*HEADER    HORMONE/GROWTH FACTOR                   16-APR-04   1T1P              
*TITLE     NMR STRUCTURE OF HUMAN INSULIN MUTANT HIS-B10-ASP, VAL-B12-           
*TITLE    2 THR, PRO-B28-LYS, LYS-B29-PRO, 15 STRUCTURES                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INSULIN;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: INSULIN A CHAIN;                                           
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES;                                                       
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: INSULIN;                                                   
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 FRAGMENT: INSULIN B CHAIN;                                           
*COMPND  11 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO                   
*SOURCE   5 SAPIENS(HUMAN);                                                      
*SOURCE   6 MOL_ID: 2;                                                           
*SOURCE   7 SYNTHETIC: YES;                                                      
*SOURCE   8 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   9 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO                   
*SOURCE  10 SAPIENS(HUMAN)                                                       
*KEYWDS    THR-B12-DKP-INSULIN, PROTEIN UNFOLDING, INSULIN RECEPTOR,             
*KEYWDS   2 RECEPTOR BINDING                                                     
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    K.HUANG, B.XU, S.Q.HU, Y.C.CHU, Q.X.HUA, J.WHITTAKER,                 
*AUTHOR   2 S.H.NAKAGAWA, P.DE MEYTS, P.G.KATSOYANNIS, M.A.WEISS                 
*REVDAT   1   10-AUG-04 1T1P    0                                                

!BIOSYM restraint 1
!
#remote_prochiral_center
1:LEU_36:HD1*   1:LEU_36:HD2*   1:LEU_36:CD1    1:LEU_36:CD2    1:LEU_36:CG    
1:VAL_3:HG1*    1:VAL_3:HG2*    1:VAL_3:CG1     1:VAL_3:CG2     1:VAL_3:CB     
1:LEU_32:HD2*   1:LEU_32:HD1*   1:LEU_32:CD2    1:LEU_32:CD1    1:LEU_32:CG    
1:LEU_27:HD1*   1:LEU_27:HD2*   1:LEU_27:CD1    1:LEU_27:CD2    1:LEU_27:CG    
1:LEU_13:HD1*   1:LEU_13:HD2*   1:LEU_13:CD1    1:LEU_13:CD2    1:LEU_13:CG    
1:VAL_39:HG1*   1:VAL_39:HG2*   1:VAL_39:CG1    1:VAL_39:CG2    1:VAL_39:CB    
1:LEU_16:HD1*   1:LEU_16:HD2*   1:LEU_16:CD1    1:LEU_16:CD2    1:LEU_16:CG    
1:LEU_38:HD1*   1:LEU_38:HD2*   1:LEU_38:CD1    1:LEU_38:CD2    1:LEU_38:CG    
!
#chiral
1:ILE_2:CA         S
1:VAL_3:CA         S
1:GLU-_4:CA        S
1:GLN_5:CA         S
1:CYS_6:CA         R
1:CYS_7:CA         R
1:THR_8:CA         S
1:SER_9:CA         S
1:ILE_10:CA        S
1:CYS_11:CA        R
1:SER_12:CA        S
1:LEU_13:CA        S
1:TYR_14:CA        S
1:GLN_15:CA        S
1:LEU_16:CA        S
1:GLU-_17:CA       S
1:ASN_18:CA        S
1:TYR_19:CA        S
1:CYS_20:CA        R
1:ASNC_21:CA       S
1:PHEN_22:CA       S
1:VAL_23:CA        S
1:ASN_24:CA        S
1:GLN_25:CA        S
1:HIS_26:CA        S
1:LEU_27:CA        S
1:CYS_28:CA        R
1:SER_30:CA        S
1:ASP-_31:CA       S
1:LEU_32:CA        S
1:THR_33:CA        S
1:GLU-_34:CA       S
1:ALA_35:CA        S
1:LEU_36:CA        S
1:TYR_37:CA        S
1:LEU_38:CA        S
1:VAL_39:CA        S
1:CYS_40:CA        R
1:GLU-_42:CA       S
1:ARG+_43:CA       S
1:PHE_45:CA        S
1:PHE_46:CA        S
1:TYR_47:CA        S
1:THR_48:CA        S
1:LYS+_49:CA       S
1:PRO_50:CA        S
1:THRC_51:CA       S
1:ILE_2:CB         R
1:ILE_10:CB        R
1:THR_8:CB         R
1:THR_48:CB        R
!
#distance
1:GLYN_1:CA        1:VAL_3:CA          4.700  7.200  1.00  1.00 1000.000
1:ILE_2:CA         1:GLU-_4:CA         4.700  7.200  1.00  1.00 1000.000
1:VAL_3:CA         1:GLN_5:CA          4.700  7.200  1.00  1.00 1000.000
1:GLU-_4:CA        1:CYS_6:CA          4.700  7.200  1.00  1.00 1000.000
1:GLN_5:CA         1:CYS_7:CA          4.700  7.200  1.00  1.00 1000.000
1:CYS_6:CA         1:THR_8:CA          4.700  7.200  1.00  1.00 1000.000
1:CYS_7:CA         1:SER_9:CA          4.700  7.200  1.00  1.00 1000.000
1:THR_8:CA         1:ILE_10:CA         4.700  7.200  1.00  1.00 1000.000
1:SER_9:CA         1:CYS_11:CA         4.700  7.200  1.00  1.00 1000.000
1:ILE_10:CA        1:SER_12:CA         4.700  7.200  1.00  1.00 1000.000
1:CYS_11:CA        1:LEU_13:CA         4.700  7.200  1.00  1.00 1000.000
1:SER_12:CA        1:TYR_14:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_13:CA        1:GLN_15:CA         4.700  7.200  1.00  1.00 1000.000
1:TYR_14:CA        1:LEU_16:CA         4.700  7.200  1.00  1.00 1000.000
1:GLN_15:CA        1:GLU-_17:CA        4.700  7.200  1.00  1.00 1000.000
1:LEU_16:CA        1:ASN_18:CA         4.700  7.200  1.00  1.00 1000.000
1:GLU-_17:CA       1:TYR_19:CA         4.700  7.200  1.00  1.00 1000.000
1:ASN_18:CA        1:CYS_20:CA         4.700  7.200  1.00  1.00 1000.000
1:TYR_19:CA        1:ASNC_21:CA        4.700  7.200  1.00  1.00 1000.000
1:PHEN_22:CA       1:ASN_24:CA         4.700  7.200  1.00  1.00 1000.000
1:VAL_23:CA        1:GLN_25:CA         4.700  7.200  1.00  1.00 1000.000
1:ASN_24:CA        1:HIS_26:CA         4.700  7.200  1.00  1.00 1000.000
1:GLN_25:CA        1:LEU_27:CA         4.700  7.200  1.00  1.00 1000.000
1:HIS_26:CA        1:CYS_28:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_27:CA        1:GLY_29:CA         4.700  7.200  1.00  1.00 1000.000
1:CYS_28:CA        1:SER_30:CA         4.700  7.200  1.00  1.00 1000.000
1:GLY_29:CA        1:ASP-_31:CA        4.700  7.200  1.00  1.00 1000.000
1:SER_30:CA        1:LEU_32:CA         4.700  7.200  1.00  1.00 1000.000
1:ASP-_31:CA       1:THR_33:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_32:CA        1:GLU-_34:CA        4.700  7.200  1.00  1.00 1000.000
1:THR_33:CA        1:ALA_35:CA         4.700  7.200  1.00  1.00 1000.000
1:GLU-_34:CA       1:LEU_36:CA         4.700  7.200  1.00  1.00 1000.000
1:ALA_35:CA        1:TYR_37:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_36:CA        1:LEU_38:CA         4.700  7.200  1.00  1.00 1000.000
1:TYR_37:CA        1:VAL_39:CA         4.700  7.200  1.00  1.00 1000.000
1:LEU_38:CA        1:CYS_40:CA         4.700  7.200  1.00  1.00 1000.000
1:VAL_39:CA        1:GLY_41:CA         4.700  7.200  1.00  1.00 1000.000
1:CYS_40:CA        1:GLU-_42:CA        4.700  7.200  1.00  1.00 1000.000
1:GLY_41:CA        1:ARG+_43:CA        4.700  7.200  1.00  1.00 1000.000
1:GLU-_42:CA       1:GLY_44:CA         4.700  7.200  1.00  1.00 1000.000
1:ARG+_43:CA       1:PHE_45:CA         4.700  7.200  1.00  1.00 1000.000
1:GLY_44:CA        1:PHE_46:CA         4.700  7.200  1.00  1.00 1000.000
1:PHE_45:CA        1:TYR_47:CA         4.700  7.200  1.00  1.00 1000.000
1:PHE_46:CA        1:THR_48:CA         4.700  7.200  1.00  1.00 1000.000
1:TYR_47:CA        1:LYS+_49:CA        4.700  7.200  1.00  1.00 1000.000
1:THR_48:CA        1:PRO_50:CA         4.700  7.200  1.00  1.00 1000.000
1:LYS+_49:CA       1:THRC_51:CA        4.700  7.200  1.00  1.00 1000.000
1:SER_12:O         1:GLN_15:HN         2.300  2.600 10.00 10.00 1000.000
1:SER_12:O         1:GLN_15:N          2.700  3.300 10.00 10.00 1000.000
1:SER_12:HN        1:GLN_15:OE1        2.300  2.600 10.00 10.00 1000.000
1:SER_12:N         1:GLN_15:OE1        2.700  3.300 10.00 10.00 1000.000
1:SER_12:O         1:LEU_16:HN         2.300  2.600 10.00 10.00 1000.000
1:SER_12:O         1:LEU_16:N          2.700  3.300 10.00 10.00 1000.000
1:LEU_13:O         1:GLU-_17:HN        2.300  2.600 10.00 10.00 1000.000
1:LEU_13:O         1:GLU-_17:N         2.700  3.300 10.00 10.00 1000.000
1:TYR_14:O         1:GLU-_17:HN        2.300  2.600 10.00 10.00 1000.000
1:TYR_14:O         1:GLU-_17:N         2.700  3.300 10.00 10.00 1000.000
1:GLN_15:O         1:ASN_18:HN         2.300  2.600 10.00 10.00 1000.000
1:GLN_15:O         1:ASN_18:N          2.700  3.300 10.00 10.00 1000.000
1:LEU_16:O         1:TYR_19:HN         2.300  2.600 10.00 10.00 1000.000
1:LEU_16:O         1:TYR_19:N          2.700  3.300 10.00 10.00 1000.000
1:GLU-_17:O        1:CYS_20:HN         2.300  2.600 10.00 10.00 1000.000
1:GLU-_17:O        1:CYS_20:N          2.700  3.300 10.00 10.00 1000.000
1:GLN_25:O         1:CYS_11:HN         2.300  2.600 10.00 10.00 1000.000
1:GLN_25:O         1:CYS_11:N          2.700  3.600 10.00 10.00 1000.000
1:CYS_28:O         1:ASP-_31:HN        2.300  2.600 10.00 10.00 1000.000
1:CYS_28:O         1:ASP-_31:N         2.700  3.300 10.00 10.00 1000.000
1:GLY_29:O         1:LEU_32:HN         2.300  2.600 10.00 10.00 1000.000
1:GLY_29:O         1:LEU_32:N          2.700  3.300 10.00 10.00 1000.000
1:SER_30:O         1:THR_33:HN         2.300  2.600 10.00 10.00 1000.000
1:SER_30:O         1:THR_33:N          2.700  3.300 10.00 10.00 1000.000
1:GLY_29:O         1:THR_33:HN         2.300  2.600 10.00 10.00 1000.000
1:GLY_29:O         1:THR_33:N          2.700  3.300 10.00 10.00 1000.000
1:SER_30:O         1:GLU-_34:HN        2.300  2.600 10.00 10.00 1000.000
1:SER_30:O         1:GLU-_34:N         2.700  3.300 10.00 10.00 1000.000
1:ASP-_31:O        1:ALA_35:HN         2.300  2.600 10.00 10.00 1000.000
1:ASP-_31:O        1:ALA_35:N          2.700  3.300 10.00 10.00 1000.000
1:LEU_32:O         1:LEU_36:HN         2.300  2.600 10.00 10.00 1000.000
1:LEU_32:O         1:LEU_36:N          2.700  3.300 10.00 10.00 1000.000
1:THR_33:O         1:TYR_37:HN         2.300  2.600 10.00 10.00 1000.000
1:THR_33:O         1:TYR_37:N          2.700  3.300 10.00 10.00 1000.000
1:GLU-_34:O        1:LEU_38:HN         2.300  2.600 10.00 10.00 1000.000
1:GLU-_34:O        1:LEU_38:N          2.700  3.300 10.00 10.00 1000.000
1:ALA_35:O         1:VAL_39:HN         2.300  2.600 10.00 10.00 1000.000
1:ALA_35:O         1:VAL_39:N          2.700  3.300 10.00 10.00 1000.000
1:LEU_36:O         1:CYS_40:HN         2.300  2.600 10.00 10.00 1000.000
1:LEU_36:O         1:CYS_40:N          2.700  3.300 10.00 10.00 1000.000
1:TYR_19:O         1:PHE_46:HN         2.300  2.600 10.00 10.00 1000.000
1:TYR_19:O         1:PHE_46:N          2.700  3.500 10.00 10.00 1000.000
1:CYS_6:O          1:LEU_27:HN         2.300  2.600 10.00 10.00 1000.000
1:CYS_6:O          1:LEU_27:N          2.700  3.300 10.00 10.00 1000.000
1:GLY_44:O         1:ASNC_21:HN        2.300  2.600 10.00 10.00 1000.000
1:GLY_44:O         1:ASNC_21:N         2.700  3.300 10.00 10.00 1000.000
1:GLY_41:O         1:GLY_44:HN         2.300  2.600 10.00 10.00 1000.000
1:GLY_41:O         1:GLY_44:N          2.700  3.300 10.00 10.00 1000.000
1:TYR_37:O         1:GLY_41:HN         2.300  2.600 10.00 10.00 1000.000
1:TYR_37:O         1:GLY_41:N          2.700  3.300 10.00 10.00 1000.000
!
