 -11.119  -0.044
  510   2HB   GLN  62          1HB       GLN  62  -9.320 -12.515  -0.081
  511   1HG   GLN  62          2HG       GLN  62  -8.660 -13.047  -2.311
  512   2HG   GLN  62          1HG       GLN  62  -7.747 -11.544  -2.452
  513   1HE2  GLN  62          1HE2      GLN  62  -5.823 -12.583  -2.906
  514   2HE2  GLN  62          2HE2      GLN  62  -4.942 -13.475  -1.719
  515    H    LEU  63           H        LEU  63  -9.278  -8.947   0.356
  516    HA   LEU  63           HA       LEU  63 -11.052  -9.378   2.495
  517   1HB   LEU  63          2HB       LEU  63  -9.354  -7.027   1.695
  518   2HB   LEU  63          1HB       LEU  63 -10.417  -6.974   3.088
  519    HG   LEU  63           HG       LEU  63  -8.138  -7.443   3.776
  520   1HD1  LEU  63          1HD1      LEU  63  -9.992  -8.430   5.046
  521   2HD1  LEU  63          2HD1      LEU  63  -8.535  -9.422   5.108
  522   3HD1  LEU  63          3HD1      LEU  63  -9.876  -9.888   4.062
  523   1HD2  LEU  63          1HD2      LEU  63  -7.043  -9.550   3.144
  524   2HD2  LEU  63          2HD2      LEU  63  -7.295  -8.485   1.761
  525   3HD2  LEU  63          3HD2      LEU  63  -8.350  -9.877   2.007
  526    H    SER  64           H        SER  64 -11.093  -7.347  -0.358
  527    HA   SER  64           HA       SER  64 -13.276  -5.750   0.184
  528   1HB   SER  64          2HB       SER  64 -12.425  -6.965  -2.453
  529   2HB   SER  64          1HB       SER  64 -13.610  -5.669  -2.291
  530    HG   SER  64           HG       SER  64 -11.002  -5.431  -2.447
  531    H    LEU  65           H        LEU  65 -13.182  -9.138  -0.831
  532    HA   LEU  65           HA       LEU  65 -16.095  -9.208  -0.965
  533   1HB   LEU  65          2HB       LEU  65 -14.068 -11.338  -1.605
  534   2HB   LEU  65          1HB       LEU  65 -15.789 -11.423  -1.929
  535    HG   LEU  65           HG       LEU  65 -13.841  -9.509  -3.221
  536   1HD1  LEU  65          1HD1      LEU  65 -13.586 -11.815  -3.984
  537   2HD1  LEU  65          2HD1      LEU  65 -14.268 -10.790  -5.248
  538   3HD1  LEU  65          3HD1      LEU  65 -15.310 -11.889  -4.345
  539   1HD2  LEU  65          1HD2      LEU  65 -16.042  -8.497  -2.963
  540   2HD2  LEU  65          2HD2      LEU  65 -16.792  -9.913  -3.701
  541   3HD2  LEU  65          3HD2      LEU  65 -15.724  -8.881  -4.654
  542    H    GLN  66           H        GLN  66 -14.045  -9.358   1.513
  543    HA   GLN  66           HA       GLN  66 -15.506 -11.535   2.830
  544   1HB   GLN  66          2HB       GLN  66 -13.631 -12.298   3.873
  545   2HB   GLN  66          1HB       GLN  66 -12.876 -11.668   2.431
  546   1HG   GLN  66          2HG       GLN  66 -11.544 -11.017   4.284
  547   2HG   GLN  66          1HG       GLN  66 -12.372  -9.576   3.704
  548   1HE2  GLN  66          1HE2      GLN  66 -12.370  -8.409   5.551
  549   2HE2  GLN  66          2HE2      GLN  66 -13.281  -8.836   6.965
  550    H    LEU  67           H        LEU  67 -13.787  -8.491   3.401
  551    HA   LEU  67           HA       LEU  67 -14.736  -7.998   5.948
  552   1HB   LEU  67          2HB       LEU  67 -13.637  -5.949   5.785
  553   2HB   LEU  67          1HB       LEU  67 -12.746  -7.054   4.778
  554    HG   LEU  67           HG       LEU  67 -14.125  -4.582   4.070
  555   1HD1  LEU  67          1HD1      LEU  67 -12.422  -4.798   2.198
  556   2HD1  LEU  67          2HD1      LEU  67 -11.852  -6.234   3.039
  557   3HD1  LEU  67          3HD1      LEU  67 -11.797  -4.668   3.840
  558   1HD2  LEU  67          1HD2      LEU  67 -14.216  -5.880   1.654
  559   2HD2  LEU  67          2HD2      LEU  67 -15.606  -5.468   2.660
  560   3HD2  LEU  67          3HD2      LEU  67 -14.885  -7.070   2.772
  561    HA   PRO  68           HA       PRO  68 -18.653  -6.040   5.794
  562   1HB   PRO  68          2HB       PRO  68 -18.625  -3.436   6.306
  563   2HB   PRO  68          1HB       PRO  68 -18.004  -4.622   7.482
  564   1HG   PRO  68          2HG       PRO  68 -16.411  -3.133   5.392
  565   2HG   PRO  68          1HG       PRO  68 -16.217  -3.066   7.172
  566   1HD   PRO  68          2HD       PRO  68 -14.760  -4.750   5.801
  567   2HD   PRO  68          1HD       PRO  68 -15.541  -5.318   7.290
  568    H    LYS  69           H        LYS  69 -18.103  -2.882   4.666
  569    HA   LYS  69           HA       LYS  69 -19.106  -1.780   2.928
  570   1HB   LYS  69          2HB       LYS  69 -18.026  -2.165   0.830
  571   2HB   LYS  69          1HB       LYS  69 -16.840  -2.433   2.098
  572   1HG   LYS  69          2HG       LYS  69 -16.755  -4.691   1.734
  573   2HG   LYS  69          1HG       LYS  69 -18.367  -4.754   1.028
  574   1HD   LYS  69          2HD       LYS  69 -16.077  -3.347  -0.321
  575   2HD   LYS  69          1HD       LYS  69 -16.404  -5.064  -0.565
  576   1HE   LYS  69          2HE       LYS  69 -18.692  -4.485  -1.298
  577   2HE   LYS  69          1HE       LYS  69 -18.287  -2.777  -1.135
  578   1HZ   LYS  69          1HZ       LYS  69 -16.883  -4.674  -2.936
  579   2HZ   LYS  69          2HZ       LYS  69 -16.631  -3.004  -2.836
  580   3HZ   LYS  69          3HZ       LYS  69 -18.097  -3.605  -3.428
  581    H    GLY  70           H        GLY  70 -19.665  -2.876   0.283
  582   1HA   GLY  70          2HA       GLY  70 -22.296  -3.923   0.844
  583   2HA   GLY  70          1HA       GLY  70 -21.644  -3.514  -0.738
  584    H    SER  71           H        SER  71 -19.769  -5.532   1.322
  585    HA   SER  71           HA       SER  71 -19.907  -7.699  -0.566
  586   1HB   SER  71          2HB       SER  71 -17.811  -6.955   0.655
  587   2HB   SER  71          1HB       SER  71 -18.498  -7.676   2.111
  588    HG   SER  71           HG       SER  71 -17.842  -8.990  -0.316
  589    H    ASP  72           H        ASP  72 -19.595  -9.879   1.259
  590    HA   ASP  72           HA       ASP  72 -22.166 -10.812   1.498
  591   1HB   ASP  72          2HB       ASP  72 -21.092 -12.298   3.383
  592   2HB   ASP  72          1HB       ASP  72 -20.608 -12.490   1.703
  593    HA   PRO  73           HA       PRO  73 -23.702  -8.250   4.862
  594   1HB   PRO  73          2HB       PRO  73 -26.094  -9.933   4.616
  595   2HB   PRO  73          1HB       PRO  73 -25.910  -8.199   4.403
  596   1HG   PRO  73          2HG       PRO  73 -26.360  -9.835   2.332
  597   2HG   PRO  73          1HG       PRO  73 -25.367  -8.370   2.193
  598   1HD   PRO  73          2HD       PRO  73 -24.512 -11.222   2.432
  599   2HD   PRO  73          1HD       PRO  73 -23.849  -9.914   1.437
  600    H    ALA  74           H        ALA  74 -24.104 -11.751   4.719
  601    HA   ALA  74           HA       ALA  74 -24.760 -12.156   7.426
  602   1HB   ALA  74          1HB       ALA  74 -23.461 -14.088   5.515
  603   2HB   ALA  74          2HB       ALA  74 -25.195 -13.811   5.678
  604   3HB   ALA  74          3HB       ALA  74 -24.283 -14.502   7.019
  605    H    TYR  75           H        TYR  75 -22.106 -10.679   6.577
  606    HA   TYR  75           HA       TYR  75 -20.204 -12.213   8.143
  607   1HB   TYR  75          2HB       TYR  75 -19.536 -11.060   6.024
  608   2HB   TYR  75          1HB       TYR  75 -19.812  -9.523   6.830
  609    HD1  TYR  75           1HD      TYR  75 -18.079  -8.504   7.996
  610    HD2  TYR  75           2HD      TYR  75 -17.829 -12.665   7.147
  611    HE1  TYR  75           1HE      TYR  75 -15.777  -8.536   8.860
  612    HE2  TYR  75           2HE      TYR  75 -15.527 -12.710   8.011
  613    HH   TYR  75           HH       TYR  75 -13.670 -11.165   8.384
  614    H    GLN  76           H        GLN  76 -22.576 -10.052   8.706
  615    HA   GLN  76           HA       GLN  76 -21.280  -8.980  11.122
  616   1HB   GLN  76          2HB       GLN  76 -23.645  -7.877   9.594
  617   2HB   GLN  76          1HB       GLN  76 -22.967  -7.185  11.061
  618   1HG   GLN  76          2HG       GLN  76 -21.634  -5.959   9.798
  619   2HG   GLN  76          1HG       GLN  76 -20.821  -7.440   9.293
  620   1HE2  GLN  76          1HE2      GLN  76 -21.364  -8.384   7.321
  621   2HE2  GLN  76          2HE2      GLN  76 -22.216  -7.514   6.095
  622    H    LYS  77           H        LYS  77 -21.760 -10.358  12.720
  623    HA   LYS  77           HA       LYS  77 -24.601 -10.905  13.216
  624   1HB   LYS  77          2HB       LYS  77 -24.094 -13.179  13.912
  625   2HB   LYS  77          1HB       LYS  77 -23.573 -12.923  12.254
  626   1HG   LYS  77          2HG       LYS  77 -21.668 -12.671  14.557
  627   2HG   LYS  77          1HG       LYS  77 -22.027 -14.226  13.805
  628   1HD   LYS  77          2HD       LYS  77 -21.270 -13.382  11.653
  629   2HD   LYS  77          1HD       LYS  77 -20.969 -11.795  12.362
  630   1HE   LYS  77          2HE       LYS  77 -19.594 -14.366  13.130
  631   2HE   LYS  77          1HE       LYS  77 -18.903 -13.087  12.132
  632   1HZ   LYS  77          1HZ       LYS  77 -18.147 -12.932  14.419
  633   2HZ   LYS  77          2HZ       LYS  77 -19.740 -12.805  14.968
  634   3HZ   LYS  77          3HZ       LYS  77 -19.076 -11.578  14.012
  635    H    ASP  78           H        ASP  78 -25.264 -10.679  15.278
  636    HA   ASP  78           HA       ASP  78 -23.526  -9.376  17.133
  637   1HB   ASP  78          2HB       ASP  78 -26.328 -10.458  17.508
  638   2HB   ASP  78          1HB       ASP  78 -25.488  -9.396  18.635
  639    H    ASP  79           H        ASP  79 -25.006 -12.577  16.929
  640    HA   ASP  79           HA       ASP  79 -22.885 -13.710  18.509
  641   1HB   ASP  79          2HB       ASP  79 -24.495 -14.760  20.147
  642   2HB   ASP  79          1HB       ASP  79 -24.250 -13.027  20.344
  643    H    ALA  80           H        ALA  80 -22.720 -14.640  16.328
  644    HA   ALA  80           HA       ALA  80 -22.895 -16.379  14.877
  645   1HB   ALA  80          1HB       ALA  80 -23.621 -18.523  15.728
  646   2HB   ALA  80          2HB       ALA  80 -24.392 -17.746  17.111
  647   3HB   ALA  80          3HB       ALA  80 -22.637 -17.705  16.943
  648    H    VAL  81           H        VAL  81 -25.087 -14.323  15.170
  649    HA   VAL  81           HA       VAL  81 -27.136 -15.807  13.659
  650    HB   VAL  81           HB       VAL  81 -27.642 -13.609  15.671
  651   1HG1  VAL  81          1HG1      VAL  81 -30.027 -13.997  15.178
  652   2HG1  VAL  81          2HG1      VAL  81 -29.560 -15.084  13.871
  653   3HG1  VAL  81          3HG1      VAL  81 -29.143 -13.371  13.787
  654   1HG2  VAL  81          1HG2      VAL  81 -28.349 -16.540  15.678
  655   2HG2  VAL  81          2HG2      VAL  81 -28.938 -15.360  16.848
  656   3HG2  VAL  81          3HG2      VAL  81 -27.215 -15.722  16.753
  657    H    LYS  82           H        LYS  82 -27.250 -15.095  11.650
  658    HA   LYS  82           HA       LYS  82 -26.066 -12.627  10.828
  659   1HB   LYS  82          2HB       LYS  82 -26.544 -13.287   8.620
  660   2HB   LYS  82          1HB       LYS  82 -26.216 -14.788   9.471
  661   1HG   LYS  82          2HG       LYS  82 -28.954 -13.704   8.832
  662   2HG   LYS  82          1HG       LYS  82 -28.120 -14.979   7.945
  663   1HD   LYS  82          2HD       LYS  82 -28.140 -16.401   9.906
  664   2HD   LYS  82          1HD       LYS  82 -28.863 -15.108  10.865
  665   1HE   LYS  82          2HE       LYS  82 -30.542 -16.740  10.185
  666   2HE   LYS  82          1HE       LYS  82 -30.853 -15.166   9.458
  667   1HZ   LYS  82          1HZ       LYS  82 -29.552 -17.467   8.104
  668   2HZ   LYS  82          2HZ       LYS  82 -29.857 -15.957   7.404
  669   3HZ   LYS  82          3HZ       LYS  82 -31.145 -16.953   7.862
  670    H    LYS  83           H        LYS  83 -27.092 -10.831   9.889
  671    HA   LYS  83           HA       LYS  83 -29.415  -9.940  11.201
  672   1HB   LYS  83          2HB       LYS  83 -27.965  -8.904   8.766
  673   2HB   LYS  83          1HB       LYS  83 -29.342  -8.077   9.481
  674   1HG   LYS  83          2HG       LYS  83 -26.790  -8.711  10.946
  675   2HG   LYS  83          1HG       LYS  83 -27.149  -7.164  10.177
  676   1HD   LYS  83          2HD       LYS  83 -29.154  -6.965  11.625
  677   2HD   LYS  83          1HD       LYS  83 -28.672  -8.455  12.439
  678   1HE   LYS  83          2HE       LYS  83 -27.968  -6.521  13.725
  679   2HE   LYS  83          1HE       LYS  83 -26.566  -7.396  13.112
  680   1HZ   LYS  83          1HZ       LYS  83 -26.413  -5.764  11.311
  681   2HZ   LYS  83          2HZ       LYS  83 -26.262  -5.036  12.831
  682   3HZ   LYS  83          3HZ       LYS  83 -27.713  -4.905  11.971
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1  -4.614  17.317  -0.678
    2   2H    MET   1          2HT       MET   1  -4.861  15.661  -0.444
    3   3H    MET   1          3HT       MET   1  -4.808  16.294  -2.012
    4    HA   MET   1           HA       MET   1  -2.763  15.149  -1.478
    5   1HB   MET   1          2HB       MET   1  -2.773  17.139  -2.982
    6   2HB   MET   1          1HB       MET   1  -2.383  18.148  -1.596
    7   1HG   MET   1          2HG       MET   1  -0.297  16.864  -1.293
    8   2HG   MET   1          1HG       MET   1  -0.683  15.950  -2.751
    9   1HE   MET   1          1HE       MET   1  -0.597  18.766  -5.490
   10   2HE   MET   1          2HE       MET   1  -2.002  18.240  -4.561
   11   3HE   MET   1          3HE       MET   1  -0.855  17.050  -5.177
   12    H    TYR   2           H        TYR   2  -2.309  14.255   0.467
   13    HA   TYR   2           HA       TYR   2  -1.035  16.007   2.441
   14   1HB   TYR   2          2HB       TYR   2  -3.134  13.926   3.084
   15   2HB   TYR   2          1HB       TYR   2  -2.151  14.762   4.281
   16    HD1  TYR   2           1HD      TYR   2  -2.562  17.101   4.815
   17    HD2  TYR   2           2HD      TYR   2  -4.929  15.076   1.918
   18    HE1  TYR   2           1HE      TYR   2  -4.215  18.918   4.905
   19    HE2  TYR   2           2HE      TYR   2  -6.589  16.888   1.998