#NOE_distance
1:ILE_2:HA         1:ILE_2:HG2*       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HA         1:ILE_2:HG1*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HA         1:ILE_2:HD1*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HB         1:ILE_2:HD1*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HN         1:ILE_2:HB         -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HN         1:ILE_2:HG2*       -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HN         1:ILE_2:HD1*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HB         1:TYR_19:HE*       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HB         1:TYR_19:HD*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HG1*       1:LEU_16:HA        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HD1*       1:LEU_16:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HG2*       1:TYR_47:HD*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HA         1:GLN_5:HB1        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HA         1:GLN_5:HB2        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HG2*       1:TYR_19:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HG2*       1:TYR_19:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HG1*       1:TYR_19:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HD1*       1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_3:HN         1:ILE_2:HG2*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_3:HN         1:VAL_3:HB         -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_3:HN         1:VAL_3:HG1*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_3:HN         1:VAL_3:HG2*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_3:HA         1:VAL_3:HG1*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_3:HA         1:VAL_3:HG2*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_3:HA         1:LEU_32:HD2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_3:HA         1:LEU_32:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_3:HG1*       1:GLU-_4:HA        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_3:HG2*       1:GLU-_4:HA        -1.000  6.300  3.000 10.00 10.00 1000.000  0.00
1:VAL_3:HA         1:CYS_7:HN         -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HA        1:THR_8:HG*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HA        1:CYS_7:HB1        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HA        1:CYS_7:HB2        -1.000  3.700  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLN_5:HB1        -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLN_5:HB2        -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_4:HA        1:LEU_32:HD1*      -1.000  7.700  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLU-_4:HB1       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLU-_4:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLU-_4:HG*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:VAL_3:HB         -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:VAL_3:HG1*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:VAL_3:HG2*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:VAL_3:HA         -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:VAL_3:HN         -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HA        1:CYS_7:HN         -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_5:HA         1:GLN_5:HG*        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB2        1:LEU_27:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:LEU_32:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:CYS_11:HB1       -1.000  5.500  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:CYS_11:HB2       -1.000  5.500  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:ILE_10:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:LEU_27:HB1       -1.000  4.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB1        1:LEU_27:HB1       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB1        1:LEU_27:HB2       -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:CYS_6:HB2        1:LEU_27:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB2        1:LEU_27:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB2        1:LEU_32:HD2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB2        1:LEU_32:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB1        1:LEU_32:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB1        1:LEU_32:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:ILE_10:HG1*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_7:HA         1:VAL_3:HG1*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_7:HA         1:HIS_26:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_7:HA         1:HIS_26:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_7:HA         1:ILE_10:HG2*      -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:THR_8:HN         1:THR_8:HB         -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:THR_8:HN         1:THR_8:HG*        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:SER_9:HB*        1:GLN_5:HB1        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:SER_9:HB*        1:GLN_5:HB2        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_10:HN        1:ILE_10:HB        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_10:HN        1:ILE_10:HG1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_10:HN        1:ILE_10:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_10:HN        1:ILE_10:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ILE_10:HA        1:ILE_10:HG1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_10:HA        1:ILE_10:HG2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_10:HA        1:ILE_10:HD1*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:ILE_10:HB        1:ILE_10:HD1*      -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB1       1:GLN_15:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB1       1:GLN_15:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB2       1:GLN_15:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB2       1:GLN_15:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:SER_12:HA        1:LEU_13:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:SER_12:HB1       1:LEU_13:HN        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:SER_12:HB2       1:LEU_13:HN        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:SER_12:HB1       1:GLN_15:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:SER_12:HB2       1:GLN_15:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:GLN_15:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:GLN_15:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:LEU_13:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:LEU_13:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:LEU_13:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:LEU_13:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_13:HD1*      -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_13:HD2*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_16:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_16:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:VAL_39:HG1*      -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:VAL_39:HG2*      -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HD1*      1:LEU_16:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HD1*      1:LEU_16:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HD2*      1:LEU_16:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HD2*      1:LEU_16:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HD2*      1:SER_12:HA        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:TYR_14:HD*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:TYR_14:HB*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:TYR_14:HA        -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HE*       1:TYR_14:HA        -1.000  7.000  2.200 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:LEU_13:HG        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HA        1:GLU-_17:HB*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:GLN_15:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HA        1:LEU_16:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HA        1:LEU_16:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:TYR_14:HD*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:TYR_14:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HB1       1:GLU-_17:HN       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HB2       1:GLU-_17:HN       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:GLN_15:HB1       -1.000  3.600  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:GLN_15:HB2       -1.000  3.700  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:TYR_14:HB*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HA        1:GLU-_17:HB*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HA        1:GLU-_17:HG*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HA        1:ASN_18:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HG*       1:TYR_14:HN        -1.000  4.700  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:TYR_14:HN        -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:LEU_16:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HA        1:LEU_16:HD1*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HA        1:LEU_16:HD2*      -1.000  4.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HG        1:LEU_32:HD2*      -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HG        1:LEU_32:HD1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HA        1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_13:HD2*      -1.000  6.700  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HD1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HD2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLN_15:HG*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HG        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLU-_17:HN       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:VAL_39:HG1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:VAL_39:HG1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:VAL_39:HG2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:VAL_39:HG2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:GLU-_17:HB*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:GLU-_17:HG*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HA       1:GLU-_17:HG*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:TYR_19:HA        -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:TYR_19:HB2       -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:ASN_18:HB1       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:ASN_18:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASN_18:HD2*      1:GLN_15:HG*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:TYR_19:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:TYR_19:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:ASN_18:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HB1       1:LEU_36:HD2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HB1       1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HB2       1:LEU_36:HD2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:ASN_18:HA        -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:GLU-_17:HB*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:ILE_2:HG2*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:ILE_2:HD1*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:ILE_2:HD1*       -1.000  5.700  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_36:HD2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_16:HB1       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_16:HB2       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:TYR_19:HE*       -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:ASN_18:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:CYS_20:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_36:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:ILE_2:HG2*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:ILE_2:HG1*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HB1       1:ILE_2:HD1*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HB2       1:ILE_2:HD1*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:THR_48:HG2*      -1.000  8.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:CYS_20:HB1       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:CYS_20:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HA        1:PHE_45:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HA        1:PHE_45:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HA        1:PHE_45:HA        -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:TYR_19:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:TYR_19:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:VAL_39:HG1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HB1       1:VAL_39:HG1*      -1.000  7.300  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HA        1:CYS_40:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HA        1:CYS_40:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:PHE_45:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HB2       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:ASNC_21:HB1      -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:ASNC_21:HB2      -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:ASNC_21:HD2*     -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:PHE_46:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:ALA_35:HB*       -1.000  8.000  5.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HE*      1:ALA_35:HB*       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HE*      1:LEU_38:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HE*      1:LEU_38:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:LEU_13:HD1*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:LEU_13:HD2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HE*      1:LEU_13:HD1*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HE*      1:LEU_13:HD2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HB*      1:LEU_13:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HB*      1:LEU_13:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:VAL_39:HG2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_23:HA        1:VAL_23:HG*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ASN_24:HA        1:ILE_10:HD1*      -1.000  6.300  3.000 10.00 10.00 1000.000  0.00