   20    HH   TYR   2           HH       TYR   2  -5.977  19.877   3.498
   21    H    ASP   3           H        ASP   3   0.518  14.976   3.770
   22    HA   ASP   3           HA       ASP   3   1.536  12.471   2.629
   23   1HB   ASP   3          2HB       ASP   3   2.906  14.672   4.179
   24   2HB   ASP   3          1HB       ASP   3   3.684  13.154   3.751
   25    H    TRP   4           H        TRP   4   2.361  10.834   4.033
   26    HA   TRP   4           HA       TRP   4   2.015  10.969   6.856
   27   1HB   TRP   4          2HB       TRP   4   0.275   9.178   7.004
   28   2HB   TRP   4          1HB       TRP   4  -0.324  10.704   6.363
   29    HD1  TRP   4           HD       TRP   4   0.837   7.246   5.037
   30    HE1  TRP   4           1HE      TRP   4  -0.500   6.731   2.900
   31    HE3  TRP   4           3HE      TRP   4  -1.763  11.630   4.630
   32    HZ2  TRP   4           2HZ      TRP   4  -2.406   8.013   1.259
   33    HZ3  TRP   4           3HZ      TRP   4  -3.323  11.905   2.748
   34    HH2  TRP   4           HH       TRP   4  -3.636  10.133   1.099
   35    H    ASN   5           H        ASN   5   3.429   9.780   4.181
   36    HA   ASN   5           HA       ASN   5   4.092   7.157   5.256
   37   1HB   ASN   5          2HB       ASN   5   4.886   8.520   2.674
   38   2HB   ASN   5          1HB       ASN   5   5.377   6.891   3.128
   39   1HD2  ASN   5          1HD2      ASN   5   3.862   5.241   3.137
   40   2HD2  ASN   5          2HD2      ASN   5   2.335   5.390   2.344
   41    H    ILE   6           H        ILE   6   4.926   9.580   6.616
   42    HA   ILE   6           HA       ILE   6   7.746   9.898   6.190
   43    HB   ILE   6           HB       ILE   6   6.206  10.781   8.614
   44   1HG1  ILE   6          2HG1      ILE   6   5.026  11.435   6.519
   45   2HG1  ILE   6          1HG1      ILE   6   5.598  12.800   7.462
   46   1HG2  ILE   6          1HG2      ILE   6   8.675  11.826   7.245
   47   2HG2  ILE   6          2HG2      ILE   6   8.585  11.039   8.820
   48   3HG2  ILE   6          3HG2      ILE   6   7.858  12.628   8.587
   49   1HD1  ILE   6          1HD1      ILE   6   6.897  11.669   5.003
   50   2HD1  ILE   6          2HD1      ILE   6   7.518  13.014   5.956
   51   3HD1  ILE   6          3HD1      ILE   6   5.979  13.170   5.109
   52    H    ALA   7           H        ALA   7   5.864   7.594   7.734
   53    HA   ALA   7           HA       ALA   7   7.443   7.003  10.004
   54   1HB   ALA   7          1HB       ALA   7   5.119   6.230   9.715
   55   2HB   ALA   7          2HB       ALA   7   6.228   4.915  10.104
   56   3HB   ALA   7          3HB       ALA   7   5.664   5.132   8.446
   57    H    ALA   8           H        ALA   8   7.884   6.426   6.666
   58    HA   ALA   8           HA       ALA   8   9.483   4.119   6.780
   59   1HB   ALA   8          1HB       ALA   8  10.160   4.683   4.515
   60   2HB   ALA   8          2HB       ALA   8   9.489   6.303   4.705
   61   3HB   ALA   8          3HB       ALA   8   8.420   4.899   4.716
   62    H    LYS   9           H        LYS   9  11.573   3.826   7.277
   63    HA   LYS   9           HA       LYS   9  13.131   6.180   8.060
   64   1HB   LYS   9          2HB       LYS   9  13.595   3.233   8.572
   65   2HB   LYS   9          1HB       LYS   9  14.625   4.531   9.161
   66   1HG   LYS   9          2HG       LYS   9  11.720   4.170   9.863
   67   2HG   LYS   9          1HG       LYS   9  13.085   3.694  10.876
   68   1HD   LYS   9          2HD       LYS   9  12.668   6.509   9.903
   69   2HD   LYS   9          1HD       LYS   9  12.007   5.916  11.428
   70   1HE   LYS   9          2HE       LYS   9  14.262   5.368  12.193
   71   2HE   LYS   9          1HE       LYS   9  14.926   5.934  10.661
   72   1HZ   LYS   9          1HZ       LYS   9  15.121   7.599  12.408
   73   2HZ   LYS   9          2HZ       LYS   9  13.442   7.611  12.612
   74   3HZ   LYS   9          3HZ       LYS   9  14.120   8.147  11.159
   75    H    SER  10           H        SER  10  13.961   3.048   6.607
   76    HA   SER  10           HA       SER  10  16.160   4.188   5.157
   77   1HB   SER  10          2HB       SER  10  14.924   1.427   5.100
   78   2HB   SER  10          1HB       SER  10  16.382   1.876   4.218
   79    HG   SER  10           HG       SER  10  16.657   2.641   6.753
   80    H    GLN  11           H        GLN  11  16.398   3.948   2.805
   81    HA   GLN  11           HA       GLN  11  14.208   5.129   1.437
   82   1HB   GLN  11          2HB       GLN  11  16.472   5.656   0.785
   83   2HB   GLN  11          1HB       GLN  11  16.809   3.968   0.430
   84   1HG   GLN  11          2HG       GLN  11  16.458   4.744  -1.675
   85   2HG   GLN  11          1HG       GLN  11  14.811   4.271  -1.258
   86   1HE2  GLN  11          1HE2      GLN  11  15.766   6.247  -3.177
   87   2HE2  GLN  11          2HE2      GLN  11  15.042   7.747  -2.722
   88    H    GLU  12           H        GLU  12  15.587   1.865   1.440
   89    HA   GLU  12           HA       GLU  12  14.040   0.833  -0.667
   90   1HB   GLU  12          2HB       GLU  12  14.636  -1.374   0.208
   91   2HB   GLU  12          1HB       GLU  12  16.032  -0.303   0.168
   92   1HG   GLU  12          2HG       GLU  12  16.389  -0.712   2.304
   93   2HG   GLU  12          1HG       GLU  12  14.829   0.020   2.679
   94    H    GLU  13           H        GLU  13  13.297   1.492   2.639
   95    HA   GLU  13           HA       GLU  13  10.984  -0.215   2.744
   96   1HB   GLU  13          2HB       GLU  13  11.753   2.055   4.585
   97   2HB   GLU  13          1HB       GLU  13  10.567   0.800   4.914
   98   1HG   GLU  13          2HG       GLU  13  12.373  -0.879   4.798
   99   2HG   GLU  13          1HG       GLU  13  13.533   0.431   4.589
  100    H    ARG  14           H        ARG  14  11.669   3.042   1.760
  101    HA   ARG  14           HA       ARG  14   9.034   4.070   2.011
  102   1HB   ARG  14          2HB       ARG  14  11.085   5.031   0.024
  103   2HB   ARG  14          1HB       ARG  14   9.807   5.954   0.800
  104   1HG   ARG  14          2HG       ARG  14  10.968   5.760   2.941
  105   2HG   ARG  14          1HG       ARG  14  12.246   4.832   2.153
  106   1HD   ARG  14          2HD       ARG  14  12.688   6.748   0.675
  107   2HD   ARG  14          1HD       ARG  14  11.464   7.675   1.538
  108    HE   ARG  14           HE       ARG  14  13.548   6.607   3.218
  109   1HH1  ARG  14          1HH1      ARG  14  12.536   9.281   1.227
  110   2HH1  ARG  14          2HH1      ARG  14  13.567  10.427   2.018
  111   1HH2  ARG  14          1HH2      ARG  14  14.908   8.107   4.265
  112   2HH2  ARG  14          2HH2      ARG  14  14.917   9.760   3.744
  113    H    ASP  15           H        ASP  15  10.855   2.764  -0.738
  114    HA   ASP  15           HA       ASP  15   8.916   3.181  -2.707
  115   1HB   ASP  15          2HB       ASP  15  10.979   0.973  -2.595
  116   2HB   ASP  15          1HB       ASP  15  10.151   1.553  -4.036
  117    H    LYS  16           H        LYS  16   9.591   0.216  -0.840
  118    HA   LYS  16           HA       LYS  16   7.597  -1.364  -1.990
  119   1HB   LYS  16          2HB       LYS  16   8.530  -1.589   0.866
  120   2HB   LYS  16          1HB       LYS  16   7.889  -2.866  -0.156
  121   1HG   LYS  16          2HG       LYS  16  10.019  -2.029  -1.619
  122   2HG   LYS  16          1HG       LYS  16  10.596  -1.784   0.030
  123   1HD   LYS  16          2HD       LYS  16  11.210  -3.966  -0.283
  124   2HD   LYS  16          1HD       LYS  16   9.588  -4.196   0.374
  125   1HE   LYS  16          2HE       LYS  16   9.645  -5.600  -1.491
  126   2HE   LYS  16          1HE       LYS  16   8.802  -4.157  -2.064
  127   1HZ   LYS  16          1HZ       LYS  16  11.680  -4.762  -2.494
  128   2HZ   LYS  16          2HZ       LYS  16  10.869  -3.384  -3.044
  129   3HZ   LYS  16          3HZ       LYS  16  10.456  -4.905  -3.655
  130    H    VAL  17           H        VAL  17   7.429   0.762   0.842
  131    HA   VAL  17           HA       VAL  17   4.709  -0.002   1.412
  132    HB   VAL  17           HB       VAL  17   6.273   2.315   2.551
  133   1HG1  VAL  17          1HG1      VAL  17   3.716   0.957   3.380
  134   2HG1  VAL  17          2HG1      VAL  17   3.938   2.642   2.905
  135   3HG1  VAL  17          3HG1      VAL  17   4.623   2.056   4.421
  136   1HG2  VAL  17          1HG2      VAL  17   5.885  -0.478   3.631
  137   2HG2  VAL  17          2HG2      VAL  17   6.734   0.841   4.439
  138   3HG2  VAL  17          3HG2      VAL  17   7.380   0.158   2.946
  139    H    ASN  18           H        ASN  18   6.280   2.569  -0.365
  140    HA   ASN  18           HA       ASN  18   4.057   4.323  -0.507
  141   1HB   ASN  18          2HB       ASN  18   6.539   3.984  -2.178
  142   2HB   ASN  18          1HB       ASN  18   5.286   5.129  -2.642
  143   1HD2  ASN  18          1HD2      ASN  18   6.031   4.419   0.687
  144   2HD2  ASN  18          2HD2      ASN  18   6.769   5.936   1.051
  145    H    VAL  19           H        VAL  19   5.258   1.763  -2.631
  146    HA   VAL  19           HA       VAL  19   3.176   2.065  -4.554
  147    HB   VAL  19           HB       VAL  19   5.534   0.948  -4.784
  148   1HG1  VAL  19          1HG1      VAL  19   5.083  -0.755  -3.034
  149   2HG1  VAL  19          2HG1      VAL  19   5.571  -1.439  -4.584
  150   3HG1  VAL  19          3HG1      VAL  19   3.876  -1.473  -4.102
  151   1HG2  VAL  19          1HG2      VAL  19   4.232   1.196  -6.702
  152   2HG2  VAL  19          2HG2      VAL  19   2.991   0.093  -6.117
  153   3HG2  VAL  19          3HG2      VAL  19   4.556  -0.534  -6.629
  154    H    ASP  20           H        ASP  20   3.491   0.453  -1.528
  155    HA   ASP  20           HA       ASP  20   1.393  -1.470  -1.953
  156   1HB   ASP  20          2HB       ASP  20   2.878  -2.241  -0.351
  157   2HB   ASP  20          1HB       ASP  20   3.123  -0.642   0.342
  158    H    LEU  21           H        LEU  21   1.754   1.703  -0.495
  159    HA   LEU  21           HA       LEU  21  -0.750   1.902   0.743
  160   1HB   LEU  21          2HB       LEU  21   0.212   3.815   1.392
  161   2HB   LEU  21          1HB       LEU  21   1.519   3.530   0.263
  162    HG   LEU  21           HG       LEU  21  -0.569   4.584  -1.272
  163   1HD1  LEU  21          1HD1      LEU  21  -0.991   6.737  -0.131
  164   2HD1  LEU  21          2HD1      LEU  21  -0.217   6.086   1.312
  165   3HD1  LEU  21          3HD1      LEU  21  -1.702   5.357   0.704
  166   1HD2  LEU  21          1HD2      LEU  21   2.122   5.379  -0.388
  167   2HD2  LEU  21          2HD2      LEU  21   1.087   6.662  -1.016
  168   3HD2  LEU  21          3HD2      LEU  21   1.440   5.248  -2.012
  169    H    ALA  22           H        ALA  22   0.445   2.611  -2.459
  170    HA   ALA  22           HA       ALA  22  -1.690   3.867  -3.622
  171   1HB   ALA  22          1HB       ALA  22  -0.873   2.807  -5.744
  172   2HB   ALA  22          2HB       ALA  22   0.241   1.854  -4.758
  173   3HB   ALA  22          3HB       ALA  22   0.375   3.611  -4.789
  174    H    ALA  23           H        ALA  23  -1.043   0.374  -3.778
  175    HA   ALA  23           HA       ALA  23  -3.356  -0.529  -4.871
  176   1HB   ALA  23          1HB       ALA  23  -1.747  -1.898  -2.728
  177   2HB   ALA  23          2HB       ALA  23  -1.393  -1.916  -4.455
  178   3HB   ALA  23          3HB       ALA  23  -2.866  -2.675  -3.851
  179    H    SER  24           H        SER  24  -2.843   0.593  -1.626
  180    HA   SER  24           HA       SER  24  -5.073  -0.640  -0.398
  181   1HB   SER  24          2HB       SER  24  -4.047   2.043   0.470
  182   2HB   SER  24          1HB       SER  24  -4.641   0.710   1.458
  183    HG   SER  24           HG       SER  24  -2.319   0.421  -0.110
  184    H    GLY  25           H        GLY  25  -4.764   2.792  -1.339
  185   1HA   GLY  25          2HA       GLY  25  -7.511   3.328  -0.924
  186   2HA   GLY  25          1HA       GLY  25  -6.374   4.368  -1.768
  187    H    VAL  26           H        VAL  26  -5.625   2.709  -3.840
  188    HA   VAL  26           HA       VAL  26  -7.412   3.305  -5.796
  189    HB   VAL  26           HB       VAL  26  -6.322   1.472  -7.115
  190   1HG1  VAL  26          1HG1      VAL  26  -5.433   3.734  -7.094
  191   2HG1  VAL  26          2HG1      VAL  26  -4.134   2.543  -7.161
  192   3HG1  VAL  26          3HG1      VAL  26  -4.510   3.352  -5.640
  193   1HG2  VAL  26          1HG2      VAL  26  -5.164   0.918  -4.465
  194   2HG2  VAL  26          2HG2      VAL  26  -4.241   0.582  -5.930
  195   3HG2  VAL  26          3HG2      VAL  26  -5.801  -0.199  -5.669
  196    H    ALA  27           H        ALA  27  -7.090  -0.026  -4.472
  197    HA   ALA  27           HA       ALA  27  -9.661  -0.717  -5.667
  198   1HB   ALA  27          1HB       ALA  27  -7.662  -2.437  -4.213
  199   2HB   ALA  27          2HB       ALA  27  -7.800  -2.252  -5.961
  200   3HB   ALA  27          3HB       ALA  27  -9.105  -3.009  -5.049
  201    H    TYR  28           H        TYR  28  -8.175  -0.862  -2.443
  202    HA   TYR  28           HA       TYR  28 -10.350  -1.910  -1.072
  203   1HB   TYR  28          2HB       TYR  28  -7.846  -0.923  -0.372
  204   2HB   TYR  28          1HB       TYR  28  -8.978   0.078   0.533
  205    HD1  TYR  28           1HD      TYR  28  -8.142  -0.832   2.686
  206    HD2  TYR  28           2HD      TYR  28  -9.815  -3.384  -0.287
  207    HE1  TYR  28           1HE      TYR  28  -8.409  -2.603   4.364
  208    HE2  TYR  28           2HE      TYR  28 -10.074  -5.165   1.387
  209    HH   TYR  28           HH       TYR  28  -9.156  -5.828   3.530
  210    H    LYS  29           H        LYS  29  -9.491   1.576  -1.183
  211    HA   LYS  29           HA       LYS  29 -11.596   2.560   0.235