1:ASN_24:HA        1:ILE_10:HG1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ASN_24:HA        1:ILE_10:HG2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HB2       1:ASN_24:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HA        1:GLN_25:HG*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HB1       1:ILE_10:HG1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HB2       1:ILE_10:HG1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HA        1:LEU_27:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HA        1:LEU_27:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HA        1:ILE_10:HG1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HA        1:ILE_10:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HA        1:ILE_10:HD1*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:ASP-_31:HB1      -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:ASP-_31:HB2      -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_27:HG        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_27:HD1*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_27:HD2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HB1       1:LEU_27:HD1*      -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HB2       1:LEU_27:HD1*      -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HB1       1:LEU_27:HD2*      -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HB2       1:LEU_27:HD2*      -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:CYS_7:HB1        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:LEU_27:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:LEU_32:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:SER_30:HA        1:THR_33:HG*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:SER_30:HN        1:THR_33:HN        -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:SER_30:HA        1:LEU_32:HB1       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:SER_30:HA        1:LEU_32:HB2       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:SER_30:HA        1:THR_33:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:SER_30:HB*       1:THR_33:HG*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:SER_30:HA        1:THR_33:HB        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:ASP-_31:HB1      -1.000  3.700  2.300 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:ASP-_31:HB2      -1.000  2.700  2.300 10.00 10.00 1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HB1      -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:LEU_32:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HN       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HG*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD2*      1:LEU_27:HA        -1.000  6.300  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:THR_33:HB        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:LEU_32:HB1       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:LEU_32:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:LEU_32:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:LEU_32:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_27:HB2       -1.000  4.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:ALA_35:HB*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD2*      1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD2*      1:CYS_28:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD2*      1:CYS_28:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD2*      1:CYS_28:HA        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD1*      1:CYS_28:HA        -1.000  5.500  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HB1       1:ASN_18:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HB2       1:ASN_18:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_32:HG        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_32:HD2*      -1.000  4.800  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_32:HD1*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_27:HD1*      -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_27:HD2*      -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:THR_33:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HG        1:LEU_36:HD1*      -1.000  4.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD1*      1:LEU_36:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD2*      1:LEU_36:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HD1*      1:LEU_36:HD1*      -1.000  7.000  2.700 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_36:HD1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HN        1:GLU-_34:HN       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HN        1:THR_33:HB        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HN        1:THR_33:HG*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_32:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_32:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_36:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_36:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_36:HG        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HN        1:GLU-_34:HA       -1.000  5.500  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_32:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HA        1:LEU_32:HD1*      -1.000  6.700  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HG*       1:PHE_45:HD*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:GLU-_34:HG*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:TYR_37:HB1       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:TYR_37:HB2       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:LEU_38:HB1       -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:LEU_38:HB2       -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HG*      1:TYR_37:HD*       -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HD2*      -1.000  7.500  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:ALA_35:HB*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:TYR_37:HB1       -1.000  5.500  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:TYR_37:HB2       -1.000  5.500  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:GLU-_34:HB1      -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:GLU-_34:HB2      -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_36:HB1       -1.000  6.700  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_36:HB2       -1.000  5.700  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_36:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_36:HB2       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_36:HG        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:VAL_39:HB        -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:GLU-_34:HB2      -1.000  5.300  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:THR_33:HA        -1.000  4.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:VAL_39:HG1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:LEU_36:HG        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:LEU_36:HD1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:LEU_36:HD2*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:LEU_16:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:LEU_16:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HB1       1:LEU_36:HD1*      -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HB2       1:LEU_36:HD1*      -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HB1       1:LEU_36:HD2*      -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HB2       1:LEU_36:HD2*      -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:ALA_35:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:ALA_35:HB*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:THR_33:HA        -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:THR_33:HB        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:TYR_37:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:TYR_37:HB2       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:THR_33:HG*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:THR_33:HB        -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:GLY_41:HA*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:GLU-_34:HA       -1.000  4.700  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HE*       1:THR_33:HG*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HE*       1:LEU_38:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:LEU_38:HB1       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:LEU_38:HB2       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:LEU_38:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:LEU_38:HD1*      -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:LEU_38:HD2*      -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_38:HN        -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:TYR_37:HA        1:LEU_36:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HA        1:PHE_45:HE*       -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_37:HA        1:PHE_45:HB1       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HA        1:PHE_45:HB2       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HA        1:CYS_40:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB1       1:PHE_45:HD*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB2       1:PHE_45:HD*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB1       1:PHE_45:HE*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB2       1:PHE_45:HE*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB1       1:GLU-_34:HB1      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB2       1:GLU-_34:HB1      -1.000  6.200  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB1       1:GLU-_34:HB2      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB2       1:GLU-_34:HB2      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:GLU-_34:HB1      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:GLU-_34:HB2      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB1       1:VAL_39:HN        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB2       1:VAL_39:HN        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:TYR_37:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:TYR_37:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HG        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HA        1:LEU_38:HG        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HA        1:LEU_38:HD1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HA        1:LEU_38:HD2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HB1       1:LEU_38:HD1*      -1.000  5.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HB1       1:LEU_38:HD2*      -1.000  5.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HB2       1:LEU_38:HD1*      -1.000  5.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HB2       1:LEU_38:HD2*      -1.000  5.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_39:HB        1:LEU_36:HD2*      -1.000  5.700  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HA        1:LEU_38:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HA        1:LEU_38:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_36:HA        -1.000  3.700  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:GLY_41:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:VAL_39:HB        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HB1       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:VAL_39:HG1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:VAL_39:HG2*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_39:HA        1:VAL_39:HG1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HA        1:VAL_39:HG2*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:TYR_37:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:CYS_40:HB1       -1.000  3.700  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:CYS_40:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:LEU_36:HA        -1.000  3.700  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HB        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:CYS_20:HB1       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:CYS_20:HB2       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:VAL_39:HG1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:VAL_39:HG2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HG1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HB1       1:VAL_39:HG1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HB1       1:VAL_39:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:GLY_41:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLY_41:HN        1:CYS_40:HB1       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLY_41:HN        1:TYR_37:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:GLY_41:HA*       -1.000  5.000  2.500 10.00 10.00 1000.000  0.00