  212   1HB   LYS  29          2HB       LYS  29  -9.822   4.009  -0.527
  213   2HB   LYS  29          1HB       LYS  29 -10.314   3.796  -2.202
  214   1HG   LYS  29          2HG       LYS  29 -12.419   4.934  -1.743
  215   2HG   LYS  29          1HG       LYS  29 -11.948   5.131  -0.054
  216   1HD   LYS  29          2HD       LYS  29 -11.508   7.189  -1.188
  217   2HD   LYS  29          1HD       LYS  29  -9.960   6.420  -0.840
  218   1HE   LYS  29          2HE       LYS  29 -10.063   7.372  -3.113
  219   2HE   LYS  29          1HE       LYS  29  -9.792   5.629  -3.116
  220   1HZ   LYS  29          1HZ       LYS  29 -12.422   6.944  -3.542
  221   2HZ   LYS  29          2HZ       LYS  29 -12.109   5.284  -3.626
  222   3HZ   LYS  29          3HZ       LYS  29 -11.434   6.330  -4.770
  223    H    GLU  30           H        GLU  30 -11.676   2.012  -3.306
  224    HA   GLU  30           HA       GLU  30 -14.103   2.894  -4.041
  225   1HB   GLU  30          2HB       GLU  30 -12.973   0.159  -4.675
  226   2HB   GLU  30          1HB       GLU  30 -14.334   0.882  -5.521
  227   1HG   GLU  30          2HG       GLU  30 -11.582   2.087  -5.383
  228   2HG   GLU  30          1HG       GLU  30 -12.179   1.094  -6.713
  229    H    ARG  31           H        ARG  31 -13.438   0.240  -1.966
  230    HA   ARG  31           HA       ARG  31 -16.283  -0.012  -1.253
  231   1HB   ARG  31          2HB       ARG  31 -14.677  -1.967  -2.400
  232   2HB   ARG  31          1HB       ARG  31 -14.558  -2.323  -0.684
  233   1HG   ARG  31          2HG       ARG  31 -16.328  -3.634  -1.540
  234   2HG   ARG  31          1HG       ARG  31 -17.062  -2.332  -0.596
  235   1HD   ARG  31          2HD       ARG  31 -18.254  -2.683  -2.700
  236   2HD   ARG  31          1HD       ARG  31 -17.512  -1.085  -2.642
  237    HE   ARG  31           HE       ARG  31 -15.648  -2.564  -3.909
  238   1HH1  ARG  31          1HH1      ARG  31 -19.069  -2.130  -4.421
  239   2HH1  ARG  31          2HH1      ARG  31 -18.973  -2.378  -6.131
  240   1HH2  ARG  31          1HH2      ARG  31 -15.516  -2.892  -6.157
  241   2HH2  ARG  31          2HH2      ARG  31 -16.954  -2.813  -7.118
  242    H    LEU  32           H        LEU  32 -16.476  -0.757   1.152
  243    HA   LEU  32           HA       LEU  32 -15.845  -0.855   3.333
  244   1HB   LEU  32          2HB       LEU  32 -13.134  -0.078   2.281
  245   2HB   LEU  32          1HB       LEU  32 -13.493  -0.288   3.974
  246    HG   LEU  32           HG       LEU  32 -13.796  -2.625   3.715
  247   1HD1  LEU  32          1HD1      LEU  32 -14.993  -2.787   1.648
  248   2HD1  LEU  32          2HD1      LEU  32 -13.503  -3.721   1.497
  249   3HD1  LEU  32          3HD1      LEU  32 -13.626  -2.127   0.752
  250   1HD2  LEU  32          1HD2      LEU  32 -11.600  -3.184   2.540
  251   2HD2  LEU  32          2HD2      LEU  32 -11.545  -2.103   3.934
  252   3HD2  LEU  32          3HD2      LEU  32 -11.449  -1.440   2.296
  253    H    ASN  33           H        ASN  33 -14.847   1.799   1.327
  254    HA   ASN  33           HA       ASN  33 -15.141   4.023   1.499
  255   1HB   ASN  33          2HB       ASN  33 -16.309   3.775   4.251
  256   2HB   ASN  33          1HB       ASN  33 -16.648   4.951   2.991
  257   1HD2  ASN  33          1HD2      ASN  33 -16.867   2.838   0.946
  258   2HD2  ASN  33          2HD2      ASN  33 -18.408   2.102   1.210
  259    H    ILE  34           H        ILE  34 -12.879   3.965   1.564
  260    HA   ILE  34           HA       ILE  34 -11.665   4.347   4.221
  261    HB   ILE  34           HB       ILE  34 -10.666   3.112   1.732
  262   1HG1  ILE  34          2HG1      ILE  34  -9.336   1.806   3.365
  263   2HG1  ILE  34          1HG1      ILE  34  -9.963   2.825   4.655
  264   1HG2  ILE  34          1HG2      ILE  34  -8.871   4.858   3.396
  265   2HG2  ILE  34          2HG2      ILE  34  -9.219   5.007   1.672
  266   3HG2  ILE  34          3HG2      ILE  34  -8.299   3.623   2.270
  267   1HD1  ILE  34          1HD1      ILE  34 -12.212   2.047   4.192
  268   2HD1  ILE  34          2HD1      ILE  34 -11.127   0.695   4.525
  269   3HD1  ILE  34          3HD1      ILE  34 -11.605   1.055   2.866
  270    HA   PRO  35           HA       PRO  35 -11.306   8.586   2.994
  271   1HB   PRO  35          2HB       PRO  35 -10.139   9.576   5.166
  272   2HB   PRO  35          1HB       PRO  35 -11.767   8.892   5.237
  273   1HG   PRO  35          2HG       PRO  35  -9.162   7.673   6.060
  274   2HG   PRO  35          1HG       PRO  35 -10.734   7.610   6.875
  275   1HD   PRO  35          2HD       PRO  35  -9.701   5.617   5.243
  276   2HD   PRO  35          1HD       PRO  35 -11.419   5.819   5.644
  277    H    VAL  36           H        VAL  36  -9.332   7.164   1.574
  278    HA   VAL  36           HA       VAL  36  -7.053   8.996   1.916
  279    HB   VAL  36           HB       VAL  36  -5.496   7.340   1.247
  280   1HG1  VAL  36          1HG1      VAL  36  -7.409   6.223   3.286
  281   2HG1  VAL  36          2HG1      VAL  36  -6.024   7.272   3.585
  282   3HG1  VAL  36          3HG1      VAL  36  -5.774   5.622   3.010
  283   1HG2  VAL  36          1HG2      VAL  36  -6.621   6.155  -0.441
  284   2HG2  VAL  36          2HG2      VAL  36  -7.906   5.653   0.657
  285   3HG2  VAL  36          3HG2      VAL  36  -6.287   4.971   0.822
  286    H    ILE  37           H        ILE  37  -6.001   9.689   0.043
  287    HA   ILE  37           HA       ILE  37  -7.736   9.888  -2.261
  288    HB   ILE  37           HB       ILE  37  -4.938  10.980  -2.004
  289   1HG1  ILE  37          2HG1      ILE  37  -6.221  11.762  -0.094
  290   2HG1  ILE  37          1HG1      ILE  37  -5.999  13.083  -1.236
  291   1HG2  ILE  37          1HG2      ILE  37  -5.777  12.657  -3.619
  292   2HG2  ILE  37          2HG2      ILE  37  -7.294  11.761  -3.715
  293   3HG2  ILE  37          3HG2      ILE  37  -5.791  11.012  -4.256
  294   1HD1  ILE  37          1HD1      ILE  37  -8.236  13.133  -0.372
  295   2HD1  ILE  37          2HD1      ILE  37  -8.495  11.451  -0.837
  296   3HD1  ILE  37          3HD1      ILE  37  -8.286  12.688  -2.077
  297    H    ALA  38           H        ALA  38  -7.697   8.562  -3.961
  298    HA   ALA  38           HA       ALA  38  -5.614   6.586  -4.228
  299   1HB   ALA  38          1HB       ALA  38  -7.963   7.135  -6.039
  300   2HB   ALA  38          2HB       ALA  38  -7.977   6.038  -4.656
  301   3HB   ALA  38          3HB       ALA  38  -6.946   5.694  -6.045
  302    H    GLU  39           H        GLU  39  -6.914   9.102  -6.390
  303    HA   GLU  39           HA       GLU  39  -5.044   9.000  -8.382
  304   1HB   GLU  39          2HB       GLU  39  -5.445  11.533  -8.610
  305   2HB   GLU  39          1HB       GLU  39  -6.816  10.445  -8.774
  306   1HG   GLU  39          2HG       GLU  39  -7.489  10.921  -6.487
  307   2HG   GLU  39          1HG       GLU  39  -6.091  11.975  -6.285
  308    H    GLN  40           H        GLN  40  -4.500   9.971  -5.153
  309    HA   GLN  40           HA       GLN  40  -2.235  11.653  -5.545
  310   1HB   GLN  40          2HB       GLN  40  -3.738  10.753  -3.359
  311   2HB   GLN  40          1HB       GLN  40  -2.124  10.101  -3.101
  312   1HG   GLN  40          2HG       GLN  40  -1.234  12.414  -3.431
  313   2HG   GLN  40          1HG       GLN  40  -2.902  12.985  -3.447
  314   1HE2  GLN  40          1HE2      GLN  40  -4.111  12.923  -1.550
  315   2HE2  GLN  40          2HE2      GLN  40  -3.373  12.741   0.002
  316    H    VAL  41           H        VAL  41  -2.795   8.262  -5.354
  317    HA   VAL  41           HA       VAL  41   0.034   7.588  -5.296
  318    HB   VAL  41           HB       VAL  41  -0.551   5.447  -4.720
  319   1HG1  VAL  41          1HG1      VAL  41  -2.427   5.477  -3.170
  320   2HG1  VAL  41          2HG1      VAL  41  -3.020   6.968  -3.898
  321   3HG1  VAL  41          3HG1      VAL  41  -1.480   6.960  -3.038
  322   1HG2  VAL  41          1HG2      VAL  41  -3.099   5.832  -6.281
  323   2HG2  VAL  41          2HG2      VAL  41  -2.757   4.405  -5.306
  324   3HG2  VAL  41          3HG2      VAL  41  -1.730   4.798  -6.684
  325    H    ALA  42           H        ALA  42  -2.527   8.034  -7.502
  326    HA   ALA  42           HA       ALA  42  -1.650   6.293  -9.566
  327   1HB   ALA  42          1HB       ALA  42  -3.959   7.008  -9.408
  328   2HB   ALA  42          2HB       ALA  42  -3.269   7.462 -10.966
  329   3HB   ALA  42          3HB       ALA  42  -3.475   8.679  -9.705
  330    H    ARG  43           H        ARG  43  -0.558   9.350  -8.501
  331    HA   ARG  43           HA       ARG  43   0.542  10.094 -11.086
  332   1HB   ARG  43          2HB       ARG  43   1.440  12.074  -9.833
  333   2HB   ARG  43          1HB       ARG  43  -0.308  11.916  -9.812
  334   1HG   ARG  43          2HG       ARG  43   0.155  12.474  -7.632
  335   2HG   ARG  43          1HG       ARG  43   0.080  10.716  -7.548
  336   1HD   ARG  43          2HD       ARG  43   1.997  11.617  -6.311
  337   2HD   ARG  43          1HD       ARG  43   2.500  10.581  -7.645
  338    HE   ARG  43           HE       ARG  43   2.417  13.299  -8.449
  339   1HH1  ARG  43          1HH1      ARG  43   4.306  11.020  -6.612
  340   2HH1  ARG  43          2HH1      ARG  43   5.797  11.871  -6.844
  341   1HH2  ARG  43          1HH2      ARG  43   4.373  14.426  -8.762
  342   2HH2  ARG  43          2HH2      ARG  43   5.835  13.808  -8.066
  343    H    GLU  44           H        GLU  44   1.453   8.049  -8.651
  344    HA   GLU  44           HA       GLU  44   4.300   8.399  -9.303
  345   1HB   GLU  44          2HB       GLU  44   4.468   7.108  -6.956
  346   2HB   GLU  44          1HB       GLU  44   4.491   8.860  -7.099
  347   1HG   GLU  44          2HG       GLU  44   2.177   9.002  -6.541
  348   2HG   GLU  44          1HG       GLU  44   2.002   7.254  -6.620
  349    H    GLN  45           H        GLN  45   2.350   5.921  -7.709
  350    HA   GLN  45           HA       GLN  45   2.570   3.611  -7.812
  351   1HB   GLN  45          2HB       GLN  45   1.737   2.777 -10.042
  352   2HB   GLN  45          1HB       GLN  45   0.714   3.966  -9.250
  353   1HG   GLN  45          2HG       GLN  45   1.664   5.711 -10.703
  354   2HG   GLN  45          1HG       GLN  45   2.617   4.478 -11.525
  355   1HE2  GLN  45          1HE2      GLN  45   0.478   2.494 -11.343
  356   2HE2  GLN  45          2HE2      GLN  45  -0.694   2.949 -12.527
  357    HA   PRO  46           HA       PRO  46   7.054   3.728  -9.195
  358   1HB   PRO  46          2HB       PRO  46   6.868   1.522  -7.184
  359   2HB   PRO  46          1HB       PRO  46   8.147   2.718  -7.427
  360   1HG   PRO  46          2HG       PRO  46   6.394   2.997  -5.444
  361   2HG   PRO  46          1HG       PRO  46   6.955   4.403  -6.367
  362   1HD   PRO  46          2HD       PRO  46   4.336   3.004  -6.458
  363   2HD   PRO  46          1HD       PRO  46   4.716   4.711  -6.747
  364    H    GLU  47           H        GLU  47   7.963   2.498 -10.717
  365    HA   GLU  47           HA       GLU  47   6.438   0.328 -11.853
  366   1HB   GLU  47          2HB       GLU  47   7.489   1.893 -13.361
  367   2HB   GLU  47          1HB       GLU  47   9.067   1.585 -12.649
  368   1HG   GLU  47          2HG       GLU  47   8.873  -0.778 -13.435
  369   2HG   GLU  47          1HG       GLU  47   7.406  -0.308 -14.293
  370    H    ASN  48           H        ASN  48   9.771   0.656 -10.601
  371    HA   ASN  48           HA       ASN  48  10.282  -2.136 -10.652
  372   1HB   ASN  48          2HB       ASN  48  11.686   0.070  -9.130
  373   2HB   ASN  48          1HB       ASN  48  12.307  -1.563  -9.360
  374   1HD2  ASN  48          1HD2      ASN  48  13.423   1.008 -10.171
  375   2HD2  ASN  48          2HD2      ASN  48  13.639   0.914 -11.882
  376    H    LEU  49           H        LEU  49   7.883  -1.204  -9.118
  377    HA   LEU  49           HA       LEU  49   8.184  -2.965  -6.889
  378   1HB   LEU  49          2HB       LEU  49   8.662  -0.223  -6.465
  379   2HB   LEU  49          1HB       LEU  49   7.044  -0.516  -5.860
  380    HG   LEU  49           HG       LEU  49   8.357  -0.835  -3.977
  381   1HD1  LEU  49          1HD1      LEU  49   8.343  -3.199  -3.471
  382   2HD1  LEU  49          2HD1      LEU  49   8.180  -3.582  -5.186
  383   3HD1  LEU  49          3HD1      LEU  49   6.879  -2.743  -4.341
  384   1HD2  LEU  49          1HD2      LEU  49  10.514  -0.709  -5.179
  385   2HD2  LEU  49          2HD2      LEU  49  10.337  -2.410  -5.612
  386   3HD2  LEU  49          3HD2      LEU  49  10.493  -1.942  -3.918
  387    H    ARG  50           H        ARG  50   6.557  -1.850  -9.406
  388    HA   ARG  50           HA       ARG  50   3.916  -1.432  -8.542
  389   1HB   ARG  50          2HB       ARG  50   4.816  -0.893 -10.811
  390   2HB   ARG  50          1HB       ARG  50   4.835  -2.613 -11.169
  391   1HG   ARG  50          2HG       ARG  50   2.428  -2.720 -10.929
  392   2HG   ARG  50          1HG       ARG  50   2.380  -1.015 -10.477
  393   1HD   ARG  50          2HD       ARG  50   3.411  -0.487 -12.692
  394   2HD   ARG  50          1HD       ARG  50   3.210  -2.183 -13.127
  395    HE   ARG  50           HE       ARG  50   0.724  -1.316 -12.319
  396   1HH1  ARG  50          1HH1      ARG  50   3.021  -0.450 -14.795
  397   2HH1  ARG  50          2HH1      ARG  50   1.811   0.098 -15.905
  398   1HH2  ARG  50          1HH2      ARG  50  -0.873  -0.600 -13.778
  399   2HH2  ARG  50          2HH2      ARG  50  -0.400   0.013 -15.328
  400    H    THR  51           H        THR  51   5.742  -4.321  -9.348
  401    HA   THR  51           HA       THR  51   3.750  -6.221  -9.477
  402    HB   THR  51           HB       THR  51   6.407  -6.622  -8.089
  403    HG1  THR  51           1HG      THR  51   6.605  -5.682 -10.216