1:GLU-_42:HA       1:GLU-_42:HG*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_42:HB1      1:ARG+_43:HA       -1.000  4.800  3.000 10.00 10.00 1000.000  0.00
1:GLU-_42:HB2      1:ARG+_43:HA       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:GLY_44:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_42:HA       1:GLY_44:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HB1      1:CYS_40:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HB2      1:CYS_40:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:ARG+_43:HG*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ARG+_43:HE       1:ARG+_43:HB1      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HE       1:ARG+_43:HB2      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HE       1:ARG+_43:HG*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HA       1:ARG+_43:HG*      -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:ARG+_43:HE       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HA       1:CYS_40:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HB1      1:ASNC_21:HB1      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HB1      1:ASNC_21:HB2      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_44:HN        1:ARG+_43:HA       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLY_44:HN        1:ARG+_43:HB1      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_44:HN        1:ARG+_43:HB2      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_44:HA*       1:PHE_45:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_44:HA*       1:PHE_45:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HN        1:GLY_44:HA*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:PHE_45:HN        1:PHE_45:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HN        1:PHE_45:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:GLY_44:HA*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:TYR_47:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:LEU_36:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:THR_33:HA        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HA        1:CYS_20:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HA        1:CYS_20:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB1       1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB1       1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HA        1:LEU_36:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HA        1:LEU_36:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB1       1:LEU_36:HB1       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB2       1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB2       1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB2       1:LEU_36:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:LEU_36:HD1*      -1.000  5.700  2.700 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:LEU_36:HD2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:LEU_36:HB1       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:LEU_36:HB2       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:PHE_45:HB1       -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:PHE_45:HB2       -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:CYS_40:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:PHE_46:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:TYR_37:HA        -1.000  4.300  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HZ        1:TYR_37:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HZ        1:TYR_37:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HZ        1:TYR_37:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:LEU_36:HD1*      -1.000  5.700  2.700 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:LEU_36:HD2*      -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:THR_33:HB        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HZ        1:THR_33:HB        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:THR_33:HA        -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HN        1:PHE_46:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:THR_33:HG*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:PHE_45:HB2       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:PHE_45:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HZ        1:THR_33:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HZ        1:THR_33:HG*       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HN        1:PHE_45:HD*       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:CYS_20:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_45:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_45:HB2       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_46:HB1       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_46:HB2       -1.000  4.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HD*       1:ASNC_21:HA       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HD*       1:THR_48:HG2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HD*       1:TYR_19:HA        -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_46:HD*       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_45:HD*       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HE*       1:ASNC_21:HA       -1.000  7.500  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HE*       1:TYR_19:HA        -1.000  7.500  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HE*       1:THR_48:HA        -1.000  7.500  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HE*       1:THR_48:HG2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HE*       1:LEU_36:HD1*      -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HE*       1:LEU_36:HD2*      -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:THR_33:HA        -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:THR_33:HB        1:GLU-_34:HN       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:LEU_36:HD1*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:LEU_36:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:THR_48:HG2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LYS+_49:HA       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:VAL_3:HG1*       -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:TYR_47:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:TYR_47:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:PHE_46:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:PHE_46:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:PHE_45:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HA        1:ILE_2:HG2*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HA        1:ILE_2:HD1*       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HA        1:TYR_19:HD*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB1       1:LEU_32:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB2       1:LEU_32:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB1       1:LEU_36:HD1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB2       1:LEU_36:HD1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LEU_32:HG        -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:VAL_3:HG1*       -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:VAL_3:HG2*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LEU_32:HD2*      -1.000  8.000  2.700 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LEU_32:HD1*      -1.000  7.500  2.700 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:ILE_2:HG2*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:ILE_2:HD1*       -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:THR_33:HG*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:THR_33:HG*       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:LEU_32:HD2*      -1.000  8.000  2.700 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:LEU_32:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:LEU_32:HB1       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:LEU_32:HB2       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LEU_32:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LEU_32:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:VAL_3:HG2*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:TYR_47:HD*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HA        1:LEU_32:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HA        1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HA        1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LYS+_49:HN       1:TYR_47:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LYS+_49:HA       1:LYS+_49:HG*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LYS+_49:HA       1:LYS+_49:HD*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD*       1:LYS+_49:HB1      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD*       1:LYS+_49:HB2      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD*       1:LYS+_49:HG*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HA        1:PRO_50:HG*       -1.000  4.000  2.700 10.00 10.00 1000.000  0.00
1:THRC_51:HN       1:THRC_51:HB       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:THRC_51:HN       1:PRO_50:HB*       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
!
#mixing_times
-9.990000E+02 
!
#NMR_dihedral
1:GLYN_1:C         1:ILE_2:N          1:ILE_2:CA         1:ILE_2:C          -90.000 -40.000 30.00 30.00 1000.000
1:ILE_2:C          1:VAL_3:N          1:VAL_3:CA         1:VAL_3:C          -90.000 -40.000 30.00 30.00 1000.000
1:VAL_3:C          1:GLU-_4:N         1:GLU-_4:CA        1:GLU-_4:C         -90.000 -40.000 30.00 30.00 1000.000
1:GLU-_4:C         1:GLN_5:N          1:GLN_5:CA         1:GLN_5:C          -90.000 -40.000 30.00 30.00 1000.000
1:GLN_5:C          1:CYS_6:N          1:CYS_6:CA         1:CYS_6:C          -90.000 -40.000 30.00 30.00 1000.000
1:SER_12:C         1:LEU_13:N         1:LEU_13:CA        1:LEU_13:C         -90.000 -40.000 30.00 30.00 1000.000
1:LEU_13:C         1:TYR_14:N         1:TYR_14:CA        1:TYR_14:C         -90.000 -40.000 30.00 30.00 1000.000
1:TYR_14:C         1:GLN_15:N         1:GLN_15:CA        1:GLN_15:C         -90.000 -40.000 30.00 30.00 1000.000
1:GLN_15:C         1:LEU_16:N         1:LEU_16:CA        1:LEU_16:C         -90.000 -40.000 30.00 30.00 1000.000
1:LEU_16:C         1:GLU-_17:N        1:GLU-_17:CA       1:GLU-_17:C        -90.000 -40.000 30.00 30.00 1000.000
1:GLU-_17:C        1:ASN_18:N         1:ASN_18:CA        1:ASN_18:C         -90.000 -40.000 30.00 30.00 1000.000
1:ASN_18:C         1:TYR_19:N         1:TYR_19:CA        1:TYR_19:C         -90.000 -40.000 30.00 30.00 1000.000
1:TYR_19:C         1:CYS_20:N         1:CYS_20:CA        1:CYS_20:C         -90.000 -40.000 30.00 30.00 1000.000
1:GLN_25:C         1:HIS_26:N         1:HIS_26:CA        1:HIS_26:C         -90.000 -40.000 30.00 30.00 1000.000
1:SER_30:C         1:ASP-_31:N        1:ASP-_31:CA       1:ASP-_31:C        -90.000 -40.000 30.00 30.00 1000.000
1:ASP-_31:C        1:LEU_32:N         1:LEU_32:CA        1:LEU_32:C         -90.000 -40.000 30.00 30.00 1000.000
1:LEU_32:C         1:THR_33:N         1:THR_33:CA        1:THR_33:C         -90.000 -40.000 30.00 30.00 1000.000
1:THR_33:C         1:GLU-_34:N        1:GLU-_34:CA       1:GLU-_34:C        -90.000 -40.000 30.00 30.00 1000.000
1:GLU-_34:C        1:ALA_35:N         1:ALA_35:CA        1:ALA_35:C         -90.000 -40.000 30.00 30.00 1000.000
1:ALA_35:C         1:LEU_36:N         1:LEU_36:CA        1:LEU_36:C         -90.000 -40.000 30.00 30.00 1000.000
1:LEU_36:C         1:TYR_37:N         1:TYR_37:CA        1:TYR_37:C         -90.000 -40.000 30.00 30.00 1000.000
1:TYR_37:C         1:LEU_38:N         1:LEU_38:CA        1:LEU_38:C         -90.000 -40.000 30.00 30.00 1000.000
1:LEU_38:C         1:VAL_39:N         1:VAL_39:CA        1:VAL_39:C         -90.000 -40.000 30.00 30.00 1000.000
1:SER_9:C          1:ILE_10:N         1:ILE_10:CA        1:ILE_10:C         -160.000 -80.000 30.00 30.00 1000.000
1:CYS_11:C         1:SER_12:N         1:SER_12:CA        1:SER_12:C         -160.000 -80.000 30.00 30.00 1000.000
1:PHEN_22:C        1:VAL_23:N         1:VAL_23:CA        1:VAL_23:C         -160.000 -80.000 30.00 30.00 1000.000
1:ASN_24:C         1:GLN_25:N         1:GLN_25:CA        1:GLN_25:C         -160.000 -80.000 30.00 30.00 1000.000
1:HIS_26:C         1:LEU_27:N         1:LEU_27:CA        1:LEU_27:C         -160.000 -80.000 30.00 30.00 1000.000
1:PHE_45:C         1:PHE_46:N         1:PHE_46:CA        1:PHE_46:C         -160.000 -80.000 30.00 30.00 1000.000
1:TYR_47:C         1:THR_48:N         1:THR_48:CA        1:THR_48:C         -160.000 -80.000 30.00 30.00 1000.000
1:CYS_6:N          1:CYS_6:CA         1:CYS_6:CB         1:CYS_6:SG         -100.000 -20.000 30.00 30.00 1000.000
1:ILE_10:N         1:ILE_10:CA        1:ILE_10:CB        1:ILE_10:CG1       -100.000 -20.000 30.00 30.00 1000.000
1:ILE_10:CA        1:ILE_10:CB        1:ILE_10:CG1       1:ILE_10:CD1       20.000 100.000 30.00 30.00 1000.000
1:VAL_39:N         1:VAL_39:CA        1:VAL_39:CB        1:VAL_39:CG1       -100.000 -20.000 30.00 30.00 1000.000
1:TYR_19:N         1:TYR_19:CA        1:TYR_19:CB        1:TYR_19:CG        -100.000 -20.000 30.00 30.00 1000.000
1:HIS_26:N         1:HIS_26:CA        1:HIS_26:CB        1:HIS_26:CG        -100.000 -20.000 30.00 30.00 1000.000
1:LEU_27:N         1:LEU_27:CA        1:LEU_27:CB        1:LEU_27:CG        -100.000 -20.000 30.00 30.00 1000.000
1:ASP-_31:N        1:ASP-_31:CA       1:ASP-_31:CB       1:ASP-_31:CG       -100.000 -20.000 30.00 30.00 1000.000
1:CYS_40:N         1:CYS_40:CA        1:CYS_40:CB        1:CYS_40:SG        -100.000 -20.000 30.00 30.00 1000.000
1:GLN_5:N          1:GLN_5:CA         1:GLN_5:CB         1:GLN_5:CG         140.000 -140.000 30.00 30.00 1000.000
1:CYS_7:N          1:CYS_7:CA         1:CYS_7:CB         1:CYS_7:SG         140.000 -140.000 30.00 30.00 1000.000
1:TYR_14:N         1:TYR_14:CA        1:TYR_14:CB        1:TYR_14:CG        140.000 -140.000 30.00 30.00 1000.000
1:GLN_25:N         1:GLN_25:CA        1:GLN_25:CB        1:GLN_25:CG        140.000 -140.000 30.00 30.00 1000.000
1:LEU_38:N         1:LEU_38:CA        1:LEU_38:CB        1:LEU_38:CG        140.000 -140.000 30.00 30.00 1000.000
1:SER_12:N         1:SER_12:CA        1:SER_12:CB        1:SER_12:OG        20.000 100.000 30.00 30.00 1000.000
1:PHE_45:N         1:PHE_45:CA        1:PHE_45:CB        1:PHE_45:CG        20.000 100.000 30.00 30.00 1000.000


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1           HT1      GLY   1  -7.649   8.764   0.098
    2   2H    GLY   1           HT2      GLY   1  -8.805   8.366  -1.083
    3   3H    GLY   1           HT3      GLY   1  -7.320   9.051  -1.542
    4   1HA   GLY   1          HA1       GLY   1  -7.481   6.433  -0.269
    5   2HA   GLY   1          HA2       GLY   1  -7.472   6.611  -2.049
    6    H    ILE   2           H        ILE   2  -5.687   5.010  -1.393
    7    HA   ILE   2           HA       ILE   2  -3.663   5.944   0.584
    8    HB   ILE   2           HB       ILE   2  -4.292   3.767   1.176
    9   1HG1  ILE   2          HG12      ILE   2  -1.747   4.141   0.467
   10   2HG1  ILE   2          HG11      ILE   2  -2.325   2.563   0.997
   11   1HG2  ILE   2          HG21      ILE   2  -4.566   3.358  -1.786
   12   2HG2  ILE   2          HG22      ILE   2  -5.742   3.060  -0.505
   13   3HG2  ILE   2          HG23      ILE   2  -4.379   1.962  -0.724
   14   1HD1  ILE   2          HD11      ILE   2  -2.424   1.727  -1.203
   15   2HD1  ILE   2          HD12      ILE   2  -0.934   2.670  -1.185
   16   3HD1  ILE   2          HD13      ILE   2  -2.393   3.339  -1.917
   17    H    VAL   3           H        VAL   3  -4.274   5.799  -2.738
   18    HA   VAL   3           HA       VAL   3  -1.775   5.153  -3.882
   19    HB   VAL   3           HB       VAL   3  -3.846   7.212  -4.697
   20   1HG1  VAL   3          HG11      VAL   3  -1.478   7.654  -5.563
   21   2HG1  VAL   3          HG12      VAL   3  -2.722   7.442  -6.794
   22   3HG1  VAL   3          HG13      VAL   3  -1.615   6.121  -6.422
   23   1HG2  VAL   3          HG21      VAL   3  -4.891   5.497  -5.738
   24   2HG2  VAL   3          HG22      VAL   3  -3.894   4.439  -4.739
   25   3HG2  VAL   3          HG23      VAL   3  -3.376   4.859  -6.372
   26    H    GLU   4           H        GLU   4  -2.831   8.537  -3.691
   27    HA   GLU   4           HA       GLU   4  -0.315   9.705  -3.768
   28   1HB   GLU   4          HB2       GLU   4  -1.907  11.358  -3.837
   29   2HB   GLU   4          HB1       GLU   4  -2.976  10.514  -2.723
   30   1HG   GLU   4          HG2       GLU   4  -1.421  11.169  -0.849
   31   2HG   GLU   4          HG1       GLU   4  -0.522  12.149  -2.007
   32    H    GLN   5           H        GLN   5  -1.982   8.322  -0.965
   33    HA   GLN   5           HA       GLN   5  -0.322   9.188   1.113
   34   1HB   GLN   5          HB2       GLN   5  -2.366   7.676   1.289
   35   2HB   GLN   5          HB1       GLN   5  -1.303   6.336   0.857
   36   1HG   GLN   5          HG2       GLN   5  -0.303   6.312   2.899
   37   2HG   GLN   5          HG1       GLN   5  -0.249   8.071   2.993
   38   1HE2  GLN   5          HE21      GLN   5  -1.438   5.661   4.761
   39   2HE2  GLN   5          HE22      GLN   5  -2.928   6.308   5.253
   40    H    CYS   6           H        CYS   6   0.277   6.626  -1.271
   41    HA   CYS   6           HA       CYS   6   2.981   6.243  -0.079
   42   1HB   CYS   6          HB2       CYS   6   1.341   4.580  -1.999
   43   2HB   CYS   6          HB1       CYS   6   3.060   4.300  -1.747
   44    H    CYS   7           H        CYS   7   1.318   7.455  -2.929
   45    HA   CYS   7           HA       CYS   7   3.800   7.528  -4.468
   46   1HB   CYS   7          HB2       CYS   7   1.690   7.259  -5.677
   47   2HB   CYS   7          HB1       CYS   7   1.100   8.792  -5.045
   48    H    THR   8           H        THR   8   1.641  10.358  -4.027
   49    HA   THR   8           HA       THR   8   3.607  12.327  -4.121
   50    HB   THR   8           HB       THR   8   1.322  12.373  -2.122
   51    HG1  THR   8           HG1      THR   8   0.259  12.051  -3.940
   52   1HG2  THR   8          HG21      THR   8   2.291  14.736  -3.673
   53   2HG2  THR   8          HG22      THR   8   3.277  14.169  -2.325
   54   3HG2  THR   8          HG23      THR   8   1.607  14.664  -2.050
   55    H    SER   9           H        SER   9   2.353  10.959  -1.068
   56    HA   SER   9           HA       SER   9   4.903  11.616   0.276
   57   1HB   SER   9          HB2       SER   9   2.185  10.746   1.118
   58   2HB   SER   9          HB1       SER   9   3.516  10.100   2.073
   59    HG   SER   9           HG       SER   9   3.141  12.013   3.001
   60    H    ILE  10           H        ILE  10   5.935   9.598   1.474
   61    HA   ILE  10           HA       ILE  10   5.695   7.300  -0.430
   62    HB   ILE  10           HB       ILE  10   8.101   8.275   1.135
   63   1HG1  ILE  10          HG12      ILE  10   9.096   8.516  -1.088
   64   2HG1  ILE  10          HG11      ILE  10   7.645   7.855  -1.839
   65   1HG2  ILE  10          HG21      ILE  10   9.074   6.296  -0.371
   66   2HG2  ILE  10          HG22      ILE  10   7.439   5.673  -0.166
   67   3HG2  ILE  10          HG23      ILE  10   8.443   5.993   1.247
   68   1HD1  ILE  10          HD11      ILE  10   6.450   9.796  -1.559
   69   2HD1  ILE  10          HD12      ILE  10   8.065  10.500  -1.614
   70   3HD1  ILE  10          HD13      ILE  10   7.279  10.217  -0.061
   71    H    CYS  11           H        CYS  11   5.785   5.151   0.481
   72    HA   CYS  11           HA       CYS  11   5.433   5.087   3.453
   73   1HB   CYS  11          HB2       CYS  11   3.576   3.515   3.237
   74   2HB   CYS  11          HB1       CYS  11   3.201   5.002   2.367
   75    H    SER  12           H        SER  12   5.586   2.761   4.280
   76    HA   SER  12           HA       SER  12   7.896   1.485   2.925
   77   1HB   SER  12          HB2       SER  12   7.526   0.076   5.238
   78   2HB   SER  12          HB1       SER  12   8.541   1.509   5.105
   79    HG   SER  12           HG       SER  12   6.349   1.175   6.550
   80    H    LEU  13           H        LEU  13   7.862  -1.036   3.218
   81    HA   LEU  13           HA       LEU  13   5.649  -2.037   1.663
   82   1HB   LEU  13          HB2       LEU  13   8.137  -3.129   2.851
   83   2HB   LEU  13          HB1       LEU  13   6.835  -4.292   2.598
   84    HG   LEU  13           HG       LEU  13   8.486  -3.916   0.646
   85   1HD1  LEU  13          HD11      LEU  13   5.820  -4.632   0.761
   86   2HD1  LEU  13          HD12      LEU  13   6.853  -4.787  -0.660
   87   3HD1  LEU  13          HD13      LEU  13   5.826  -3.366  -0.467
   88   1HD2  LEU  13          HD21      LEU  13   8.506  -1.914  -0.454
   89   2HD2  LEU  13          HD22      LEU  13   7.913  -1.280   1.078
   90   3HD2  LEU  13          HD23      LEU  13   6.778  -1.656  -0.219
   91    H    TYR  14           H        TYR  14   6.291  -1.806   5.086
   92    HA   TYR  14           HA       TYR  14   4.472  -3.854   5.938
   93   1HB   TYR  14          HB2       TYR  14   6.243  -2.626   7.351
   94   2HB   TYR  14          HB1       TYR  14   5.073  -1.316   7.477
   95    HD1  TYR  14           HD1      TYR  14   5.232  -5.054   7.880
   96    HD2  TYR  14           HD2      TYR  14   3.594  -1.333   9.280
   97    HE1  TYR  14           HE1      TYR  14   4.091  -6.249   9.737
   98    HE2  TYR  14           HE2      TYR  14   2.451  -2.532  11.134
   99    HH   TYR  14           HH       TYR  14   2.486  -6.057  11.330
  100    H    GLN  15           H        GLN  15   4.073  -0.524   4.924
  101    HA   GLN  15           HA       GLN  15   1.319  -0.351   5.861
  102   1HB   GLN  15          HB2       GLN  15   2.850   1.375   3.887
  103   2HB   GLN  15          HB1       GLN  15   1.285   1.775   4.589
  104   1HG   GLN  15          HG2       GLN  15   2.464   1.454   6.877
  105   2HG   GLN  15          HG1       GLN  15   3.962   1.598   5.956
  106   1HE2  GLN  15          HE21      GLN  15   3.266   3.588   7.873
  107   2HE2  GLN  15          HE22      GLN  15   2.902   5.030   7.054
  108    H    LEU  16           H        LEU  16   2.900  -0.776   2.675
  109    HA   LEU  16           HA       LEU  16   0.493  -1.017   1.169
  110   1HB   LEU  16          HB2       LEU  16   3.301  -1.549   0.746
  111   2HB   LEU  16          HB1       LEU  16   2.342  -2.882   0.107
  112    HG   LEU  16           HG       LEU  16   2.688  -1.070  -1.569
  113   1HD1  LEU  16          HD11      LEU  16   0.341  -2.425  -0.915
  114   2HD1  LEU  16          HD12      LEU  16   0.663  -1.583  -2.430
  115   3HD1  LEU  16          HD13      LEU  16  -0.179  -0.752  -1.122
  116   1HD2  LEU  16          HD21      LEU  16   2.515   1.075  -0.905
  117   2HD2  LEU  16          HD22      LEU  16   1.985   0.551   0.693
  118   3HD2  LEU  16          HD23      LEU  16   0.799   0.826  -0.585
  119    H    GLU  17           H        GLU  17   1.882  -3.000   3.590
  120    HA   GLU  17           HA       GLU  17   0.652  -5.515   2.774
  121   1HB   GLU  17          HB2       GLU  17   1.960  -4.512   5.304
  122   2HB   GLU  17          HB1       GLU  17   1.076  -6.036   5.304
  123   1HG   GLU  17          HG2       GLU  17   2.773  -6.010   3.005
  124   2HG   GLU  17          HG1       GLU  17   3.744  -5.544   4.403
  125    H    ASN  18           H        ASN  18  -0.084  -2.871   5.012
  126    HA   ASN  18           HA       ASN  18  -2.526  -3.972   6.023
  127   1HB   ASN  18          HB2       ASN  18  -2.046  -1.018   5.733
  128   2HB   ASN  18          HB1       ASN  18  -2.807  -1.894   7.055