  404   1HG2  THR  51          1HG2      THR  51   4.824  -8.476  -7.841
  405   2HG2  THR  51          2HG2      THR  51   6.185  -8.927  -8.868
  406   3HG2  THR  51          3HG2      THR  51   4.623  -8.538  -9.591
  407    H    TYR  52           H        TYR  52   5.466  -5.063  -6.586
  408    HA   TYR  52           HA       TYR  52   4.165  -6.565  -4.660
  409   1HB   TYR  52          2HB       TYR  52   6.178  -5.059  -4.378
  410   2HB   TYR  52          1HB       TYR  52   5.070  -3.692  -4.346
  411    HD1  TYR  52           1HD      TYR  52   5.253  -2.873  -2.177
  412    HD2  TYR  52           2HD      TYR  52   4.694  -7.052  -2.757
  413    HE1  TYR  52           1HE      TYR  52   4.939  -3.159   0.235
  414    HE2  TYR  52           2HE      TYR  52   4.378  -7.347  -0.345
  415    HH   TYR  52           HH       TYR  52   3.842  -4.776   1.775
  416    H    PHE  53           H        PHE  53   3.315  -3.418  -6.035
  417    HA   PHE  53           HA       PHE  53   1.057  -2.888  -4.491
  418   1HB   PHE  53          2HB       PHE  53   1.756  -1.062  -5.658
  419   2HB   PHE  53          1HB       PHE  53   2.132  -1.976  -7.109
  420    HD1  PHE  53           1HD      PHE  53  -0.220   0.114  -5.416
  421    HD2  PHE  53           2HD      PHE  53   0.227  -2.627  -8.635
  422    HE1  PHE  53           1HE      PHE  53  -2.248   1.030  -6.461
  423    HE2  PHE  53           2HE      PHE  53  -1.808  -1.729  -9.684
  424    HZ   PHE  53           HZ       PHE  53  -3.049   0.102  -8.601
  425    H    MET  54           H        MET  54   1.464  -4.874  -7.364
  426    HA   MET  54           HA       MET  54  -1.319  -5.314  -7.816
  427   1HB   MET  54          2HB       MET  54   0.879  -7.217  -8.612
  428   2HB   MET  54          1HB       MET  54  -0.663  -6.943  -9.410
  429   1HG   MET  54          2HG       MET  54   0.400  -4.485  -9.585
  430   2HG   MET  54          1HG       MET  54   1.865  -5.461  -9.611
  431   1HE   MET  54          1HE       MET  54   1.293  -7.760 -12.713
  432   2HE   MET  54          2HE       MET  54   1.005  -8.103 -11.008
  433   3HE   MET  54          3HE       MET  54   2.455  -7.228 -11.497
  434    H    GLU  55           H        GLU  55   1.229  -7.063  -6.163
  435    HA   GLU  55           HA       GLU  55  -0.163  -9.339  -5.368
  436   1HB   GLU  55          2HB       GLU  55   1.979  -7.851  -3.829
  437   2HB   GLU  55          1HB       GLU  55   1.505  -9.524  -3.567
  438   1HG   GLU  55          2HG       GLU  55   2.206  -9.964  -5.950
  439   2HG   GLU  55          1HG       GLU  55   2.906  -8.349  -5.945
  440    H    ARG  56           H        ARG  56   0.049  -6.128  -4.037
  441    HA   ARG  56           HA       ARG  56  -1.515  -6.628  -1.724
  442   1HB   ARG  56          2HB       ARG  56  -0.716  -4.110  -3.168
  443   2HB   ARG  56          1HB       ARG  56  -1.752  -4.079  -1.750
  444   1HG   ARG  56          2HG       ARG  56   1.010  -5.269  -1.824
  445   2HG   ARG  56          1HG       ARG  56   0.623  -3.650  -1.241
  446   1HD   ARG  56          2HD       ARG  56  -0.916  -4.694   0.420
  447   2HD   ARG  56          1HD       ARG  56  -0.334  -6.274  -0.102
  448    HE   ARG  56           HE       ARG  56   1.933  -4.929   0.552
  449   1HH1  ARG  56          1HH1      ARG  56  -1.047  -5.613   2.223
  450   2HH1  ARG  56          2HH1      ARG  56  -0.311  -5.630   3.792
  451   1HH2  ARG  56          1HH2      ARG  56   2.908  -4.946   2.609
  452   2HH2  ARG  56          2HH2      ARG  56   1.937  -5.249   4.012
  453    H    LEU  57           H        LEU  57  -2.246  -5.474  -4.997
  454    HA   LEU  57           HA       LEU  57  -4.877  -4.691  -4.670
  455   1HB   LEU  57          2HB       LEU  57  -3.624  -6.149  -6.993
  456   2HB   LEU  57          1HB       LEU  57  -5.230  -5.450  -7.035
  457    HG   LEU  57           HG       LEU  57  -2.686  -3.917  -6.598
  458   1HD1  LEU  57          1HD1      LEU  57  -2.671  -4.645  -8.843
  459   2HD1  LEU  57          2HD1      LEU  57  -3.298  -2.996  -8.885
  460   3HD1  LEU  57          3HD1      LEU  57  -4.402  -4.361  -9.024
  461   1HD2  LEU  57          1HD2      LEU  57  -4.124  -1.941  -6.958
  462   2HD2  LEU  57          2HD2      LEU  57  -4.558  -2.847  -5.507
  463   3HD2  LEU  57          3HD2      LEU  57  -5.534  -3.003  -6.968
  464    H    ARG  58           H        ARG  58  -3.826  -7.918  -5.772
  465    HA   ARG  58           HA       ARG  58  -6.284  -9.166  -5.631
  466   1HB   ARG  58          2HB       ARG  58  -5.099 -11.254  -5.593
  467   2HB   ARG  58          1HB       ARG  58  -4.189 -10.134  -6.595
  468   1HG   ARG  58          2HG       ARG  58  -2.601  -9.763  -4.828
  469   2HG   ARG  58          1HG       ARG  58  -3.548 -10.760  -3.725
  470   1HD   ARG  58          2HD       ARG  58  -1.698 -12.052  -4.561
  471   2HD   ARG  58          1HD       ARG  58  -3.199 -12.685  -5.232
  472    HE   ARG  58           HE       ARG  58  -2.082 -10.805  -7.010
  473   1HH1  ARG  58          1HH1      ARG  58  -1.567 -14.037  -5.803
  474   2HH1  ARG  58          2HH1      ARG  58  -0.765 -14.582  -7.237
  475   1HH2  ARG  58          1HH2      ARG  58  -1.024 -11.519  -8.900
  476   2HH2  ARG  58          2HH2      ARG  58  -0.458 -13.152  -8.997
  477    H    HIS  59           H        HIS  59  -3.947  -8.450  -3.115
  478    HA   HIS  59           HA       HIS  59  -5.164 -10.002  -1.074
  479   1HB   HIS  59          2HB       HIS  59  -2.849  -9.017  -0.991
  480   2HB   HIS  59          1HB       HIS  59  -3.590  -7.451  -0.681
  481    HD1  HIS  59           1HD      HIS  59  -2.691 -10.653   0.946
  482    HD2  HIS  59           2HD      HIS  59  -4.801  -7.199   1.885
  483    HE1  HIS  59           1HE      HIS  59  -2.993 -10.708   3.441
  484    HE2  HIS  59           2HE      HIS  59  -4.194  -8.565   3.997
  485    H    TYR  60           H        TYR  60  -5.461  -6.552  -1.855
  486    HA   TYR  60           HA       TYR  60  -7.367  -5.968   0.148
  487   1HB   TYR  60          2HB       TYR  60  -6.614  -4.571  -2.422
  488   2HB   TYR  60          1HB       TYR  60  -7.833  -3.935  -1.323
  489    HD1  TYR  60           1HD      TYR  60  -4.411  -3.909  -2.152
  490    HD2  TYR  60           2HD      TYR  60  -7.040  -3.641   1.175
  491    HE1  TYR  60           1HE      TYR  60  -2.628  -2.838  -0.851
  492    HE2  TYR  60           2HE      TYR  60  -5.271  -2.549   2.487
  493    HH   TYR  60           HH       TYR  60  -2.909  -2.292   2.544
  494    H    ARG  61           H        ARG  61  -7.538  -7.262  -3.060
  495    HA   ARG  61           HA       ARG  61 -10.316  -6.918  -3.481
  496   1HB   ARG  61          2HB       ARG  61  -8.313  -8.829  -4.693
  497   2HB   ARG  61          1HB       ARG  61  -9.991  -8.738  -5.207
  498   1HG   ARG  61          2HG       ARG  61  -9.713  -6.503  -5.984
  499   2HG   ARG  61          1HG       ARG  61  -8.107  -6.395  -5.263
  500   1HD   ARG  61          2HD       ARG  61  -7.406  -8.270  -6.773
  501   2HD   ARG  61          1HD       ARG  61  -8.967  -8.120  -7.578
  502    HE   ARG  61           HE       ARG  61  -7.984  -5.609  -7.698
  503   1HH1  ARG  61          1HH1      ARG  61  -6.659  -8.719  -8.547
  504   2HH1  ARG  61          2HH1      ARG  61  -5.659  -8.090  -9.814
  505   1HH2  ARG  61          1HH2      ARG  61  -6.668  -4.774  -9.364
  506   2HH2  ARG  61          2HH2      ARG  61  -5.663  -5.849 -10.277
  507    H    GLN  62           H        GLN  62  -8.332  -9.562  -2.210
  508    HA   GLN  62           HA       GLN  62 -10.186 -11.563  -1.945
  509   1HB   GLN  62          2HB       GLN  62  -7.921 -10.737  -0.139
  510   2HB   GLN  62          1HB       GLN  62  -8.912 -12.146   0.217
  511   1HG   GLN  62          2HG       GLN  62  -8.250 -13.208  -1.817
  512   2HG   GLN  62          1HG       GLN  62  -7.418 -11.755  -2.361
  513   1HE2  GLN  62          1HE2      GLN  62  -5.463 -12.817  -2.590
  514   2HE2  GLN  62          2HE2      GLN  62  -4.517 -13.321  -1.235
  515    H    LEU  63           H        LEU  63  -9.642  -8.808   0.220
  516    HA   LEU  63           HA       LEU  63 -11.827  -9.571   1.935
  517   1HB   LEU  63          2HB       LEU  63 -10.139  -7.078   1.796
  518   2HB   LEU  63          1HB       LEU  63 -11.452  -7.285   2.940
  519    HG   LEU  63           HG       LEU  63  -9.408  -7.752   4.078
  520   1HD1  LEU  63          1HD1      LEU  63  -9.772 -10.008   4.855
  521   2HD1  LEU  63          2HD1      LEU  63 -10.726 -10.379   3.419
  522   3HD1  LEU  63          3HD1      LEU  63 -11.322  -9.208   4.595
  523   1HD2  LEU  63          1HD2      LEU  63  -7.822  -9.435   3.353
  524   2HD2  LEU  63          2HD2      LEU  63  -8.025  -8.210   2.100
  525   3HD2  LEU  63          3HD2      LEU  63  -8.806  -9.781   1.931
  526    H    SER  64           H        SER  64 -11.292  -7.160  -0.606
  527    HA   SER  64           HA       SER  64 -13.520  -5.603  -0.417
  528   1HB   SER  64          2HB       SER  64 -13.257  -5.047  -2.697
  529   2HB   SER  64          1HB       SER  64 -11.641  -5.493  -2.152
  530    HG   SER  64           HG       SER  64 -12.003  -6.541  -4.068
  531    H    LEU  65           H        LEU  65 -13.415  -8.929  -1.139
  532    HA   LEU  65           HA       LEU  65 -16.161  -8.954  -2.151
  533   1HB   LEU  65          2HB       LEU  65 -14.927 -11.563  -1.689
  534   2HB   LEU  65          1HB       LEU  65 -15.725 -10.938  -3.117
  535    HG   LEU  65           HG       LEU  65 -12.852 -10.412  -2.352
  536   1HD1  LEU  65          1HD1      LEU  65 -13.122 -12.705  -2.985
  537   2HD1  LEU  65          2HD1      LEU  65 -12.364 -11.841  -4.321
  538   3HD1  LEU  65          3HD1      LEU  65 -14.078 -12.253  -4.395
  539   1HD2  LEU  65          1HD2      LEU  65 -14.137  -9.830  -5.003
  540   2HD2  LEU  65          2HD2      LEU  65 -12.594  -9.251  -4.367
  541   3HD2  LEU  65          3HD2      LEU  65 -14.110  -8.638  -3.703
  542    H    GLN  66           H        GLN  66 -14.248 -10.574   0.402
  543    HA   GLN  66           HA       GLN  66 -16.386 -11.664   1.780
  544   1HB   GLN  66          2HB       GLN  66 -14.842 -12.437   3.231
  545   2HB   GLN  66          1HB       GLN  66 -13.719 -11.849   2.017
  546   1HG   GLN  66          2HG       GLN  66 -12.892 -11.150   4.109
  547   2HG   GLN  66          1HG       GLN  66 -13.566  -9.717   3.336
  548   1HE2  GLN  66          1HE2      GLN  66 -14.018  -8.560   5.136
  549   2HE2  GLN  66          2HE2      GLN  66 -15.221  -9.012   6.293
  550    H    LEU  67           H        LEU  67 -14.728  -8.572   2.610
  551    HA   LEU  67           HA       LEU  67 -16.505  -8.035   4.737
  552   1HB   LEU  67          2HB       LEU  67 -15.545  -5.649   4.472
  553   2HB   LEU  67          1HB       LEU  67 -14.509  -6.953   5.022
  554    HG   LEU  67           HG       LEU  67 -13.606  -7.187   2.767
  555   1HD1  LEU  67          1HD1      LEU  67 -15.501  -6.519   1.487
  556   2HD1  LEU  67          2HD1      LEU  67 -14.162  -5.434   1.100
  557   3HD1  LEU  67          3HD1      LEU  67 -15.455  -4.897   2.171
  558   1HD2  LEU  67          1HD2      LEU  67 -13.492  -4.439   3.981
  559   2HD2  LEU  67          2HD2      LEU  67 -12.447  -4.966   2.660
  560   3HD2  LEU  67          3HD2      LEU  67 -12.370  -5.778   4.226
  561    HA   PRO  68           HA       PRO  68 -19.885  -6.089   2.754
  562   1HB   PRO  68          2HB       PRO  68 -20.869  -4.552   4.620
  563   2HB   PRO  68          1HB       PRO  68 -20.623  -6.278   4.967
  564   1HG   PRO  68          2HG       PRO  68 -18.817  -3.969   5.624
  565   2HG   PRO  68          1HG       PRO  68 -19.463  -5.206   6.729
  566   1HD   PRO  68          2HD       PRO  68 -17.014  -5.394   5.570
  567   2HD   PRO  68          1HD       PRO  68 -18.007  -6.815   5.957
  568    H    LYS  69           H        LYS  69 -19.848  -3.175   4.415
  569    HA   LYS  69           HA       LYS  69 -18.810  -1.773   2.070
  570   1HB   LYS  69          2HB       LYS  69 -20.977  -0.931   3.988
  571   2HB   LYS  69          1HB       LYS  69 -20.381   0.046   2.651
  572   1HG   LYS  69          2HG       LYS  69 -21.286  -1.393   1.047
  573   2HG   LYS  69          1HG       LYS  69 -21.506  -2.692   2.223
  574   1HD   LYS  69          2HD       LYS  69 -22.964  -0.062   2.395
  575   2HD   LYS  69          1HD       LYS  69 -23.603  -1.453   1.516
  576   1HE   LYS  69          2HE       LYS  69 -23.597  -2.778   3.537
  577   2HE   LYS  69          1HE       LYS  69 -22.837  -1.462   4.432
  578   1HZ   LYS  69          1HZ       LYS  69 -25.239  -1.601   4.811
  579   2HZ   LYS  69          2HZ       LYS  69 -25.519  -1.322   3.166
  580   3HZ   LYS  69          3HZ       LYS  69 -24.795  -0.123   4.114
  581    H    GLY  70           H        GLY  70 -17.952  -2.567   5.068
  582   1HA   GLY  70          2HA       GLY  70 -16.036  -0.450   5.279
  583   2HA   GLY  70          1HA       GLY  70 -17.300  -0.302   6.487
  584    H    SER  71           H        SER  71 -17.543  -3.302   6.540
  585    HA   SER  71           HA       SER  71 -16.758  -5.052   7.754
  586   1HB   SER  71          2HB       SER  71 -14.878  -4.940   6.134
  587   2HB   SER  71          1HB       SER  71 -14.026  -3.857   7.234
  588    HG   SER  71           HG       SER  71 -14.483  -6.593   7.421
  589    H    ASP  72           H        ASP  72 -15.245  -5.593   9.712
  590    HA   ASP  72           HA       ASP  72 -14.827  -3.383  11.525
  591   1HB   ASP  72          2HB       ASP  72 -17.183  -3.779  11.894
  592   2HB   ASP  72          1HB       ASP  72 -16.905  -5.507  12.087
  593    HA   PRO  73           HA       PRO  73 -11.428  -5.917  12.781
  594   1HB   PRO  73          2HB       PRO  73 -11.906  -4.865  15.507
  595   2HB   PRO  73          1HB       PRO  73 -10.460  -4.793  14.505
  596   1HG   PRO  73          2HG       PRO  73 -12.001  -2.643  14.924
  597   2HG   PRO  73          1HG       PRO  73 -11.136  -2.911  13.402
  598   1HD   PRO  73          2HD       PRO  73 -14.024  -3.209  14.015
  599   2HD   PRO  73          1HD       PRO  73 -13.221  -2.750  12.507
  600    H    ALA  74           H        ALA  74 -14.233  -5.806  14.939
  601    HA   ALA  74           HA       ALA  74 -13.627  -8.385  16.094
  602   1HB   ALA  74          1HB       ALA  74 -16.038  -6.608  16.438
  603   2HB   ALA  74          2HB       ALA  74 -14.614  -6.640  17.478
  604   3HB   ALA  74          3HB       ALA  74 -15.675  -8.047  17.390
  605    H    TYR  75           H        TYR  75 -14.451  -7.841  13.152
  606    HA   TYR  75           HA       TYR  75 -16.603  -9.842  13.020
  607   1HB   TYR  75          2HB       TYR  75 -17.090  -7.565  12.081
  608   2HB   TYR  75          1HB       TYR  75 -15.828  -7.844  10.893
  609    HD1  TYR  75           1HD      TYR  75 -18.959  -9.418  12.179
  610    HD2  TYR  75           2HD      TYR  75 -16.408  -8.743   8.842
  611    HE1  TYR  75           1HE      TYR  75 -20.594 -10.526  10.713
  612    HE2  TYR  75           2HE      TYR  75 -18.036  -9.849   7.366
  613    HH   TYR  75           HH       TYR  75 -21.209 -10.568   8.339
  614    H    GLN  76           H        GLN  76 -13.423  -9.528  12.801
  615    HA   GLN  76           HA       GLN  76 -12.879 -11.027  10.410
  616   1HB   GLN  76          2HB       GLN  76 -11.032 -10.380  12.708
  617   2HB   GLN  76          1HB       GLN  76 -10.554 -10.937  11.107
  618   1HG   GLN  76          2HG       GLN  76 -12.076  -8.405  11.562
  619   2HG   GLN  76          1HG       GLN  76 -10.314  -8.468  11.551
  620   1HE2  GLN  76          1HE2      GLN  76 -13.214  -8.623   9.690
  621   2HE2  GLN  76          2HE2      GLN  76 -12.473  -8.583   8.128
  622    H    LYS  77           H        LYS  77 -13.325 -13.091  10.279
  623    HA   LYS  77           HA       LYS  77 -12.588 -14.850  12.513
  624   1HB   LYS  77          2HB       LYS  77 -14.587 -16.158  12.288
  625   2HB   LYS  77          1HB       LYS  77 -15.058 -14.479  12.493
  626   1HG   LYS  77          2HG       LYS  77 -14.862 -15.776   9.792
  627   2HG   LYS  77          1HG       LYS  77 -16.329 -15.824  10.770
  628   1HD   LYS  77          2HD       LYS  77 -16.328 -13.355  10.830
  629   2HD   LYS  77          1HD       LYS  77 -14.916 -13.353   9.771
  630   1HE   LYS  77          2HE       LYS  77 -16.933 -12.977   8.479
  631   2HE   LYS  77          1HE       LYS  77 -16.220 -14.533   8.057
  632   1HZ   LYS  77          1HZ       LYS  77 -18.626 -14.675   8.313
  633   2HZ   LYS  77          2HZ       LYS  77 -18.507 -14.140   9.914
  634   3HZ   LYS  77          3HZ       LYS  77 -17.837 -15.628   9.467
  635    H    ASP  78           H        ASP  78 -12.022 -17.000  11.922
  636    HA   ASP  78           HA       ASP  78 -10.714 -17.139   9.368
  637   1HB   ASP  78          2HB       ASP  78  -9.839 -18.080  11.577
  638   2HB   ASP  78          1HB       ASP  78 -10.988 -19.396  11.348
  639    H    ASP  79           H        ASP  79 -13.460 -18.761  10.913
  640    HA   ASP  79           HA       ASP  79 -14.429 -19.518   8.261
  641   1HB   ASP  79          2HB       ASP  79 -14.089 -21.449  10.560
  642   2HB   ASP  79          1HB       ASP  79 -15.045 -21.790   9.123
  643    H    ALA  80           H        ALA  80 -15.133 -19.557  11.746
  644    HA   ALA  80           HA       ALA  80 -17.623 -18.186  11.322
  645   1HB   ALA  80          1HB       ALA  80 -18.262 -20.496  10.773
  646   2HB   ALA  80          2HB       ALA  80 -19.087 -19.900  12.214
  647   3HB   ALA  80          3HB       ALA  80 -17.726 -21.011  12.373
  648    H    VAL  81           H        VAL  81 -14.986 -18.350  12.955
  649    HA   VAL  81           HA       VAL  81 -16.244 -17.612  15.509
  650    HB   VAL  81           HB       VAL  81 -13.653 -19.152  15.317
  651   1HG1  VAL  81          1HG1      VAL  81 -13.774 -17.728  17.266
  652   2HG1  VAL  81          2HG1      VAL  81 -13.960 -19.412  17.753
  653   3HG1  VAL  81          3HG1      VAL  81 -15.371 -18.359  17.666
  654   1HG2  VAL  81          1HG2      VAL  81 -15.481 -20.593  14.632
  655   2HG2  VAL  81          2HG2      VAL  81 -16.407 -20.135  16.061
  656   3HG2  VAL  81          3HG2      VAL  81 -14.914 -21.058  16.236
  657    H    LYS  82           H        LYS  82 -15.730 -15.610  16.072
  658    HA   LYS  82           HA       LYS  82 -13.914 -14.008  14.646
  659   1HB   LYS  82          2HB       LYS  82 -15.373 -13.671  17.249
  660   2HB   LYS  82          1HB       LYS  82 -14.199 -12.472  16.726
  661   1HG   LYS  82          2HG       LYS  82 -16.420 -11.778  16.104
  662   2HG   LYS  82          1HG       LYS  82 -15.484 -12.144  14.655
  663   1HD   LYS  82          2HD       LYS  82 -16.584 -14.262  14.409
  664   2HD   LYS  82          1HD       LYS  82 -17.401 -14.069  15.961
  665   1HE   LYS  82          2HE       LYS  82 -18.902 -13.588  14.088
  666   2HE   LYS  82          1HE       LYS  82 -18.640 -12.163  15.091
  667   1HZ   LYS  82          1HZ       LYS  82 -17.289 -12.735  12.508
  668   2HZ   LYS  82          2HZ       LYS  82 -17.030 -11.369  13.470
  669   3HZ   LYS  82          3HZ       LYS  82 -18.537 -11.616  12.746
  670    H    LYS  83           H        LYS  83 -11.786 -13.796  14.773
  671    HA   LYS  83           HA       LYS  83 -10.402 -15.017  17.054
  672   1HB   LYS  83          2HB       LYS  83  -8.375 -14.867  15.540
  673   2HB   LYS  83          1HB       LYS  83  -9.640 -15.975  15.031
  674   1HG   LYS  83          2HG       LYS  83 -10.437 -14.354  13.407
  675   2HG   LYS  83          1HG       LYS  83  -9.221 -13.196  13.947
  676   1HD   LYS  83          2HD       LYS  83  -7.452 -14.761  13.268
  677   2HD   LYS  83          1HD       LYS  83  -8.682 -15.890  12.697
  678   1HE   LYS  83          2HE       LYS  83  -8.234 -13.094  11.656
  679   2HE   LYS  83          1HE       LYS  83  -7.723 -14.583  10.861
  680   1HZ   LYS  83          1HZ       LYS  83 -10.042 -15.241  10.686
  681   2HZ   LYS  83          2HZ       LYS  83  -9.785 -13.751   9.929
  682   3HZ   LYS  83          3HZ       LYS  83 -10.530 -13.810  11.446
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1  -2.266  18.329   5.377
    2   2H    MET   1          2HT       MET   1  -3.379  18.118   6.633
    3   3H    MET   1          3HT       MET   1  -3.775  17.632   5.062
    4    HA   MET   1           HA       MET   1  -1.628  16.466   6.734
    5   1HB   MET   1          2HB       MET   1  -4.317  15.335   5.931
    6   2HB   MET   1          1HB       MET   1  -3.076  14.480   6.835
    7   1HG   MET   1          2HG       MET   1  -4.540  16.943   7.750
    8   2HG   MET   1          1HG       MET   1  -4.848  15.292   8.287
    9   1HE   MET   1          1HE       MET   1  -3.234  16.929  11.453
   10   2HE   MET   1          2HE       MET   1  -4.607  16.019  10.825
   11   3HE   MET   1          3HE       MET   1  -4.338  17.682  10.301
   12    H    TYR   2           H        TYR   2  -3.757  15.323   4.137
   13    HA   TYR   2           HA       TYR   2  -3.346  14.350   2.136
   14   1HB   TYR   2          2HB       TYR   2  -1.558  16.529   2.283
   15   2HB   TYR   2          1HB       TYR   2  -0.649  15.175   1.622
   16    HD1  TYR   2           1HD      TYR   2  -3.778  17.128   1.158
   17    HD2  TYR   2           2HD      TYR   2  -0.864  14.604  -0.635
   18    HE1  TYR   2           1HE      TYR   2  -4.788  17.539  -1.048
   19    HE2  TYR   2           2HE      TYR   2  -1.861  15.007  -2.846
   20    HH   TYR   2           HH       TYR   2  -4.115  17.461  -3.428
   21    H    ASP   3           H        ASP   3  -2.012  13.485   4.808
   22    HA   ASP   3           HA       ASP   3  -0.345  11.356   3.658
   23   1HB   ASP   3          2HB       ASP   3   0.687  11.216   5.931
   24   2HB   ASP   3          1HB       ASP   3   0.977  12.746   5.117
   25    H    TRP   4           H        TRP   4  -0.328   9.333   5.091
   26    HA   TRP   4           HA       TRP   4  -2.614   8.804   6.704
   27   1HB   TRP   4          2HB       TRP   4  -3.565   7.024   5.198
   28   2HB   TRP   4          1HB       TRP   4  -3.817   8.673   4.639
   29    HD1  TRP   4           HD       TRP   4  -1.563   5.622   3.900
   30    HE1  TRP   4           1HE      TRP   4  -0.820   5.757   1.442
   31    HE3  TRP   4           3HE      TRP   4  -3.577  10.164   2.687
   32    HZ2  TRP   4           2HZ      TRP   4  -1.054   7.549  -0.730
   33    HZ3  TRP   4           3HZ      TRP   4  -3.273  11.014   0.398
   34    HH2  TRP   4           HH       TRP   4  -2.037   9.733  -1.273
   35    H    ASN   5           H        ASN   5   0.178   7.697   4.930
   36    HA   ASN   5           HA       ASN   5   0.338   5.251   6.465
   37   1HB   ASN   5          2HB       ASN   5   2.482   4.928   5.143
   38   2HB   ASN   5          1HB       ASN   5   0.993   4.973   4.201
   39   1HD2  ASN   5          1HD2      ASN   5   3.921   6.643   5.025
   40   2HD2  ASN   5          2HD2      ASN   5   3.841   7.826   3.767
   41    H    ILE   6           H        ILE   6   2.242   8.105   5.976
   42    HA   ILE   6           HA       ILE   6   3.775   9.226   7.165
   43    HB   ILE   6           HB       ILE   6   2.070   7.934   9.215
   44   1HG1  ILE   6          2HG1      ILE   6   2.268  10.715   8.089
   45   2HG1  ILE   6          1HG1      ILE   6   0.948   9.569   7.902
   46   1HG2  ILE   6          1HG2      ILE   6   4.267   9.935   9.743
   47   2HG2  ILE   6          2HG2      ILE   6   4.178   8.284  10.351
   48   3HG2  ILE   6          3HG2      ILE   6   3.025   9.492  10.912
   49   1HD1  ILE   6          1HD1      ILE   6   1.737  11.004  10.426
   50   2HD1  ILE   6          2HD1      ILE   6   0.485   9.766  10.319
   51   3HD1  ILE   6          3HD1      ILE   6   0.302  11.285   9.441
   52    H    ALA   7           H        ALA   7   3.800   6.036   6.826
   53    HA   ALA   7           HA       ALA   7   6.195   5.642   8.434
   54   1HB   ALA   7          1HB       ALA   7   4.329   4.086   8.876
   55   2HB   ALA   7          2HB       ALA   7   5.797   3.269   8.337
   56   3HB   ALA   7          3HB       ALA   7   4.458   3.510   7.214
   57    H    ALA   8           H        ALA   8   7.496   6.760   6.877
   58    HA   ALA   8           HA       ALA   8   8.531   4.957   4.856
   59   1HB   ALA   8          1HB       ALA   8   8.367   6.553   3.030
   60   2HB   ALA   8          2HB       ALA   8   7.531   7.696   4.079
   61   3HB   ALA   8          3HB       ALA   8   6.764   6.165   3.654
   62    H    LYS   9           H        LYS   9  10.388   4.957   6.160
   63    HA   LYS   9           HA       LYS   9  11.850   7.505   6.314
   64   1HB   LYS   9          2HB       LYS   9  11.306   5.872   8.357
   65   2HB   LYS   9          1HB       LYS   9  12.780   5.096   7.795
   66   1HG   LYS   9          2HG       LYS   9  13.372   6.629   9.510
   67   2HG   LYS   9          1HG       LYS   9  13.922   7.308   7.975
   68   1HD   LYS   9          2HD       LYS   9  11.206   8.093   8.701
   69   2HD   LYS   9          1HD       LYS   9  12.427   8.627   9.860
   70   1HE   LYS   9          2HE       LYS   9  12.495   9.116   6.882
   71   2HE   LYS   9          1HE       LYS   9  12.020  10.297   8.101
   72   1HZ   LYS   9          1HZ       LYS   9  14.247  10.136   9.053
   73   2HZ   LYS   9          2HZ       LYS   9  14.304  10.627   7.436
   74   3HZ   LYS   9          3HZ       LYS   9  14.697   9.035   7.850
   75    H    SER  10           H        SER  10  12.935   4.128   6.315
   76    HA   SER  10           HA       SER  10  15.215   4.695   4.721
   77   1HB   SER  10          2HB       SER  10  15.250   2.827   6.274
   78   2HB   SER  10          1HB       SER  10  13.905   2.059   5.431
   79    HG   SER  10           HG       SER  10  15.233   1.350   3.953
   80    H    GLN  11           H        GLN  11  15.459   4.745   2.596
   81    HA   GLN  11           HA       GLN  11  13.473   5.022   0.774
   82   1HB   GLN  11          2HB       GLN  11  15.633   5.614   0.088
   83   2HB   GLN  11          1HB       GLN  11  16.286   4.024   0.458
   84   1HG   GLN  11          2HG       GLN  11  15.388   3.069  -1.462
   85   2HG   GLN  11          1HG       GLN  11  14.237   4.382  -1.694
   86   1HE2  GLN  11          1HE2      GLN  11  17.531   3.344  -2.070
   87   2HE2  GLN  11          2HE2      GLN  11  18.031   4.618  -3.124
   88    H    GLU  12           H        GLU  12  15.256   1.955   1.229
   89    HA   GLU  12           HA       GLU  12  13.895   0.379  -0.554
   90   1HB   GLU  12          2HB       GLU  12  14.930  -0.396   2.180
   91   2HB   GLU  12          1HB       GLU  12  14.428  -1.545   0.948
   92   1HG   GLU  12          2HG       GLU  12  16.773  -1.433   0.840
   93   2HG   GLU  12          1HG       GLU  12  16.172  -0.537  -0.552
   94    H    GLU  13           H        GLU  13  12.834   1.493   2.574
   95    HA   GLU  13           HA       GLU  13  10.525  -0.235   2.634
   96   1HB   GLU  13          2HB       GLU  13  11.090   2.163   4.379
   97   2HB   GLU  13          1HB       GLU  13   9.995   0.829   4.719
   98   1HG   GLU  13          2HG       GLU  13  12.991   0.633   4.511
   99   2HG   GLU  13          1HG       GLU  13  12.055   0.654   6.005
  100    H    ARG  14           H        ARG  14  11.269   3.059   1.694
  101    HA   ARG  14           HA       ARG  14   8.612   4.033   1.622
  102   1HB   ARG  14          2HB       ARG  14  10.821   4.996  -0.185
  103   2HB   ARG  14          1HB       ARG  14   9.472   5.911   0.474
  104   1HG   ARG  14          2HG       ARG  14  10.457   5.737   2.707
  105   2HG   ARG  14          1HG       ARG  14  11.813   4.841   2.027