  129   1HD2  ASN  18          HD21      ASN  18  -0.511  -3.940   6.979
  130   2HD2  ASN  18          HD22      ASN  18   0.769  -3.151   7.764
  131    H    TYR  19           H        TYR  19  -1.621  -2.497   3.048
  132    HA   TYR  19           HA       TYR  19  -4.457  -1.956   2.335
  133   1HB   TYR  19          HB2       TYR  19  -1.967  -1.328   0.727
  134   2HB   TYR  19          HB1       TYR  19  -3.593  -0.692   0.472
  135    HD1  TYR  19           HD1      TYR  19  -0.609   0.455   1.424
  136    HD2  TYR  19           HD2      TYR  19  -4.523  -0.012   3.131
  137    HE1  TYR  19           HE1      TYR  19  -0.137   2.304   3.009
  138    HE2  TYR  19           HE2      TYR  19  -4.054   1.837   4.716
  139    HH   TYR  19           HH       TYR  19  -2.371   3.961   4.608
  140    H    CYS  20           H        CYS  20  -2.749  -4.612   2.452
  141    HA   CYS  20           HA       CYS  20  -2.950  -5.550  -0.319
  142   1HB   CYS  20          HB2       CYS  20  -1.944  -6.597   2.262
  143   2HB   CYS  20          HB1       CYS  20  -2.572  -7.803   1.163
  144    H    ASN  21           H        ASN  21  -4.069  -8.146   0.139
  145    HA   ASN  21           HA       ASN  21  -6.840  -7.594  -0.116
  146   1HB   ASN  21          HB2       ASN  21  -5.972  -9.702  -0.913
  147   2HB   ASN  21          HB1       ASN  21  -5.402 -10.136   0.698
  148   1HD2  ASN  21          HD21      ASN  21  -8.531  -9.010  -0.725
  149   2HD2  ASN  21          HD22      ASN  21  -9.478 -10.159   0.090
  150   1H    PHE   1           HT1      PHE   1  10.170  -3.046  -0.638
  151   2H    PHE   1           HT2      PHE   1  11.705  -2.973   0.086
  152   3H    PHE   1           HT3      PHE   1  11.522  -3.666  -1.454
  153    HA   PHE   1           HA       PHE   1  12.399  -1.574  -1.901
  154   1HB   PHE   1          HB2       PHE   1   9.635  -0.592  -2.126
  155   2HB   PHE   1          HB1       PHE   1  10.826  -0.887  -3.389
  156    HD1  PHE   1           HD1      PHE   1   7.715  -1.940  -2.142
  157    HD2  PHE   1           HD2      PHE   1  11.397  -3.503  -3.716
  158    HE1  PHE   1           HE1      PHE   1   6.561  -4.044  -2.758
  159    HE2  PHE   1           HE2      PHE   1  10.241  -5.607  -4.332
  160    HZ   PHE   1           HZ       PHE   1   7.822  -5.878  -3.855
  161    H    VAL   2           H        VAL   2  13.293  -0.084  -0.575
  162    HA   VAL   2           HA       VAL   2  11.813   0.910   1.767
  163    HB   VAL   2           HB       VAL   2  13.896   1.896   2.436
  164   1HG1  VAL   2          HG11      VAL   2  13.950  -0.460   2.780
  165   2HG1  VAL   2          HG12      VAL   2  15.497  -0.068   2.030
  166   3HG1  VAL   2          HG13      VAL   2  14.203  -0.780   1.065
  167   1HG2  VAL   2          HG21      VAL   2  14.553   1.586  -0.487
  168   2HG2  VAL   2          HG22      VAL   2  15.853   1.667   0.703
  169   3HG2  VAL   2          HG23      VAL   2  14.721   3.010   0.540
  170    H    ASN   3           H        ASN   3  11.037   3.008   2.013
  171    HA   ASN   3           HA       ASN   3  10.017   4.977   1.167
  172   1HB   ASN   3          HB2       ASN   3  12.929   5.240   0.370
  173   2HB   ASN   3          HB1       ASN   3  11.771   6.568   0.285
  174   1HD2  ASN   3          HD21      ASN   3  11.582   7.799   2.165
  175   2HD2  ASN   3          HD22      ASN   3  12.061   7.292   3.712
  176    H    GLN   4           H        GLN   4   8.615   4.141  -0.462
  177    HA   GLN   4           HA       GLN   4   9.717   4.457  -3.220
  178   1HB   GLN   4          HB2       GLN   4   8.999   2.043  -2.192
  179   2HB   GLN   4          HB1       GLN   4   7.458   2.568  -2.870
  180   1HG   GLN   4          HG2       GLN   4   8.610   1.372  -4.612
  181   2HG   GLN   4          HG1       GLN   4   8.700   3.084  -5.026
  182   1HE2  GLN   4          HE21      GLN   4  10.690   2.272  -6.306
  183   2HE2  GLN   4          HE22      GLN   4  12.167   2.183  -5.475
  184    H    HIS   5           H        HIS   5   8.408   5.465  -4.691
  185    HA   HIS   5           HA       HIS   5   5.961   6.797  -3.624
  186   1HB   HIS   5          HB2       HIS   5   7.331   7.495  -6.223
  187   2HB   HIS   5          HB1       HIS   5   6.383   8.541  -5.172
  188    HD2  HIS   5           HD2      HIS   5   9.969   6.857  -5.134
  189    HE1  HIS   5           HE1      HIS   5   9.932  10.165  -2.500
  190    HE2  HIS   5           HE2      HIS   5  11.393   8.357  -3.554
  191    H    LEU   6           H        LEU   6   4.303   5.330  -4.051
  192    HA   LEU   6           HA       LEU   6   4.206   4.168  -6.801
  193   1HB   LEU   6          HB2       LEU   6   3.196   3.205  -4.153
  194   2HB   LEU   6          HB1       LEU   6   2.563   2.576  -5.671
  195    HG   LEU   6           HG       LEU   6   4.576   1.549  -6.239
  196   1HD1  LEU   6          HD11      LEU   6   6.043   3.462  -6.172
  197   2HD1  LEU   6          HD12      LEU   6   6.767   2.220  -5.152
  198   3HD1  LEU   6          HD13      LEU   6   5.907   3.574  -4.417
  199   1HD2  LEU   6          HD21      LEU   6   3.627   1.111  -3.690
  200   2HD2  LEU   6          HD22      LEU   6   5.338   1.423  -3.401
  201   3HD2  LEU   6          HD23      LEU   6   4.850   0.125  -4.491
  202    H    CYS   7           H        CYS   7   2.723   4.990  -8.128
  203    HA   CYS   7           HA       CYS   7   0.094   5.691  -6.971
  204   1HB   CYS   7          HB2       CYS   7   0.397   7.494  -9.098
  205   2HB   CYS   7          HB1       CYS   7   0.379   7.892  -7.385
  206    H    GLY   8           H        GLY   8  -1.642   5.586  -8.601
  207   1HA   GLY   8          HA2       GLY   8  -2.725   4.324 -10.265
  208   2HA   GLY   8          HA1       GLY   8  -1.440   4.955 -11.293
  209    H    SER   9           H        SER   9  -0.823   3.204 -12.480
  210    HA   SER   9           HA       SER   9  -0.907   0.499 -11.762
  211   1HB   SER   9          HB2       SER   9   0.143   0.132 -13.751
  212   2HB   SER   9          HB1       SER   9  -0.151   1.852 -13.990
  213    HG   SER   9           HG       SER   9   2.193   0.549 -13.083
  214    H    ASP  10           H        ASP  10   1.925   2.689 -11.465
  215    HA   ASP  10           HA       ASP  10   3.828   0.970 -10.439
  216   1HB   ASP  10          HB2       ASP  10   3.177   3.822 -10.000
  217   2HB   ASP  10          HB1       ASP  10   4.152   3.083  -8.730
  218    H    LEU  11           H        LEU  11   1.047   2.307  -8.685
  219    HA   LEU  11           HA       LEU  11   1.800   1.004  -6.195
  220   1HB   LEU  11          HB2       LEU  11   0.297   3.088  -6.489
  221   2HB   LEU  11          HB1       LEU  11  -0.976   1.945  -6.908
  222    HG   LEU  11           HG       LEU  11  -0.613   0.776  -4.739
  223   1HD1  LEU  11          HD11      LEU  11   1.288   3.081  -4.238
  224   2HD1  LEU  11          HD12      LEU  11   1.746   1.385  -4.405
  225   3HD1  LEU  11          HD13      LEU  11   0.775   1.904  -3.029
  226   1HD2  LEU  11          HD21      LEU  11  -1.014   3.255  -3.482
  227   2HD2  LEU  11          HD22      LEU  11  -2.259   2.169  -4.099
  228   3HD2  LEU  11          HD23      LEU  11  -1.627   3.459  -5.122
  229    H    THR  12           H        THR  12  -0.680   0.383  -8.708
  230    HA   THR  12           HA       THR  12  -1.707  -2.019  -7.622
  231    HB   THR  12           HB       THR  12  -1.244  -1.279 -10.526
  232    HG1  THR  12           HG1      THR  12  -3.738  -1.207 -10.032
  233   1HG2  THR  12          HG21      THR  12  -2.824  -3.530  -9.264
  234   2HG2  THR  12          HG22      THR  12  -1.487  -3.671 -10.405
  235   3HG2  THR  12          HG23      THR  12  -3.034  -3.014 -10.937
  236    H    GLU  13           H        GLU  13   1.074  -1.498  -9.788
  237    HA   GLU  13           HA       GLU  13   1.906  -4.134 -10.166
  238   1HB   GLU  13          HB2       GLU  13   2.995  -1.615 -10.601
  239   2HB   GLU  13          HB1       GLU  13   4.144  -2.364  -9.495
  240   1HG   GLU  13          HG2       GLU  13   3.844  -4.446 -11.106
  241   2HG   GLU  13          HG1       GLU  13   3.352  -3.205 -12.259
  242    H    ALA  14           H        ALA  14   3.368  -2.057  -7.632
  243    HA   ALA  14           HA       ALA  14   4.467  -4.163  -6.111
  244   1HB   ALA  14          HB1       ALA  14   3.317  -1.562  -5.042
  245   2HB   ALA  14          HB2       ALA  14   4.936  -1.742  -5.717
  246   3HB   ALA  14          HB3       ALA  14   4.501  -2.586  -4.231
  247    H    LEU  15           H        LEU  15   1.355  -2.486  -5.591
  248    HA   LEU  15           HA       LEU  15   0.247  -4.000  -3.529
  249   1HB   LEU  15          HB2       LEU  15  -0.814  -2.608  -5.939
  250   2HB   LEU  15          HB1       LEU  15  -1.907  -3.749  -5.178
  251    HG   LEU  15           HG       LEU  15  -0.542  -1.400  -3.833
  252   1HD1  LEU  15          HD11      LEU  15  -3.055  -0.815  -3.524
  253   2HD1  LEU  15          HD12      LEU  15  -3.325  -1.970  -4.828
  254   3HD1  LEU  15          HD13      LEU  15  -2.322  -0.545  -5.104
  255   1HD2  LEU  15          HD21      LEU  15  -0.766  -3.188  -2.206
  256   2HD2  LEU  15          HD22      LEU  15  -2.410  -3.531  -2.745
  257   3HD2  LEU  15          HD23      LEU  15  -2.054  -2.023  -1.905
  258    H    TYR  16           H        TYR  16   0.008  -4.715  -6.993
  259    HA   TYR  16           HA       TYR  16  -1.221  -7.238  -6.844
  260   1HB   TYR  16          HB2       TYR  16  -0.347  -5.662  -8.848
  261   2HB   TYR  16          HB1       TYR  16   0.940  -6.857  -8.852
  262    HD1  TYR  16           HD1      TYR  16  -2.529  -6.171  -9.621
  263    HD2  TYR  16           HD2      TYR  16   0.385  -9.287  -9.136
  264    HE1  TYR  16           HE1      TYR  16  -4.019  -7.743 -10.830
  265    HE2  TYR  16           HE2      TYR  16  -1.103 -10.866 -10.343
  266    HH   TYR  16           HH       TYR  16  -3.051 -11.141 -11.369
  267    H    LEU  17           H        LEU  17   2.149  -6.337  -6.301
  268    HA   LEU  17           HA       LEU  17   2.912  -9.184  -6.165
  269   1HB   LEU  17          HB2       LEU  17   4.368  -7.592  -7.350
  270   2HB   LEU  17          HB1       LEU  17   4.607  -6.698  -5.846
  271    HG   LEU  17           HG       LEU  17   5.744  -8.509  -4.813
  272   1HD1  LEU  17          HD11      LEU  17   5.960 -10.687  -6.347
  273   2HD1  LEU  17          HD12      LEU  17   4.409 -10.109  -6.954
  274   3HD1  LEU  17          HD13      LEU  17   4.605 -10.472  -5.239
  275   1HD2  LEU  17          HD21      LEU  17   7.051  -7.298  -6.591
  276   2HD2  LEU  17          HD22      LEU  17   6.619  -8.585  -7.718
  277   3HD2  LEU  17          HD23      LEU  17   7.615  -8.945  -6.308
  278    H    VAL  18           H        VAL  18   3.136  -6.310  -3.978
  279    HA   VAL  18           HA       VAL  18   4.160  -7.449  -1.693
  280    HB   VAL  18           HB       VAL  18   1.983  -6.174  -0.575
  281   1HG1  VAL  18          HG11      VAL  18   3.514  -4.562   0.003
  282   2HG1  VAL  18          HG12      VAL  18   4.215  -4.496  -1.613
  283   3HG1  VAL  18          HG13      VAL  18   4.617  -5.830  -0.532
  284   1HG2  VAL  18          HG21      VAL  18   2.652  -4.446  -2.916
  285   2HG2  VAL  18          HG22      VAL  18   1.183  -4.495  -1.943
  286   3HG2  VAL  18          HG23      VAL  18   1.477  -5.738  -3.157
  287    H    CYS  19           H        CYS  19   0.833  -7.760  -2.786
  288    HA   CYS  19           HA       CYS  19   0.409  -9.901  -0.755
  289   1HB   CYS  19          HB2       CYS  19  -1.816  -9.295  -2.581
  290   2HB   CYS  19          HB1       CYS  19  -1.793  -9.373  -0.831
  291    H    GLY  20           H        GLY  20  -0.533  -9.427  -4.152
  292   1HA   GLY  20          HA2       GLY  20  -0.372 -10.874  -6.000
  293   2HA   GLY  20          HA1       GLY  20   0.860 -11.768  -5.106
  294    H    GLU  21           H        GLU  21   0.267 -13.844  -4.783
  295    HA   GLU  21           HA       GLU  21  -2.262 -14.958  -5.206
  296   1HB   GLU  21          HB2       GLU  21  -0.199 -15.850  -3.163
  297   2HB   GLU  21          HB1       GLU  21  -1.503 -16.848  -3.810
  298   1HG   GLU  21          HG2       GLU  21  -0.570 -16.812  -6.008
  299   2HG   GLU  21          HG1       GLU  21   0.560 -15.525  -5.582
  300    H    ARG  22           H        ARG  22  -1.105 -13.086  -2.526
  301    HA   ARG  22           HA       ARG  22  -3.278 -13.865  -0.731
  302   1HB   ARG  22          HB2       ARG  22  -1.328 -11.560  -0.507
  303   2HB   ARG  22          HB1       ARG  22  -2.329 -12.216   0.790
  304   1HG   ARG  22          HG2       ARG  22  -0.457 -14.031  -0.705
  305   2HG   ARG  22          HG1       ARG  22   0.169 -12.995   0.578
  306   1HD   ARG  22          HD2       ARG  22  -0.401 -14.875   1.810
  307   2HD   ARG  22          HD1       ARG  22  -1.905 -13.960   1.918
  308    HE   ARG  22           HE       ARG  22  -2.066 -15.582  -0.402
  309   1HH1  ARG  22          HH21      ARG  22  -3.595 -15.381   2.414
  310   2HH1  ARG  22          HH22      ARG  22  -3.682 -17.074   2.772
  311   1HH2  ARG  22          HH11      ARG  22  -1.416 -17.986   0.317
  312   2HH2  ARG  22          HH12      ARG  22  -2.451 -18.545   1.588
  313    H    GLY  23           H        GLY  23  -3.424 -12.252  -3.495
  314   1HA   GLY  23          HA2       GLY  23  -4.898 -10.645  -4.368
  315   2HA   GLY  23          HA1       GLY  23  -5.894 -10.948  -2.942
  316    H    PHE  24           H        PHE  24  -5.344  -8.329  -4.175
  317    HA   PHE  24           HA       PHE  24  -4.075  -7.066  -1.776
  318   1HB   PHE  24          HB2       PHE  24  -2.913  -5.489  -3.169
  319   2HB   PHE  24          HB1       PHE  24  -2.494  -7.102  -3.715
  320    HD1  PHE  24           HD1      PHE  24  -4.330  -4.019  -4.557
  321    HD2  PHE  24           HD2      PHE  24  -3.288  -7.992  -5.825
  322    HE1  PHE  24           HE1      PHE  24  -5.047  -3.473  -6.871
  323    HE2  PHE  24           HE2      PHE  24  -4.010  -7.448  -8.133
  324    HZ   PHE  24           HZ       PHE  24  -4.881  -5.188  -8.659
  325    H    PHE  25           H        PHE  25  -4.425  -4.457  -2.328
  326    HA   PHE  25           HA       PHE  25  -7.289  -4.116  -3.063
  327   1HB   PHE  25          HB2       PHE  25  -7.134  -4.389  -0.605
  328   2HB   PHE  25          HB1       PHE  25  -5.997  -3.043  -0.540
  329    HD1  PHE  25           HD1      PHE  25  -9.443  -3.965  -1.616
  330    HD2  PHE  25           HD2      PHE  25  -6.755  -0.823  -0.457
  331    HE1  PHE  25           HE1      PHE  25 -11.335  -2.372  -1.560
  332    HE2  PHE  25           HE2      PHE  25  -8.644   0.777  -0.400
  333    HZ   PHE  25           HZ       PHE  25 -10.943   0.005  -0.952
  334    H    TYR  26           H        TYR  26  -7.789  -1.992  -3.808
  335    HA   TYR  26           HA       TYR  26  -5.586  -0.018  -3.979
  336   1HB   TYR  26          HB2       TYR  26  -5.336  -1.411  -5.994
  337   2HB   TYR  26          HB1       TYR  26  -7.026  -1.146  -6.391
  338    HD1  TYR  26           HD1      TYR  26  -4.070   0.960  -5.431
  339    HD2  TYR  26           HD2      TYR  26  -7.436   0.415  -8.040
  340    HE1  TYR  26           HE1      TYR  26  -3.458   3.030  -6.654
  341    HE2  TYR  26           HE2      TYR  26  -6.828   2.486  -9.266
  342    HH   TYR  26           HH       TYR  26  -5.533   4.618  -8.740
  343    H    THR  27           H        THR  27  -6.470   2.073  -4.979
  344    HA   THR  27           HA       THR  27  -9.007   2.671  -3.657
  345    HB   THR  27           HB       THR  27  -8.559   4.978  -4.333
  346    HG1  THR  27           HG1      THR  27  -6.199   4.177  -5.590
  347   1HG2  THR  27          HG21      THR  27  -7.258   4.824  -2.491
  348   2HG2  THR  27          HG22      THR  27  -5.903   4.762  -3.617
  349   3HG2  THR  27          HG23      THR  27  -6.596   3.268  -2.986
  350    H    LYS  28           H        LYS  28  -7.903   3.256  -7.021
  351    HA   LYS  28           HA       LYS  28  -9.216   3.485  -8.973
  352   1HB   LYS  28          HB2       LYS  28  -9.123   0.969  -8.495
  353   2HB   LYS  28          HB1       LYS  28 -10.743   1.141  -7.823
  354   1HG   LYS  28          HG2       LYS  28 -11.330   0.687  -9.999
  355   2HG   LYS  28          HG1       LYS  28 -11.123   2.432 -10.148
  356   1HD   LYS  28          HD2       LYS  28  -8.620   1.828 -10.635
  357   2HD   LYS  28          HD1       LYS  28  -9.266   0.233 -11.012
  358   1HE   LYS  28          HE2       LYS  28  -9.943   2.866 -12.331
  359   2HE   LYS  28          HE1       LYS  28  -9.266   1.420 -13.080
  360   1HZ   LYS  28          HZ1       LYS  28 -11.349   0.258 -12.507
  361   2HZ   LYS  28          HZ2       LYS  28 -11.589   1.550 -13.582
  362   3HZ   LYS  28          HZ3       LYS  28 -11.993   1.721 -11.941
  363    HA   PRO  29           HA       PRO  29 -12.720   5.377  -6.557
  364   1HB   PRO  29          HB2       PRO  29 -11.981   7.993  -6.964
  365   2HB   PRO  29          HB1       PRO  29 -11.462   7.032  -5.567
  366   1HG   PRO  29          HG2       PRO  29  -9.899   7.833  -7.982
  367   2HG   PRO  29          HG1       PRO  29  -9.328   7.471  -6.345
  368   1HD   PRO  29          HD2       PRO  29  -9.177   5.728  -8.563
  369   2HD   PRO  29          HD1       PRO  29  -8.950   5.269  -6.861
  370    H    THR  30           H        THR  30 -14.526   5.447  -7.830
  371    HA   THR  30           HA       THR  30 -14.825   7.272 -10.026
  372    HB   THR  30           HB       THR  30 -13.322   5.477 -11.033
  373    HG1  THR  30           HG1      THR  30 -15.916   5.805 -12.130
  374   1HG2  THR  30          HG21      THR  30 -14.800   3.688  -9.755
  375   2HG2  THR  30          HG22      THR  30 -14.068   3.304 -11.312
  376   3HG2  THR  30          HG23      THR  30 -15.767   3.766 -11.227
  Start of MODEL    2
    1   1H    GLY   1           HT1      GLY   1  -8.167   7.674  -3.341
    2   2H    GLY   1           HT2      GLY   1  -7.709   6.038  -3.313
    3   3H    GLY   1           HT3      GLY   1  -6.524   7.252  -3.408
    4   1HA   GLY   1          HA1       GLY   1  -7.383   7.961  -1.153
    5   2HA   GLY   1          HA2       GLY   1  -8.272   6.410  -1.081
    6    H    ILE   2           H        ILE   2  -5.685   5.167  -1.545
    7    HA   ILE   2           HA       ILE   2  -3.879   6.518   0.407
    8    HB   ILE   2           HB       ILE   2  -4.318   4.416   1.291
    9   1HG1  ILE   2          HG12      ILE   2  -1.796   4.835   0.543
   10   2HG1  ILE   2          HG11      ILE   2  -2.281   3.323   1.292
   11   1HG2  ILE   2          HG21      ILE   2  -4.461   3.505  -1.577
   12   2HG2  ILE   2          HG22      ILE   2  -5.716   3.453  -0.339
   13   3HG2  ILE   2          HG23      ILE   2  -4.345   2.346  -0.252
   14   1HD1  ILE   2          HD11      ILE   2  -0.867   3.148  -0.841
   15   2HD1  ILE   2          HD12      ILE   2  -2.300   3.703  -1.706
   16   3HD1  ILE   2          HD13      ILE   2  -2.348   2.191  -0.800
   17    H    VAL   3           H        VAL   3  -4.202   5.692  -2.895
   18    HA   VAL   3           HA       VAL   3  -1.711   5.082  -3.861
   19    HB   VAL   3           HB       VAL   3  -3.521   7.261  -4.933
   20   1HG1  VAL   3          HG11      VAL   3  -0.933   6.849  -5.676
   21   2HG1  VAL   3          HG12      VAL   3  -2.186   7.398  -6.787
   22   3HG1  VAL   3          HG13      VAL   3  -1.751   5.691  -6.724
   23   1HG2  VAL   3          HG21      VAL   3  -4.394   5.497  -6.376
   24   2HG2  VAL   3          HG22      VAL   3  -4.544   4.992  -4.693
   25   3HG2  VAL   3          HG23      VAL   3  -3.252   4.337  -5.698
   26    H    GLU   4           H        GLU   4  -2.671   8.506  -3.460
   27    HA   GLU   4           HA       GLU   4  -0.078   9.541  -3.764
   28   1HB   GLU   4          HB2       GLU   4  -2.643  10.495  -2.644
   29   2HB   GLU   4          HB1       GLU   4  -1.213  11.325  -2.039
   30   1HG   GLU   4          HG2       GLU   4  -0.497  11.507  -4.512
   31   2HG   GLU   4          HG1       GLU   4  -2.165  11.083  -4.890
   32    H    GLN   5           H        GLN   5  -1.706   8.338  -0.844
   33    HA   GLN   5           HA       GLN   5   0.086   9.195   1.126
   34   1HB   GLN   5          HB2       GLN   5  -1.947   7.910   1.643
   35   2HB   GLN   5          HB1       GLN   5  -1.232   6.479   0.908
   36   1HG   GLN   5          HG2       GLN   5  -0.150   5.981   2.814
   37   2HG   GLN   5          HG1       GLN   5   0.602   7.578   2.837
   38   1HE2  GLN   5          HE21      GLN   5  -2.890   6.762   3.067
   39   2HE2  GLN   5          HE22      GLN   5  -3.113   7.472   4.593
   40    H    CYS   6           H        CYS   6   0.445   6.500  -1.157
   41    HA   CYS   6           HA       CYS   6   3.160   6.003  -0.054
   42   1HB   CYS   6          HB2       CYS   6   1.405   4.395  -1.908
   43   2HB   CYS   6          HB1       CYS   6   3.094   4.002  -1.591
   44    H    CYS   7           H        CYS   7   1.585   7.612  -2.624
   45    HA   CYS   7           HA       CYS   7   4.022   7.461  -4.319
   46   1HB   CYS   7          HB2       CYS   7   1.886   7.183  -5.496
   47   2HB   CYS   7          HB1       CYS   7   1.318   8.729  -4.879
   48    H    THR   8           H        THR   8   1.873  10.291  -3.997
   49    HA   THR   8           HA       THR   8   3.878  12.240  -4.010
   50    HB   THR   8           HB       THR   8   2.123  13.286  -2.150
   51    HG1  THR   8           HG1      THR   8   1.049  11.127  -2.457
   52   1HG2  THR   8          HG21      THR   8   0.863  13.641  -4.623
   53   2HG2  THR   8          HG22      THR   8   2.560  13.374  -5.020
   54   3HG2  THR   8          HG23      THR   8   2.106  14.676  -3.921
   55    H    SER   9           H        SER   9   2.348  10.919  -1.077
   56    HA   SER   9           HA       SER   9   4.790  11.559   0.475
   57   1HB   SER   9          HB2       SER   9   2.302  11.822   1.307
   58   2HB   SER   9          HB1       SER   9   2.383  10.079   1.543
   59    HG   SER   9           HG       SER   9   3.859  12.140   2.773
   60    H    ILE  10           H        ILE  10   6.120   9.784   1.271
   61    HA   ILE  10           HA       ILE  10   5.601   7.285  -0.250
   62    HB   ILE  10           HB       ILE  10   8.090   8.402   1.055
   63   1HG1  ILE  10          HG12      ILE  10   8.950   8.035  -1.289
   64   2HG1  ILE  10          HG11      ILE  10   7.315   7.579  -1.762
   65   1HG2  ILE  10          HG21      ILE  10   8.587   5.985  -0.392
   66   2HG2  ILE  10          HG22      ILE  10   7.364   5.658   0.828
   67   3HG2  ILE  10          HG23      ILE  10   8.920   6.326   1.304
   68   1HD1  ILE  10          HD11      ILE  10   6.717   9.735  -1.956
   69   2HD1  ILE  10          HD12      ILE  10   8.395  10.180  -1.644
   70   3HD1  ILE  10          HD13      ILE  10   7.252  10.069  -0.310
   71    H    CYS  11           H        CYS  11   5.328   5.306   0.751
   72    HA   CYS  11           HA       CYS  11   5.062   5.423   3.737
   73   1HB   CYS  11          HB2       CYS  11   3.304   3.736   3.551
   74   2HB   CYS  11          HB1       CYS  11   2.905   5.117   2.532
   75    H    SER  12           H        SER  12   5.093   2.954   4.573
   76    HA   SER  12           HA       SER  12   7.678   1.872   3.567
   77   1HB   SER  12          HB2       SER  12   7.533   0.518   5.742
   78   2HB   SER  12          HB1       SER  12   7.761   2.257   5.912
   79    HG   SER  12           HG       SER  12   6.098   1.558   7.270
   80    H    LEU  13           H        LEU  13   7.880  -0.527   3.469
   81    HA   LEU  13           HA       LEU  13   5.881  -1.708   1.827
   82   1HB   LEU  13          HB2       LEU  13   8.346  -2.606   3.193
   83   2HB   LEU  13          HB1       LEU  13   7.168  -3.881   2.877
   84    HG   LEU  13           HG       LEU  13   8.819  -3.505   1.003
   85   1HD1  LEU  13          HD11      LEU  13   6.757  -4.597   0.461
   86   2HD1  LEU  13          HD12      LEU  13   6.991  -3.355  -0.769
   87   3HD1  LEU  13          HD13      LEU  13   5.855  -3.085   0.554
   88   1HD2  LEU  13          HD21      LEU  13   9.054  -1.097   1.142
   89   2HD2  LEU  13          HD22      LEU  13   7.324  -0.867   0.890
   90   3HD2  LEU  13          HD23      LEU  13   8.333  -1.478  -0.422
   91    H    TYR  14           H        TYR  14   6.233  -1.552   5.296
   92    HA   TYR  14           HA       TYR  14   4.478  -3.725   5.960
   93   1HB   TYR  14          HB2       TYR  14   6.037  -2.606   7.574
   94   2HB   TYR  14          HB1       TYR  14   4.989  -1.188   7.544
   95    HD1  TYR  14           HD1      TYR  14   4.480  -4.906   7.785
   96    HD2  TYR  14           HD2      TYR  14   3.590  -1.022   9.399
   97    HE1  TYR  14           HE1      TYR  14   3.024  -5.951   9.502
   98    HE2  TYR  14           HE2      TYR  14   2.133  -2.071  11.115
   99    HH   TYR  14           HH       TYR  14   0.809  -4.253  11.314
  100    H    GLN  15           H        GLN  15   3.936  -0.346   5.116
  101    HA   GLN  15           HA       GLN  15   1.150  -0.367   5.909
  102   1HB   GLN  15          HB2       GLN  15   2.639   1.484   4.024
  103   2HB   GLN  15          HB1       GLN  15   1.032   1.778   4.688
  104   1HG   GLN  15          HG2       GLN  15   2.203   1.409   6.999
  105   2HG   GLN  15          HG1       GLN  15   3.682   1.763   6.103
  106   1HE2  GLN  15          HE21      GLN  15   0.368   3.122   6.565