  106   1HD   ARG  14          2HD       ARG  14  12.452   7.143   2.301
  107   2HD   ARG  14          1HD       ARG  14  12.316   6.779   0.581
  108    HE   ARG  14           HE       ARG  14   9.942   7.913   1.764
  109   1HH1  ARG  14          1HH1      ARG  14  12.959   8.542   0.142
  110   2HH1  ARG  14          2HH1      ARG  14  12.478  10.105  -0.427
  111   1HH2  ARG  14          1HH2      ARG  14   9.297   9.971   1.021
  112   2HH2  ARG  14          2HH2      ARG  14  10.395  10.917   0.075
  113    H    ASP  15           H        ASP  15  10.692   2.564  -0.831
  114    HA   ASP  15           HA       ASP  15   8.987   2.911  -3.016
  115   1HB   ASP  15          2HB       ASP  15  11.034   0.744  -2.540
  116   2HB   ASP  15          1HB       ASP  15  10.309   1.135  -4.096
  117    H    LYS  16           H        LYS  16   9.359   0.050  -0.908
  118    HA   LYS  16           HA       LYS  16   7.355  -1.434  -2.285
  119   1HB   LYS  16          2HB       LYS  16   8.451  -1.910   0.485
  120   2HB   LYS  16          1HB       LYS  16   7.573  -3.069  -0.505
  121   1HG   LYS  16          2HG       LYS  16   9.502  -2.611  -2.211
  122   2HG   LYS  16          1HG       LYS  16  10.367  -2.081  -0.768
  123   1HD   LYS  16          2HD       LYS  16  10.896  -4.363  -1.003
  124   2HD   LYS  16          1HD       LYS  16   9.672  -4.301   0.266
  125   1HE   LYS  16          2HE       LYS  16   7.952  -4.934  -1.322
  126   2HE   LYS  16          1HE       LYS  16   9.126  -4.912  -2.637
  127   1HZ   LYS  16          1HZ       LYS  16   9.163  -6.748  -0.302
  128   2HZ   LYS  16          2HZ       LYS  16  10.318  -6.716  -1.537
  129   3HZ   LYS  16          3HZ       LYS  16   8.722  -7.159  -1.883
  130    H    VAL  17           H        VAL  17   7.261   0.639   0.572
  131    HA   VAL  17           HA       VAL  17   4.619  -0.225   1.300
  132    HB   VAL  17           HB       VAL  17   6.145   2.194   2.254
  133   1HG1  VAL  17          1HG1      VAL  17   4.524   2.086   4.148
  134   2HG1  VAL  17          2HG1      VAL  17   3.611   0.888   3.225
  135   3HG1  VAL  17          3HG1      VAL  17   3.799   2.528   2.601
  136   1HG2  VAL  17          1HG2      VAL  17   6.716   0.874   4.179
  137   2HG2  VAL  17          2HG2      VAL  17   7.188  -0.029   2.739
  138   3HG2  VAL  17          3HG2      VAL  17   5.721  -0.467   3.612
  139    H    ASN  18           H        ASN  18   5.913   2.737  -0.240
  140    HA   ASN  18           HA       ASN  18   3.501   4.109  -0.486
  141   1HB   ASN  18          2HB       ASN  18   5.848   4.082  -2.384
  142   2HB   ASN  18          1HB       ASN  18   4.533   5.242  -2.448
  143   1HD2  ASN  18          1HD2      ASN  18   5.773   4.082   0.596
  144   2HD2  ASN  18          2HD2      ASN  18   6.564   5.546   1.057
  145    H    VAL  19           H        VAL  19   4.729   1.368  -2.171
  146    HA   VAL  19           HA       VAL  19   2.784   1.524  -4.316
  147    HB   VAL  19           HB       VAL  19   5.268   0.245  -3.994
  148   1HG1  VAL  19          1HG1      VAL  19   3.076  -1.793  -4.349
  149   2HG1  VAL  19          2HG1      VAL  19   4.177  -1.673  -2.978
  150   3HG1  VAL  19          3HG1      VAL  19   4.799  -2.087  -4.575
  151   1HG2  VAL  19          1HG2      VAL  19   4.865  -0.469  -6.348
  152   2HG2  VAL  19          2HG2      VAL  19   4.554   1.240  -6.041
  153   3HG2  VAL  19          3HG2      VAL  19   3.207   0.111  -6.184
  154    H    ASP  20           H        ASP  20   3.306  -0.079  -1.286
  155    HA   ASP  20           HA       ASP  20   1.286  -2.035  -1.446
  156   1HB   ASP  20          2HB       ASP  20   3.039  -2.165   0.241
  157   2HB   ASP  20          1HB       ASP  20   2.496  -0.654   0.963
  158    H    LEU  21           H        LEU  21   1.329   1.302  -0.300
  159    HA   LEU  21           HA       LEU  21  -1.422   1.243   0.479
  160   1HB   LEU  21          2HB       LEU  21  -1.163   3.684   0.799
  161   2HB   LEU  21          1HB       LEU  21   0.031   2.740   1.666
  162    HG   LEU  21           HG       LEU  21   1.508   3.239  -0.458
  163   1HD1  LEU  21          1HD1      LEU  21  -0.053   4.355  -1.834
  164   2HD1  LEU  21          2HD1      LEU  21   1.031   5.599  -1.213
  165   3HD1  LEU  21          3HD1      LEU  21  -0.577   5.402  -0.517
  166   1HD2  LEU  21          1HD2      LEU  21   2.448   5.128   0.707
  167   2HD2  LEU  21          2HD2      LEU  21   1.959   3.900   1.875
  168   3HD2  LEU  21          3HD2      LEU  21   0.962   5.335   1.635
  169    H    ALA  22           H        ALA  22   0.440   2.177  -2.329
  170    HA   ALA  22           HA       ALA  22  -1.367   3.646  -3.780
  171   1HB   ALA  22          1HB       ALA  22   0.864   3.240  -4.590
  172   2HB   ALA  22          2HB       ALA  22  -0.292   2.688  -5.804
  173   3HB   ALA  22          3HB       ALA  22   0.527   1.519  -4.767
  174    H    ALA  23           H        ALA  23  -1.129   0.104  -3.616
  175    HA   ALA  23           HA       ALA  23  -3.374  -0.394  -5.283
  176   1HB   ALA  23          1HB       ALA  23  -2.106  -2.189  -3.216
  177   2HB   ALA  23          2HB       ALA  23  -1.615  -2.059  -4.904
  178   3HB   ALA  23          3HB       ALA  23  -3.208  -2.692  -4.497
  179    H    SER  24           H        SER  24  -2.922   0.003  -1.830
  180    HA   SER  24           HA       SER  24  -5.397  -0.948  -0.944
  181   1HB   SER  24          2HB       SER  24  -3.583  -0.477   0.610
  182   2HB   SER  24          1HB       SER  24  -3.669   1.242   0.230
  183    HG   SER  24           HG       SER  24  -5.570   1.396   1.285
  184    H    GLY  25           H        GLY  25  -4.480   2.476  -1.438
  185   1HA   GLY  25          2HA       GLY  25  -6.982   3.574  -0.974
  186   2HA   GLY  25          1HA       GLY  25  -5.755   4.292  -2.004
  187    H    VAL  26           H        VAL  26  -5.646   2.358  -4.016
  188    HA   VAL  26           HA       VAL  26  -7.630   3.227  -5.741
  189    HB   VAL  26           HB       VAL  26  -5.873   0.784  -5.840
  190   1HG1  VAL  26          1HG1      VAL  26  -6.481   0.610  -8.231
  191   2HG1  VAL  26          2HG1      VAL  26  -7.735   1.825  -7.977
  192   3HG1  VAL  26          3HG1      VAL  26  -7.837   0.268  -7.157
  193   1HG2  VAL  26          1HG2      VAL  26  -4.631   2.067  -7.478
  194   2HG2  VAL  26          2HG2      VAL  26  -4.790   2.988  -5.982
  195   3HG2  VAL  26          3HG2      VAL  26  -5.801   3.381  -7.371
  196    H    ALA  27           H        ALA  27  -7.431  -0.075  -4.349
  197    HA   ALA  27           HA       ALA  27 -10.199  -0.534  -5.100
  198   1HB   ALA  27          1HB       ALA  27  -8.529  -2.264  -5.523
  199   2HB   ALA  27          2HB       ALA  27  -9.806  -2.835  -4.448
  200   3HB   ALA  27          3HB       ALA  27  -8.231  -2.397  -3.789
  201    H    TYR  28           H        TYR  28  -8.319  -0.841  -2.084
  202    HA   TYR  28           HA       TYR  28 -10.276  -1.527  -0.325
  203   1HB   TYR  28          2HB       TYR  28  -7.652  -0.479  -0.155
  204   2HB   TYR  28          1HB       TYR  28  -8.648   0.448   0.956
  205    HD1  TYR  28           1HD      TYR  28  -7.514  -0.394   2.944
  206    HD2  TYR  28           2HD      TYR  28  -9.338  -3.070   0.183
  207    HE1  TYR  28           1HE      TYR  28  -7.332  -2.208   4.590
  208    HE2  TYR  28           2HE      TYR  28  -9.153  -4.893   1.823
  209    HH   TYR  28           HH       TYR  28  -7.765  -5.462   3.799
  210    H    LYS  29           H        LYS  29  -9.725   1.741  -1.594
  211    HA   LYS  29           HA       LYS  29 -11.434   3.024   0.264
  212   1HB   LYS  29          2HB       LYS  29  -9.849   4.361  -0.912
  213   2HB   LYS  29          1HB       LYS  29 -10.463   3.832  -2.473
  214   1HG   LYS  29          2HG       LYS  29 -12.402   5.207  -0.725
  215   2HG   LYS  29          1HG       LYS  29 -11.076   6.191  -1.342
  216   1HD   LYS  29          2HD       LYS  29 -12.731   4.447  -3.143
  217   2HD   LYS  29          1HD       LYS  29 -13.217   6.091  -2.734
  218   1HE   LYS  29          2HE       LYS  29 -10.473   5.530  -3.794
  219   2HE   LYS  29          1HE       LYS  29 -11.847   5.669  -4.892
  220   1HZ   LYS  29          1HZ       LYS  29 -10.585   7.768  -4.502
  221   2HZ   LYS  29          2HZ       LYS  29 -11.138   7.751  -2.904
  222   3HZ   LYS  29          3HZ       LYS  29 -12.242   7.877  -4.179
  223    H    GLU  30           H        GLU  30 -12.016   2.324  -3.146
  224    HA   GLU  30           HA       GLU  30 -14.725   3.038  -3.051
  225   1HB   GLU  30          2HB       GLU  30 -13.306   1.225  -5.003
  226   2HB   GLU  30          1HB       GLU  30 -14.917   1.884  -5.241
  227   1HG   GLU  30          2HG       GLU  30 -14.020   4.136  -5.254
  228   2HG   GLU  30          1HG       GLU  30 -12.400   3.508  -4.951
  229    H    ARG  31           H        ARG  31 -13.587   0.672  -1.260
  230    HA   ARG  31           HA       ARG  31 -16.008  -0.950  -1.639
  231   1HB   ARG  31          2HB       ARG  31 -13.181  -1.841  -1.310
  232   2HB   ARG  31          1HB       ARG  31 -14.466  -2.836  -0.638
  233   1HG   ARG  31          2HG       ARG  31 -14.130  -3.743  -2.736
  234   2HG   ARG  31          1HG       ARG  31 -15.521  -2.688  -2.978
  235   1HD   ARG  31          2HD       ARG  31 -14.126  -0.989  -3.953
  236   2HD   ARG  31          1HD       ARG  31 -12.671  -1.905  -3.569
  237    HE   ARG  31           HE       ARG  31 -14.388  -3.446  -5.196
  238   1HH1  ARG  31          1HH1      ARG  31 -12.240  -0.707  -5.336
  239   2HH1  ARG  31          2HH1      ARG  31 -11.847  -0.937  -7.006
  240   1HH2  ARG  31          1HH2      ARG  31 -13.875  -3.755  -7.399
  241   2HH2  ARG  31          2HH2      ARG  31 -12.775  -2.667  -8.177
  242    H    LEU  32           H        LEU  32 -13.396  -0.423   0.751
  243    HA   LEU  32           HA       LEU  32 -15.387  -0.740   2.874
  244   1HB   LEU  32          2HB       LEU  32 -12.469  -0.643   3.445
  245   2HB   LEU  32          1HB       LEU  32 -13.735  -1.527   4.269
  246    HG   LEU  32           HG       LEU  32 -12.447  -3.186   3.284
  247   1HD1  LEU  32          1HD1      LEU  32 -14.838  -3.429   2.774
  248   2HD1  LEU  32          2HD1      LEU  32 -13.773  -4.217   1.606
  249   3HD1  LEU  32          3HD1      LEU  32 -14.538  -2.676   1.208
  250   1HD2  LEU  32          1HD2      LEU  32 -11.280  -3.089   1.348
  251   2HD2  LEU  32          2HD2      LEU  32 -11.323  -1.373   1.763
  252   3HD2  LEU  32          3HD2      LEU  32 -12.439  -2.022   0.563
  253    H    ASN  33           H        ASN  33 -13.350   0.461   4.733
  254    HA   ASN  33           HA       ASN  33 -14.124   3.243   4.279
  255   1HB   ASN  33          2HB       ASN  33 -14.794   2.164   6.418
  256   2HB   ASN  33          1HB       ASN  33 -13.091   1.950   6.811
  257   1HD2  ASN  33          1HD2      ASN  33 -11.850   3.729   7.361
  258   2HD2  ASN  33          2HD2      ASN  33 -12.553   5.249   7.787
  259    H    ILE  34           H        ILE  34 -12.484   3.582   2.722
  260    HA   ILE  34           HA       ILE  34  -9.918   4.244   3.994
  261    HB   ILE  34           HB       ILE  34 -10.090   2.723   1.391
  262   1HG1  ILE  34          2HG1      ILE  34  -8.447   1.248   2.790
  263   2HG1  ILE  34          1HG1      ILE  34  -9.195   2.053   4.166
  264   1HG2  ILE  34          1HG2      ILE  34  -7.627   2.852   1.391
  265   2HG2  ILE  34          2HG2      ILE  34  -7.720   3.976   2.747
  266   3HG2  ILE  34          3HG2      ILE  34  -8.406   4.419   1.185
  267   1HD1  ILE  34          1HD1      ILE  34 -10.383   0.144   2.214
  268   2HD1  ILE  34          2HD1      ILE  34 -11.416   1.307   3.040
  269   3HD1  ILE  34          3HD1      ILE  34 -10.466   0.153   3.975
  270    HA   PRO  35           HA       PRO  35 -11.612   7.780   1.602
  271   1HB   PRO  35          2HB       PRO  35 -11.010   9.685   3.381
  272   2HB   PRO  35          1HB       PRO  35 -12.393   8.608   3.622
  273   1HG   PRO  35          2HG       PRO  35  -9.611   8.373   4.743
  274   2HG   PRO  35          1HG       PRO  35 -11.162   8.311   5.616
  275   1HD   PRO  35          2HD       PRO  35  -9.863   6.069   4.899
  276   2HD   PRO  35          1HD       PRO  35 -11.636   6.163   4.860
  277    H    VAL  36           H        VAL  36  -9.908   7.460   0.046
  278    HA   VAL  36           HA       VAL  36  -7.871   9.514   0.227
  279    HB   VAL  36           HB       VAL  36  -6.048   8.002  -0.479
  280   1HG1  VAL  36          1HG1      VAL  36  -7.358   7.375   2.167
  281   2HG1  VAL  36          2HG1      VAL  36  -6.121   8.589   1.840
  282   3HG1  VAL  36          3HG1      VAL  36  -5.723   6.875   1.729
  283   1HG2  VAL  36          1HG2      VAL  36  -8.052   5.840   0.122
  284   2HG2  VAL  36          2HG2      VAL  36  -6.337   5.578  -0.192
  285   3HG2  VAL  36          3HG2      VAL  36  -7.374   6.240  -1.456
  286    H    ILE  37           H        ILE  37  -6.781   9.827  -1.919
  287    HA   ILE  37           HA       ILE  37  -8.775   9.411  -4.010
  288    HB   ILE  37           HB       ILE  37  -6.290  11.106  -4.177
  289   1HG1  ILE  37          2HG1      ILE  37  -7.692  11.872  -2.314
  290   2HG1  ILE  37          1HG1      ILE  37  -7.728  13.023  -3.646
  291   1HG2  ILE  37          1HG2      ILE  37  -7.268  10.502  -6.322
  292   2HG2  ILE  37          2HG2      ILE  37  -7.490  12.220  -5.993
  293   3HG2  ILE  37          3HG2      ILE  37  -8.837  11.101  -5.786
  294   1HD1  ILE  37          1HD1      ILE  37  -9.929  12.737  -2.679
  295   2HD1  ILE  37          2HD1      ILE  37  -9.863  11.003  -2.995
  296   3HD1  ILE  37          3HD1      ILE  37  -9.900  12.145  -4.340
  297    H    ALA  38           H        ALA  38  -8.537   8.032  -5.607
  298    HA   ALA  38           HA       ALA  38  -6.537   6.074  -5.621
  299   1HB   ALA  38          1HB       ALA  38  -8.829   5.809  -6.533
  300   2HB   ALA  38          2HB       ALA  38  -7.560   5.242  -7.619
  301   3HB   ALA  38          3HB       ALA  38  -8.348   6.792  -7.917
  302    H    GLU  39           H        GLU  39  -6.875   9.000  -7.618
  303    HA   GLU  39           HA       GLU  39  -4.621   8.301  -9.247
  304   1HB   GLU  39          2HB       GLU  39  -4.828  10.649 -10.093
  305   2HB   GLU  39          1HB       GLU  39  -6.271   9.662 -10.264
  306   1HG   GLU  39          2HG       GLU  39  -7.203  10.729  -8.249
  307   2HG   GLU  39          1HG       GLU  39  -5.775  11.759  -8.163
  308    H    GLN  40           H        GLN  40  -5.043   9.824  -6.208
  309    HA   GLN  40           HA       GLN  40  -2.731  11.430  -6.117
  310   1HB   GLN  40          2HB       GLN  40  -4.778  10.761  -4.356
  311   2HB   GLN  40          1HB       GLN  40  -3.332  10.126  -3.591
  312   1HG   GLN  40          2HG       GLN  40  -2.411  12.534  -4.218
  313   2HG   GLN  40          1HG       GLN  40  -4.129  12.922  -4.126
  314   1HE2  GLN  40          1HE2      GLN  40  -5.203  12.720  -2.148
  315   2HE2  GLN  40          2HE2      GLN  40  -4.347  12.623  -0.650
  316    H    VAL  41           H        VAL  41  -3.309   8.024  -5.517
  317    HA   VAL  41           HA       VAL  41  -0.579   7.562  -4.672
  318    HB   VAL  41           HB       VAL  41  -1.194   5.310  -4.250
  319   1HG1  VAL  41          1HG1      VAL  41  -3.590   6.991  -3.530
  320   2HG1  VAL  41          2HG1      VAL  41  -2.049   7.026  -2.671
  321   3HG1  VAL  41          3HG1      VAL  41  -3.011   5.548  -2.698
  322   1HG2  VAL  41          1HG2      VAL  41  -3.772   5.849  -5.711
  323   2HG2  VAL  41          2HG2      VAL  41  -3.316   4.339  -4.925
  324   3HG2  VAL  41          3HG2      VAL  41  -2.419   4.906  -6.332
  325    H    ALA  42           H        ALA  42  -2.417   7.558  -7.537
  326    HA   ALA  42           HA       ALA  42  -1.052   5.618  -9.044
  327   1HB   ALA  42          1HB       ALA  42  -3.226   6.532  -9.685
  328   2HB   ALA  42          2HB       ALA  42  -2.047   6.674 -10.990
  329   3HB   ALA  42          3HB       ALA  42  -2.468   8.088 -10.023
  330    H    ARG  43           H        ARG  43  -0.315   8.964  -8.326
  331    HA   ARG  43           HA       ARG  43   1.820   9.044 -10.302
  332   1HB   ARG  43          2HB       ARG  43   2.113  11.389  -9.510
  333   2HB   ARG  43          1HB       ARG  43   0.500  11.033 -10.114
  334   1HG   ARG  43          2HG       ARG  43  -0.052  12.178  -8.236
  335   2HG   ARG  43          1HG       ARG  43   0.035  10.551  -7.558
  336   1HD   ARG  43          2HD       ARG  43   1.208  12.070  -6.106
  337   2HD   ARG  43          1HD       ARG  43   2.377  11.007  -6.888
  338    HE   ARG  43           HE       ARG  43   2.139  13.328  -8.427
  339   1HH1  ARG  43          1HH1      ARG  43   3.289  12.349  -5.286
  340   2HH1  ARG  43          2HH1      ARG  43   4.485  13.599  -5.194
  341   1HH2  ARG  43          1HH2      ARG  43   3.708  14.976  -8.312
  342   2HH2  ARG  43          2HH2      ARG  43   4.724  15.092  -6.913
  343    H    GLU  44           H        GLU  44   1.504   8.096  -7.076
  344    HA   GLU  44           HA       GLU  44   4.376   8.537  -6.603
  345   1HB   GLU  44          2HB       GLU  44   3.775   8.252  -4.202
  346   2HB   GLU  44          1HB       GLU  44   3.245   9.754  -4.941
  347   1HG   GLU  44          2HG       GLU  44   1.014   8.786  -5.210
  348   2HG   GLU  44          1HG       GLU  44   1.575   7.307  -4.439
  349    H    GLN  45           H        GLN  45   2.932   6.260  -7.881
  350    HA   GLN  45           HA       GLN  45   3.457   4.080  -6.025
  351   1HB   GLN  45          2HB       GLN  45   1.269   4.043  -7.092
  352   2HB   GLN  45          1HB       GLN  45   2.011   4.160  -8.682
  353   1HG   GLN  45          2HG       GLN  45   3.200   1.943  -7.935
  354   2HG   GLN  45          1HG       GLN  45   1.824   1.837  -6.836
  355   1HE2  GLN  45          1HE2      GLN  45   2.885   1.730 -10.125
  356   2HE2  GLN  45          2HE2      GLN  45   1.401   1.165 -10.806
  357    HA   PRO  46           HA       PRO  46   7.512   4.170  -8.240
  358   1HB   PRO  46          2HB       PRO  46   8.267   1.948  -6.663
  359   2HB   PRO  46          1HB       PRO  46   8.698   3.639  -6.389
  360   1HG   PRO  46          2HG       PRO  46   6.483   2.029  -5.199
  361   2HG   PRO  46          1HG       PRO  46   7.489   3.283  -4.446
  362   1HD   PRO  46          2HD       PRO  46   5.000   3.814  -5.148
  363   2HD   PRO  46          1HD       PRO  46   6.279   5.005  -5.477
  364    H    GLU  47           H        GLU  47   7.407   3.323 -10.219
  365    HA   GLU  47           HA       GLU  47   6.025   1.024 -10.992
  366   1HB   GLU  47          2HB       GLU  47   6.521   2.453 -12.751
  367   2HB   GLU  47          1HB       GLU  47   8.185   2.685 -12.229
  368   1HG   GLU  47          2HG       GLU  47   8.689   0.374 -12.927
  369   2HG   GLU  47          1HG       GLU  47   7.039   0.229 -13.540
  370    H    ASN  48           H        ASN  48   9.260   1.440  -9.767
  371    HA   ASN  48           HA       ASN  48  10.410  -0.988 -10.539
  372   1HB   ASN  48          2HB       ASN  48  11.681   0.895  -9.569
  373   2HB   ASN  48          1HB       ASN  48  10.919   0.594  -8.010
  374   1HD2  ASN  48          1HD2      ASN  48  12.872   0.206  -6.999
  375   2HD2  ASN  48          2HD2      ASN  48  13.784  -1.236  -7.270
  376    H    LEU  49           H        LEU  49   8.013  -0.273  -8.185
  377    HA   LEU  49           HA       LEU  49   8.160  -3.036  -7.164
  378   1HB   LEU  49          2HB       LEU  49   7.435  -0.473  -5.784
  379   2HB   LEU  49          1HB       LEU  49   6.823  -2.002  -5.193
  380    HG   LEU  49           HG       LEU  49   8.774  -1.364  -3.923
  381   1HD1  LEU  49          1HD1      LEU  49  10.122  -3.351  -4.178
  382   2HD1  LEU  49          2HD1      LEU  49   9.476  -3.615  -5.800
  383   3HD1  LEU  49          3HD1      LEU  49   8.417  -3.753  -4.396
  384   1HD2  LEU  49          1HD2      LEU  49   9.784   0.046  -5.724
  385   2HD2  LEU  49          2HD2      LEU  49  10.358  -1.440  -6.482
  386   3HD2  LEU  49          3HD2      LEU  49  10.928  -0.993  -4.875
  387    H    ARG  50           H        ARG  50   6.688  -1.597  -9.436
  388    HA   ARG  50           HA       ARG  50   3.961  -1.465  -8.927
  389   1HB   ARG  50          2HB       ARG  50   5.165  -0.762 -11.041
  390   2HB   ARG  50          1HB       ARG  50   5.174  -2.454 -11.511
  391   1HG   ARG  50          2HG       ARG  50   2.744  -2.494 -11.499
  392   2HG   ARG  50          1HG       ARG  50   2.709  -0.811 -10.972
  393   1HD   ARG  50          2HD       ARG  50   2.333  -0.800 -13.313
  394   2HD   ARG  50          1HD       ARG  50   3.987  -0.242 -13.062
  395    HE   ARG  50           HE       ARG  50   4.232  -2.929 -13.460
  396   1HH1  ARG  50          1HH1      ARG  50   2.804  -0.303 -15.252
  397   2HH1  ARG  50          2HH1      ARG  50   3.087  -1.033 -16.797
  398   1HH2  ARG  50          1HH2      ARG  50   4.606  -3.898 -15.491
  399   2HH2  ARG  50          2HH2      ARG  50   4.109  -3.075 -16.932
  400    H    THR  51           H        THR  51   6.061  -4.152  -9.125
  401    HA   THR  51           HA       THR  51   4.154  -6.161  -9.766
  402    HB   THR  51           HB       THR  51   6.694  -6.565  -8.182
  403    HG1  THR  51           1HG      THR  51   7.574  -5.702  -9.934
  404   1HG2  THR  51          1HG2      THR  51   5.191  -8.347 -10.098
  405   2HG2  THR  51          2HG2      THR  51   5.191  -8.492  -8.340
  406   3HG2  THR  51          3HG2      THR  51   6.679  -8.763  -9.247
  407    H    TYR  52           H        TYR  52   5.525  -4.949  -6.723
  408    HA   TYR  52           HA       TYR  52   4.143  -6.671  -4.988
  409   1HB   TYR  52          2HB       TYR  52   6.136  -5.264  -4.412
  410   2HB   TYR  52          1HB       TYR  52   5.094  -3.848  -4.446
  411    HD1  TYR  52           1HD      TYR  52   5.239  -3.133  -2.209
  412    HD2  TYR  52           2HD      TYR  52   4.250  -7.187  -3.053
  413    HE1  TYR  52           1HE      TYR  52   4.664  -3.480   0.146
  414    HE2  TYR  52           2HE      TYR  52   3.670  -7.540  -0.703
  415    HH   TYR  52           HH       TYR  52   3.265  -5.000   1.502
  416    H    PHE  53           H        PHE  53   3.480  -3.338  -5.994
  417    HA   PHE  53           HA       PHE  53   1.168  -2.801  -4.693
  418   1HB   PHE  53          2HB       PHE  53   1.688  -0.996  -5.933
  419   2HB   PHE  53          1HB       PHE  53   2.327  -1.956  -7.262
  420    HD1  PHE  53           1HD      PHE  53  -0.650  -0.366  -5.845
  421    HD2  PHE  53           2HD      PHE  53   0.914  -2.617  -9.099
  422    HE1  PHE  53           1HE      PHE  53  -2.666   0.139  -7.156
  423    HE2  PHE  53           2HE      PHE  53  -1.098  -2.115 -10.420
  424    HZ   PHE  53           HZ       PHE  53  -2.885  -0.705  -9.450
  425    H    MET  54           H        MET  54   1.431  -4.766  -7.665
  426    HA   MET  54           HA       MET  54  -1.357  -5.178  -7.922
  427   1HB   MET  54          2HB       MET  54   0.934  -6.874  -8.928
  428   2HB   MET  54          1HB       MET  54  -0.737  -6.982  -9.470
  429   1HG   MET  54          2HG       MET  54  -0.647  -4.823 -10.444
  430   2HG   MET  54          1HG       MET  54   0.912  -4.489  -9.696
  431   1HE   MET  54          1HE       MET  54   0.261  -7.528 -13.107
  432   2HE   MET  54          2HE       MET  54  -1.023  -6.580 -12.358
  433   3HE   MET  54          3HE       MET  54  -0.224  -7.858 -11.446
  434    H    GLU  55           H        GLU  55   1.218  -6.992  -6.298
  435    HA   GLU  55           HA       GLU  55  -0.202  -9.286  -5.633
  436   1HB   GLU  55          2HB       GLU  55   1.905  -7.833  -4.016
  437   2HB   GLU  55          1HB       GLU  55   1.376  -9.485  -3.726
  438   1HG   GLU  55          2HG       GLU  55   2.162 -10.107  -5.970
  439   2HG   GLU  55          1HG       GLU  55   2.743  -8.460  -6.200
  440    H    ARG  56           H        ARG  56   0.180  -6.290  -3.752
  441    HA   ARG  56           HA       ARG  56  -1.711  -7.040  -1.774
  442   1HB   ARG  56          2HB       ARG  56   0.054  -4.850  -2.250
  443   2HB   ARG  56          1HB       ARG  56  -1.553  -4.195  -1.968
  444   1HG   ARG  56          2HG       ARG  56  -0.354  -4.315   0.112
  445   2HG   ARG  56          1HG       ARG  56  -1.680  -5.479   0.132
  446   1HD   ARG  56          2HD       ARG  56  -0.122  -7.276  -0.411
  447   2HD   ARG  56          1HD       ARG  56   1.207  -6.119  -0.473
  448    HE   ARG  56           HE       ARG  56   0.146  -5.810   2.022
  449   1HH1  ARG  56          1HH1      ARG  56   1.419  -8.497   0.204
  450   2HH1  ARG  56          2HH1      ARG  56   1.989  -9.339   1.606
  451   1HH2  ARG  56          1HH2      ARG  56   0.893  -6.913   3.871
  452   2HH2  ARG  56          2HH2      ARG  56   1.688  -8.442   3.689
  453    H    LEU  57           H        LEU  57  -1.883  -5.350  -4.832
  454    HA   LEU  57           HA       LEU  57  -4.432  -4.258  -4.666
  455   1HB   LEU  57          2HB       LEU  57  -2.946  -3.749  -6.503
  456   2HB   LEU  57          1HB       LEU  57  -2.990  -5.412  -7.050
  457    HG   LEU  57           HG       LEU  57  -5.382  -5.157  -7.596
  458   1HD1  LEU  57          1HD1      LEU  57  -5.993  -3.433  -6.013
  459   2HD1  LEU  57          2HD1      LEU  57  -6.351  -2.893  -7.652
  460   3HD1  LEU  57          3HD1      LEU  57  -4.925  -2.282  -6.813
  461   1HD2  LEU  57          1HD2      LEU  57  -3.557  -3.120  -8.860
  462   2HD2  LEU  57          2HD2      LEU  57  -5.068  -3.710  -9.551
  463   3HD2  LEU  57          3HD2      LEU  57  -3.712  -4.814  -9.322
  464    H    ARG  58           H        ARG  58  -3.593  -7.357  -6.213
  465    HA   ARG  58           HA       ARG  58  -6.181  -8.266  -6.629
  466   1HB   ARG  58          2HB       ARG  58  -5.169 -10.518  -6.784
  467   2HB   ARG  58          1HB       ARG  58  -4.278  -9.309  -7.691
  468   1HG   ARG  58          2HG       ARG  58  -2.622  -9.170  -5.914
  469   2HG   ARG  58          1HG       ARG  58  -3.514 -10.372  -4.984
  470   1HD   ARG  58          2HD       ARG  58  -1.701 -11.471  -6.099
  471   2HD   ARG  58          1HD       ARG  58  -3.210 -11.965  -6.865
  472    HE   ARG  58           HE       ARG  58  -2.238  -9.790  -8.291
  473   1HH1  ARG  58          1HH1      ARG  58  -1.283 -13.062  -7.566
  474   2HH1  ARG  58          2HH1      ARG  58  -0.395 -13.265  -9.040
  475   1HH2  ARG  58          1HH2      ARG  58  -1.072 -10.049 -10.233
  476   2HH2  ARG  58          2HH2      ARG  58  -0.275 -11.553 -10.556
  477    H    HIS  59           H        HIS  59  -4.048  -8.703  -3.848
  478    HA   HIS  59           HA       HIS  59  -5.736 -10.446  -2.405
  479   1HB   HIS  59          2HB       HIS  59  -3.297 -10.032  -1.947
  480   2HB   HIS  59          1HB       HIS  59  -3.753  -8.487  -1.237
  481    HD1  HIS  59           1HD      HIS  59  -3.709 -12.140  -0.569
  482    HD2  HIS  59           2HD      HIS  59  -5.089  -8.671   1.254
  483    HE1  HIS  59           1HE      HIS  59  -4.272 -12.799   1.790
  484    HE2  HIS  59           2HE      HIS  59  -5.079 -10.678   2.884
  485    H    TYR  60           H        TYR  60  -5.266  -6.933  -2.149
  486    HA   TYR  60           HA       TYR  60  -7.068  -6.348  -0.155
  487   1HB   TYR  60          2HB       TYR  60  -6.067  -4.822  -2.525
  488   2HB   TYR  60          1HB       TYR  60  -7.395  -4.148  -1.590
  489    HD1  TYR  60           1HD      TYR  60  -4.251  -3.447  -2.062
  490    HD2  TYR  60           2HD      TYR  60  -6.615  -4.899   1.163
  491    HE1  TYR  60           1HE      TYR  60  -2.648  -2.492  -0.462
  492    HE2  TYR  60           2HE      TYR  60  -5.018  -3.945   2.771
  493    HH   TYR  60           HH       TYR  60  -2.658  -3.268   2.841
  494    H    ARG  61           H        ARG  61  -7.664  -6.989  -3.547
  495    HA   ARG  61           HA       ARG  61 -10.359  -6.172  -3.635
  496   1HB   ARG  61          2HB       ARG  61  -8.873  -8.227  -5.274
  497   2HB   ARG  61          1HB       ARG  61 -10.511  -7.693  -5.628
  498   1HG   ARG  61          2HG       ARG  61  -9.699  -5.406  -5.923
  499   2HG   ARG  61          1HG       ARG  61  -8.058  -5.950  -5.578
  500   1HD   ARG  61          2HD       ARG  61  -8.229  -7.493  -7.522
  501   2HD   ARG  61          1HD       ARG  61  -9.797  -6.777  -7.897
  502    HE   ARG  61           HE       ARG  61  -7.491  -4.996  -7.721
  503   1HH1  ARG  61          1HH1      ARG  61  -9.812  -6.683  -9.701
  504   2HH1  ARG  61          2HH1      ARG  61  -9.497  -5.724 -11.107
  505   1HH2  ARG  61          1HH2      ARG  61  -7.074  -3.732  -9.564
  506   2HH2  ARG  61          2HH2      ARG  61  -7.940  -4.046 -11.030
  507    H    GLN  62           H        GLN  62  -8.876  -9.306  -2.923
  508    HA   GLN  62           HA       GLN  62 -11.257 -10.775  -2.661
  509   1HB   GLN  62          2HB       GLN  62  -8.590 -11.180  -1.292
  510   2HB   GLN  62          1HB       GLN  62  -9.880 -12.373  -1.367
  511   1HG   GLN  62          2HG       GLN  62  -9.681 -12.473  -3.782
  512   2HG   GLN  62          1HG       GLN  62  -8.436 -11.224  -3.744
  513   1HE2  GLN  62          1HE2      GLN  62  -6.920 -12.556  -4.716
  514   2HE2  GLN  62          2HE2      GLN  62  -6.171 -13.869  -3.879
  515    H    LEU  63           H        LEU  63  -9.437  -8.788  -0.401
  516    HA   LEU  63           HA       LEU  63 -11.176  -9.463   1.809
  517   1HB   LEU  63          2HB       LEU  63  -8.990  -7.391   1.603
  518   2HB   LEU  63          1HB       LEU  63  -9.843  -7.838   3.067
  519    HG   LEU  63           HG       LEU  63  -8.041  -9.660   1.470
  520   1HD1  LEU  63          1HD1      LEU  63  -7.618  -8.355   4.155
  521   2HD1  LEU  63          2HD1      LEU  63  -6.843  -7.869   2.647
  522   3HD1  LEU  63          3HD1      LEU  63  -6.509  -9.458   3.338
  523   1HD2  LEU  63          1HD2      LEU  63  -9.819 -10.904   2.559
  524   2HD2  LEU  63          2HD2      LEU  63  -9.475 -10.094   4.088
  525   3HD2  LEU  63          3HD2      LEU  63  -8.285 -11.186   3.382
  526    H    SER  64           H        SER  64 -11.023  -7.206  -0.741
  527    HA   SER  64           HA       SER  64 -12.368  -5.028   0.418
  528   1HB   SER  64          2HB       SER  64 -12.571  -4.177  -1.731
  529   2HB   SER  64          1HB       SER  64 -11.230  -5.301  -1.950
  530    HG   SER  64           HG       SER  64 -13.454  -5.276  -3.286
  531    H    LEU  65           H        LEU  65 -13.409  -8.086  -0.885
  532    HA   LEU  65           HA       LEU  65 -16.210  -7.447  -0.798
  533   1HB   LEU  65          2HB       LEU  65 -14.954 -10.182  -0.986
  534   2HB   LEU  65          1HB       LEU  65 -16.568  -9.712  -1.484
  535    HG   LEU  65           HG       LEU  65 -14.033  -8.724  -2.794
  536   1HD1  LEU  65          1HD1      LEU  65 -14.596 -10.252  -4.616
  537   2HD1  LEU  65          2HD1      LEU  65 -15.946 -10.884  -3.672
  538   3HD1  LEU  65          3HD1      LEU  65 -14.290 -11.125  -3.115
  539   1HD2  LEU  65          1HD2      LEU  65 -16.898  -8.570  -3.713
  540   2HD2  LEU  65          2HD2      LEU  65 -15.485  -7.890  -4.520
  541   3HD2  LEU  65          3HD2      LEU  65 -16.011  -7.241  -2.968
  542    H    GLN  66           H        GLN  66 -13.985  -9.464   1.137
  543    HA   GLN  66           HA       GLN  66 -15.981 -10.297   2.971
  544   1HB   GLN  66          2HB       GLN  66 -14.356 -11.536   3.951
  545   2HB   GLN  66          1HB       GLN  66 -13.495 -11.165   2.468
  546   1HG   GLN  66          2HG       GLN  66 -11.965 -10.814   4.210
  547   2HG   GLN  66          1HG       GLN  66 -12.476  -9.207   3.697
  548   1HE2  GLN  66          1HE2      GLN  66 -12.223  -8.075   5.518
  549   2HE2  GLN  66          2HE2      GLN  66 -13.057  -8.384   6.996
  550    H    LEU  67           H        LEU  67 -13.514  -7.727   3.205
  551    HA   LEU  67           HA       LEU  67 -13.920  -6.851   5.757
  552   1HB   LEU  67          2HB       LEU  67 -12.871  -5.693   3.314
  553   2HB   LEU  67          1HB       LEU  67 -13.630  -4.483   4.327
  554    HG   LEU  67           HG       LEU  67 -12.178  -5.612   6.221
  555   1HD1  LEU  67          1HD1      LEU  67 -11.398  -7.355   4.544
  556   2HD1  LEU  67          2HD1      LEU  67 -10.172  -6.579   5.542
  557   3HD1  LEU  67          3HD1      LEU  67 -10.389  -6.079   3.865
  558   1HD2  LEU  67          1HD2      LEU  67 -10.987  -3.767   4.157
  559   2HD2  LEU  67          2HD2      LEU  67 -10.442  -3.966   5.822
  560   3HD2  LEU  67          3HD2      LEU  67 -12.031  -3.277   5.490
  561    HA   PRO  68           HA       PRO  68 -17.819  -4.948   6.372
  562   1HB   PRO  68          2HB       PRO  68 -17.357  -2.419   7.198
  563   2HB   PRO  68          1HB       PRO  68 -16.970  -3.835   8.193
  564   1HG   PRO  68          2HG       PRO  68 -15.160  -2.331   6.318
  565   2HG   PRO  68          1HG       PRO  68 -14.904  -2.678   8.050
  566   1HD   PRO  68          2HD       PRO  68 -13.794  -4.244   6.263
  567   2HD   PRO  68          1HD       PRO  68 -14.630  -4.992   7.640
  568    H    LYS  69           H        LYS  69 -18.836  -2.456   6.057
  569    HA   LYS  69           HA       LYS  69 -19.828  -1.090   4.543
  570   1HB   LYS  69          2HB       LYS  69 -17.256  -1.470   3.015
  571   2HB   LYS  69          1HB       LYS  69 -18.470  -0.248   2.664
  572   1HG   LYS  69          2HG       LYS  69 -16.964  -0.456   5.264
  573   2HG   LYS  69          1HG       LYS  69 -16.524   0.610   3.930
  574   1HD   LYS  69          2HD       LYS  69 -18.601   1.810   4.134
  575   2HD   LYS  69          1HD       LYS  69 -19.186   0.668   5.345
  576   1HE   LYS  69          2HE       LYS  69 -16.753   2.417   5.684
  577   2HE   LYS  69          1HE       LYS  69 -18.358   2.817   6.294
  578   1HZ   LYS  69          1HZ       LYS  69 -16.806   0.400   7.054
  579   2HZ   LYS  69          2HZ       LYS  69 -18.308   0.863   7.680
  580   3HZ   LYS  69          3HZ       LYS  69 -16.937   1.804   7.989
  581    H    GLY  70           H        GLY  70 -18.037  -2.878   2.135
  582   1HA   GLY  70          2HA       GLY  70 -18.853  -4.764   0.906
  583   2HA   GLY  70          1HA       GLY  70 -20.484  -4.310   1.373
  584    H    SER  71           H        SER  71 -19.488  -1.436   0.661
  585    HA   SER  71           HA       SER  71 -19.772  -0.016  -1.094
  586   1HB   SER  71          2HB       SER  71 -17.693  -1.259  -1.817
  587   2HB   SER  71          1HB       SER  71 -18.733  -2.288  -2.800
  588    HG   SER  71           HG       SER  71 -17.985  -0.627  -4.084
  589    H    ASP  72           H        ASP  72 -20.579  -0.262  -3.683
  590    HA   ASP  72           HA       ASP  72 -23.338  -0.625  -3.470
  591   1HB   ASP  72          2HB       ASP  72 -21.617  -0.648  -5.958
  592   2HB   ASP  72          1HB       ASP  72 -23.368  -0.460  -5.939
  593    HA   PRO  73           HA       PRO  73 -24.354  -4.900  -3.727
  594   1HB   PRO  73          2HB       PRO  73 -25.883  -4.233  -6.195
  595   2HB   PRO  73          1HB       PRO  73 -26.393  -5.105  -4.750
  596   1HG   PRO  73          2HG       PRO  73 -27.103  -2.551  -5.224
  597   2HG   PRO  73          1HG       PRO  73 -26.879  -3.204  -3.594
  598   1HD   PRO  73          2HD       PRO  73 -25.213  -1.301  -5.091
  599   2HD   PRO  73          1HD       PRO  73 -25.302  -1.609  -3.350
  600    H    ALA  74           H        ALA  74 -24.241  -3.762  -7.110
  601    HA   ALA  74           HA       ALA  74 -22.779  -6.141  -7.881
  602   1HB   ALA  74          1HB       ALA  74 -23.055  -5.313 -10.166
  603   2HB   ALA  74          2HB       ALA  74 -23.737  -3.812  -9.539
  604   3HB   ALA  74          3HB       ALA  74 -24.590  -5.338  -9.299
  605    H    TYR  75           H        TYR  75 -21.656  -3.749  -6.275
  606    HA   TYR  75           HA       TYR  75 -19.756  -2.552  -6.093
  607   1HB   TYR  75          2HB       TYR  75 -18.984  -5.039  -7.496
  608   2HB   TYR  75          1HB       TYR  75 -17.769  -3.819  -7.167
  609    HD1  TYR  75           1HD      TYR  75 -20.271  -6.036  -5.576
  610    HD2  TYR  75           2HD      TYR  75 -16.817  -3.622  -5.008
  611    HE1  TYR  75           1HE      TYR  75 -20.031  -6.928  -3.297
  612    HE2  TYR  75           2HE      TYR  75 -16.564  -4.510  -2.723
  613    HH   TYR  75           HH       TYR  75 -17.993  -5.545  -0.989
  614    H    GLN  76           H        GLN  76 -17.647  -1.909  -7.581
  615    HA   GLN  76           HA       GLN  76 -18.843  -0.442  -9.806
  616   1HB   GLN  76          2HB       GLN  76 -16.200  -0.098  -8.385
  617   2HB   GLN  76          1HB       GLN  76 -16.749   0.903  -9.722
  618   1HG   GLN  76          2HG       GLN  76 -17.198   2.124  -7.770
  619   2HG   GLN  76          1HG       GLN  76 -18.749   1.483  -8.309
  620   1HE2  GLN  76          1HE2      GLN  76 -19.793  -0.051  -7.088
  621   2HE2  GLN  76          2HE2      GLN  76 -19.312  -0.457  -5.480
  622    H    LYS  77           H        LYS  77 -18.650  -1.232 -11.784
  623    HA   LYS  77           HA       LYS  77 -16.567  -3.156 -12.415
  624   1HB   LYS  77          2HB       LYS  77 -18.991  -2.151 -13.901
  625   2HB   LYS  77          1HB       LYS  77 -17.809  -3.223 -14.640
  626   1HG   LYS  77          2HG       LYS  77 -18.510  -5.019 -13.481
  627   2HG   LYS  77          1HG       LYS  77 -18.868  -4.085 -12.031
  628   1HD   LYS  77          2HD       LYS  77 -20.903  -5.012 -13.018
  629   2HD   LYS  77          1HD       LYS  77 -20.915  -3.250 -13.060
  630   1HE   LYS  77          2HE       LYS  77 -20.190  -3.327 -15.414
  631   2HE   LYS  77          1HE       LYS  77 -20.249  -5.088 -15.357
  632   1HZ   LYS  77          1HZ       LYS  77 -22.565  -3.285 -14.904
  633   2HZ   LYS  77          2HZ       LYS  77 -22.609  -4.976 -14.916
  634   3HZ   LYS  77          3HZ       LYS  77 -22.254  -4.131 -16.337
  635    H    ASP  78           H        ASP  78 -14.655  -2.069 -12.627
  636    HA   ASP  78           HA       ASP  78 -14.533   0.286 -14.344
  637   1HB   ASP  78          2HB       ASP  78 -13.345   0.373 -12.203
  638   2HB   ASP  78          1HB       ASP  78 -12.395  -1.037 -12.662
  639    H    ASP  79           H        ASP  79 -13.688  -3.084 -14.330
  640    HA   ASP  79           HA       ASP  79 -12.058  -2.813 -16.731
  641   1HB   ASP  79          2HB       ASP  79 -12.756  -5.246 -15.076
  642   2HB   ASP  79          1HB       ASP  79 -11.661  -5.243 -16.456
  643    H    ALA  80           H        ALA  80 -15.166  -2.607 -16.354
  644    HA   ALA  80           HA       ALA  80 -17.019  -3.027 -17.610
  645   1HB   ALA  80          1HB       ALA  80 -15.567  -2.161 -19.404
  646   2HB   ALA  80          2HB       ALA  80 -16.713  -3.365 -19.990
  647   3HB   ALA  80          3HB       ALA  80 -15.024  -3.806 -19.737
  648    H    VAL  81           H        VAL  81 -15.872  -5.163 -15.962
  649    HA   VAL  81           HA       VAL  81 -16.702  -7.551 -17.465
  650    HB   VAL  81           HB       VAL  81 -15.191  -7.416 -14.851
  651   1HG1  VAL  81          1HG1      VAL  81 -16.437  -9.469 -15.054
  652   2HG1  VAL  81          2HG1      VAL  81 -14.724  -9.803 -15.311
  653   3HG1  VAL  81          3HG1      VAL  81 -15.825  -9.723 -16.688
  654   1HG2  VAL  81          1HG2      VAL  81 -13.232  -8.092 -16.172
  655   2HG2  VAL  81          2HG2      VAL  81 -13.845  -6.511 -16.656
  656   3HG2  VAL  81          3HG2      VAL  81 -14.184  -7.929 -17.648
  657    H    LYS  82           H        LYS  82 -18.728  -8.148 -17.160
  658    HA   LYS  82           HA       LYS  82 -20.400  -7.188 -15.123
  659   1HB   LYS  82          2HB       LYS  82 -21.920  -9.088 -15.869
  660   2HB   LYS  82          1HB       LYS  82 -21.445  -7.931 -17.104
  661   1HG   LYS  82          2HG       LYS  82 -19.560  -9.628 -17.621
  662   2HG   LYS  82          1HG       LYS  82 -20.583 -10.767 -16.740
  663   1HD   LYS  82          2HD       LYS  82 -22.452 -10.213 -18.251
  664   2HD   LYS  82          1HD       LYS  82 -21.382  -9.136 -19.149
  665   1HE   LYS  82          2HE       LYS  82 -19.944 -11.027 -19.715
  666   2HE   LYS  82          1HE       LYS  82 -20.997 -12.107 -18.800
  667   1HZ   LYS  82          1HZ       LYS  82 -21.478 -12.216 -21.158
  668   2HZ   LYS  82          2HZ       LYS  82 -21.777 -10.552 -21.208
  669   3HZ   LYS  82          3HZ       LYS  82 -22.801 -11.568 -20.325
  670    H    LYS  83           H        LYS  83 -21.087  -8.025 -13.200
  671    HA   LYS  83           HA       LYS  83 -21.008  -9.194 -11.253
  672   1HB   LYS  83          2HB       LYS  83 -21.759 -11.071 -12.678
  673   2HB   LYS  83          1HB       LYS  83 -20.080 -11.483 -13.001
  674   1HG   LYS  83          2HG       LYS  83 -19.797 -11.784 -10.513
  675   2HG   LYS  83          1HG       LYS  83 -21.553 -11.656 -10.388
  676   1HD   LYS  83          2HD       LYS  83 -21.819 -13.576 -11.853
  677   2HD   LYS  83          1HD       LYS  83 -20.070 -13.681 -12.065
  678   1HE   LYS  83          2HE       LYS  83 -19.850 -14.049  -9.621
  679   2HE   LYS  83          1HE       LYS  83 -21.609 -14.072  -9.500
  680   1HZ   LYS  83          1HZ       LYS  83 -21.662 -15.990 -10.951
  681   2HZ   LYS  83          2HZ       LYS  83 -20.669 -16.305  -9.617
  682   3HZ   LYS  83          3HZ       LYS  83 -19.979 -15.953 -11.121