  107   2HE2  GLN  15          HE22      GLN  15   0.862   4.744   6.479
  108    H    LEU  16           H        LEU  16   2.798  -0.536   2.734
  109    HA   LEU  16           HA       LEU  16   0.464  -0.835   1.169
  110   1HB   LEU  16          HB2       LEU  16   3.289  -1.151   0.791
  111   2HB   LEU  16          HB1       LEU  16   2.476  -2.560   0.105
  112    HG   LEU  16           HG       LEU  16   2.692  -0.627  -1.507
  113   1HD1  LEU  16          HD11      LEU  16   0.166  -1.951  -0.673
  114   2HD1  LEU  16          HD12      LEU  16   0.998  -1.991  -2.227
  115   3HD1  LEU  16          HD13      LEU  16   0.011  -0.596  -1.789
  116   1HD2  LEU  16          HD21      LEU  16   2.111   1.438  -0.823
  117   2HD2  LEU  16          HD22      LEU  16   1.712   0.784   0.765
  118   3HD2  LEU  16          HD23      LEU  16   0.473   0.882  -0.486
  119    H    GLU  17           H        GLU  17   1.909  -2.932   3.470
  120    HA   GLU  17           HA       GLU  17   0.790  -5.431   2.491
  121   1HB   GLU  17          HB2       GLU  17   1.977  -4.523   5.115
  122   2HB   GLU  17          HB1       GLU  17   1.219  -6.106   4.964
  123   1HG   GLU  17          HG2       GLU  17   3.427  -5.117   3.145
  124   2HG   GLU  17          HG1       GLU  17   3.702  -6.122   4.569
  125    H    ASN  18           H        ASN  18  -0.313  -2.777   4.463
  126    HA   ASN  18           HA       ASN  18  -2.544  -4.172   5.661
  127   1HB   ASN  18          HB2       ASN  18  -1.714  -1.291   5.370
  128   2HB   ASN  18          HB1       ASN  18  -3.283  -1.716   6.040
  129   1HD2  ASN  18          HD21      ASN  18  -0.297  -3.629   6.476
  130   2HD2  ASN  18          HD22      ASN  18  -0.197  -3.388   8.150
  131    H    TYR  19           H        TYR  19  -1.974  -2.465   2.664
  132    HA   TYR  19           HA       TYR  19  -4.850  -2.341   2.046
  133   1HB   TYR  19          HB2       TYR  19  -2.568  -1.736   0.160
  134   2HB   TYR  19          HB1       TYR  19  -4.217  -1.101   0.119
  135    HD1  TYR  19           HD1      TYR  19  -1.113   0.049   0.651
  136    HD2  TYR  19           HD2      TYR  19  -4.787  -0.352   2.841
  137    HE1  TYR  19           HE1      TYR  19  -0.428   1.911   2.143
  138    HE2  TYR  19           HE2      TYR  19  -4.104   1.506   4.336
  139    HH   TYR  19           HH       TYR  19  -2.463   2.901   4.896
  140    H    CYS  20           H        CYS  20  -2.710  -4.766   2.148
  141    HA   CYS  20           HA       CYS  20  -3.283  -6.048  -0.424
  142   1HB   CYS  20          HB2       CYS  20  -1.815  -6.842   2.089
  143   2HB   CYS  20          HB1       CYS  20  -2.009  -7.935   0.750
  144    H    ASN  21           H        ASN  21  -4.028  -8.532  -0.034
  145    HA   ASN  21           HA       ASN  21  -6.715  -8.600   0.617
  146   1HB   ASN  21          HB2       ASN  21  -5.727 -10.550  -0.376
  147   2HB   ASN  21          HB1       ASN  21  -4.624 -10.761   0.985
  148   1HD2  ASN  21          HD21      ASN  21  -7.487 -11.949  -0.278
  149   2HD2  ASN  21          HD22      ASN  21  -8.185 -12.543   1.151
  150   1H    PHE   1           HT1      PHE   1  11.179  -1.286   0.632
  151   2H    PHE   1           HT2      PHE   1  11.853  -2.833   0.443
  152   3H    PHE   1           HT3      PHE   1  10.300  -2.501  -0.162
  153    HA   PHE   1           HA       PHE   1  12.641  -2.377  -1.564
  154   1HB   PHE   1          HB2       PHE   1   9.923  -1.129  -2.064
  155   2HB   PHE   1          HB1       PHE   1  11.170  -1.304  -3.300
  156    HD1  PHE   1           HD1      PHE   1   8.275  -2.777  -2.089
  157    HD2  PHE   1           HD2      PHE   1  12.291  -3.816  -3.214
  158    HE1  PHE   1           HE1      PHE   1   7.559  -5.118  -2.491
  159    HE2  PHE   1           HE2      PHE   1  11.573  -6.157  -3.615
  160    HZ   PHE   1           HZ       PHE   1   9.208  -6.808  -3.255
  161    H    VAL   2           H        VAL   2  13.387  -0.422  -2.893
  162    HA   VAL   2           HA       VAL   2  14.081   1.729  -1.027
  163    HB   VAL   2           HB       VAL   2  15.354   2.615  -3.025
  164   1HG1  VAL   2          HG11      VAL   2  16.084   0.730  -1.303
  165   2HG1  VAL   2          HG12      VAL   2  17.095   1.117  -2.696
  166   3HG1  VAL   2          HG13      VAL   2  16.031  -0.290  -2.742
  167   1HG2  VAL   2          HG21      VAL   2  14.751   0.004  -4.374
  168   2HG2  VAL   2          HG22      VAL   2  15.297   1.523  -5.082
  169   3HG2  VAL   2          HG23      VAL   2  13.620   1.343  -4.564
  170    H    ASN   3           H        ASN   3  13.482   3.934  -1.276
  171    HA   ASN   3           HA       ASN   3  11.780   5.553  -1.580
  172   1HB   ASN   3          HB2       ASN   3  11.492   6.053  -4.068
  173   2HB   ASN   3          HB1       ASN   3  13.151   6.074  -3.468
  174   1HD2  ASN   3          HD21      ASN   3  14.524   4.173  -3.972
  175   2HD2  ASN   3          HD22      ASN   3  14.130   3.157  -5.273
  176    H    GLN   4           H        GLN   4   9.887   4.640  -0.699
  177    HA   GLN   4           HA       GLN   4   8.297   2.741  -2.264
  178   1HB   GLN   4          HB2       GLN   4   8.498   3.271   0.422
  179   2HB   GLN   4          HB1       GLN   4   7.001   4.100   0.009
  180   1HG   GLN   4          HG2       GLN   4   7.655   1.180  -0.412
  181   2HG   GLN   4          HG1       GLN   4   6.376   1.867   0.591
  182   1HE2  GLN   4          HE21      GLN   4   5.255   3.775  -1.120
  183   2HE2  GLN   4          HE22      GLN   4   4.610   3.013  -2.490
  184    H    HIS   5           H        HIS   5   8.274   4.416  -4.099
  185    HA   HIS   5           HA       HIS   5   6.097   6.430  -3.741
  186   1HB   HIS   5          HB2       HIS   5   8.531   6.247  -5.413
  187   2HB   HIS   5          HB1       HIS   5   7.106   6.805  -6.281
  188    HD2  HIS   5           HD2      HIS   5   9.763   8.185  -3.911
  189    HE1  HIS   5           HE1      HIS   5   6.664  11.055  -4.107
  190    HE2  HIS   5           HE2      HIS   5   9.070  10.633  -3.368
  191    H    LEU   6           H        LEU   6   4.217   5.160  -4.062
  192    HA   LEU   6           HA       LEU   6   4.080   3.720  -6.688
  193   1HB   LEU   6          HB2       LEU   6   3.025   3.031  -3.987
  194   2HB   LEU   6          HB1       LEU   6   2.162   2.507  -5.417
  195    HG   LEU   6           HG       LEU   6   3.832   1.035  -6.049
  196   1HD1  LEU   6          HD11      LEU   6   5.642   2.608  -6.312
  197   2HD1  LEU   6          HD12      LEU   6   6.223   1.308  -5.275
  198   3HD1  LEU   6          HD13      LEU   6   5.751   2.851  -4.568
  199   1HD2  LEU   6          HD21      LEU   6   4.923   0.161  -3.860
  200   2HD2  LEU   6          HD22      LEU   6   3.165   0.124  -3.987
  201   3HD2  LEU   6          HD23      LEU   6   3.954   1.401  -3.064
  202    H    CYS   7           H        CYS   7   2.741   4.741  -8.071
  203    HA   CYS   7           HA       CYS   7   0.201   5.802  -6.961
  204   1HB   CYS   7          HB2       CYS   7   0.902   7.402  -9.225
  205   2HB   CYS   7          HB1       CYS   7   0.631   7.925  -7.569
  206    H    GLY   8           H        GLY   8  -1.526   5.865  -8.585
  207   1HA   GLY   8          HA2       GLY   8  -2.776   4.680 -10.191
  208   2HA   GLY   8          HA1       GLY   8  -1.445   5.140 -11.250
  209    H    SER   9           H        SER   9  -1.087   3.301 -12.416
  210    HA   SER   9           HA       SER   9  -1.428   0.635 -11.579
  211   1HB   SER   9          HB2       SER   9   0.052   0.031 -13.451
  212   2HB   SER   9          HB1       SER   9  -1.067   1.304 -13.932
  213    HG   SER   9           HG       SER   9   0.996   1.874 -14.583
  214    H    ASP  10           H        ASP  10   1.577   2.587 -11.521
  215    HA   ASP  10           HA       ASP  10   3.413   0.757 -10.574
  216   1HB   ASP  10          HB2       ASP  10   3.019   3.546  -9.444
  217   2HB   ASP  10          HB1       ASP  10   4.505   2.600  -9.369
  218    H    LEU  11           H        LEU  11   0.779   2.248  -8.742
  219    HA   LEU  11           HA       LEU  11   1.576   1.073  -6.210
  220   1HB   LEU  11          HB2       LEU  11   0.125   3.117  -6.445
  221   2HB   LEU  11          HB1       LEU  11  -1.156   2.074  -7.057
  222    HG   LEU  11           HG       LEU  11  -1.201   0.833  -4.945
  223   1HD1  LEU  11          HD11      LEU  11   0.919   2.793  -4.021
  224   2HD1  LEU  11          HD12      LEU  11   1.224   1.097  -4.396
  225   3HD1  LEU  11          HD13      LEU  11   0.170   1.527  -3.049
  226   1HD2  LEU  11          HD21      LEU  11  -2.679   2.498  -4.546
  227   2HD2  LEU  11          HD22      LEU  11  -1.567   3.739  -5.125
  228   3HD2  LEU  11          HD23      LEU  11  -1.426   3.127  -3.476
  229    H    THR  12           H        THR  12  -0.771   0.219  -8.751
  230    HA   THR  12           HA       THR  12  -1.756  -2.132  -7.411
  231    HB   THR  12           HB       THR  12  -1.541  -1.601 -10.395
  232    HG1  THR  12           HG1      THR  12  -3.960  -1.253  -9.698
  233   1HG2  THR  12          HG21      THR  12  -3.548  -3.188 -10.393
  234   2HG2  THR  12          HG22      THR  12  -3.098  -3.593  -8.737
  235   3HG2  THR  12          HG23      THR  12  -1.980  -3.923 -10.060
  236    H    GLU  13           H        GLU  13   0.786  -1.615  -9.858
  237    HA   GLU  13           HA       GLU  13   1.695  -4.242 -10.180
  238   1HB   GLU  13          HB2       GLU  13   2.705  -1.600 -10.657
  239   2HB   GLU  13          HB1       GLU  13   3.997  -2.574  -9.959
  240   1HG   GLU  13          HG2       GLU  13   3.690  -4.291 -11.655
  241   2HG   GLU  13          HG1       GLU  13   2.285  -3.445 -12.305
  242    H    ALA  14           H        ALA  14   2.921  -1.874  -7.789
  243    HA   ALA  14           HA       ALA  14   4.500  -3.754  -6.333
  244   1HB   ALA  14          HB1       ALA  14   3.122  -1.252  -5.299
  245   2HB   ALA  14          HB2       ALA  14   4.705  -1.286  -6.075
  246   3HB   ALA  14          HB3       ALA  14   4.467  -2.089  -4.523
  247    H    LEU  15           H        LEU  15   1.268  -2.418  -5.562
  248    HA   LEU  15           HA       LEU  15   0.599  -4.016  -3.369
  249   1HB   LEU  15          HB2       LEU  15  -0.942  -2.767  -5.596
  250   2HB   LEU  15          HB1       LEU  15  -1.773  -4.011  -4.666
  251    HG   LEU  15           HG       LEU  15  -0.378  -1.613  -3.447
  252   1HD1  LEU  15          HD11      LEU  15  -2.267  -0.410  -3.722
  253   2HD1  LEU  15          HD12      LEU  15  -3.277  -1.750  -3.177
  254   3HD1  LEU  15          HD13      LEU  15  -2.781  -1.651  -4.867
  255   1HD2  LEU  15          HD21      LEU  15  -2.166  -3.798  -2.337
  256   2HD2  LEU  15          HD22      LEU  15  -1.773  -2.324  -1.452
  257   3HD2  LEU  15          HD23      LEU  15  -0.495  -3.458  -1.889
  258    H    TYR  16           H        TYR  16  -0.131  -4.773  -6.768
  259    HA   TYR  16           HA       TYR  16  -1.108  -7.342  -6.578
  260   1HB   TYR  16          HB2       TYR  16  -0.269  -5.772  -8.626
  261   2HB   TYR  16          HB1       TYR  16   0.994  -6.997  -8.636
  262    HD1  TYR  16           HD1      TYR  16  -2.211  -6.184  -9.808
  263    HD2  TYR  16           HD2      TYR  16   0.100  -9.497  -8.353
  264    HE1  TYR  16           HE1      TYR  16  -3.775  -7.754 -10.915
  265    HE2  TYR  16           HE2      TYR  16  -1.462 -11.074  -9.458
  266    HH   TYR  16           HH       TYR  16  -4.428 -10.370 -10.398
  267    H    LEU  17           H        LEU  17   2.286  -6.352  -6.316
  268    HA   LEU  17           HA       LEU  17   3.164  -9.141  -6.092
  269   1HB   LEU  17          HB2       LEU  17   4.408  -6.942  -7.021
  270   2HB   LEU  17          HB1       LEU  17   4.986  -6.912  -5.354
  271    HG   LEU  17           HG       LEU  17   5.191  -9.257  -7.268
  272   1HD1  LEU  17          HD11      LEU  17   7.390  -8.681  -7.611
  273   2HD1  LEU  17          HD12      LEU  17   7.556  -7.948  -6.016
  274   3HD1  LEU  17          HD13      LEU  17   6.746  -7.067  -7.311
  275   1HD2  LEU  17          HD21      LEU  17   5.104 -10.367  -5.256
  276   2HD2  LEU  17          HD22      LEU  17   5.594  -8.947  -4.334
  277   3HD2  LEU  17          HD23      LEU  17   6.803  -9.895  -5.202
  278    H    VAL  18           H        VAL  18   3.510  -6.284  -3.931
  279    HA   VAL  18           HA       VAL  18   4.404  -7.517  -1.633
  280    HB   VAL  18           HB       VAL  18   2.458  -5.912  -0.528
  281   1HG1  VAL  18          HG11      VAL  18   5.093  -5.939  -0.509
  282   2HG1  VAL  18          HG12      VAL  18   4.204  -4.482  -0.062
  283   3HG1  VAL  18          HG13      VAL  18   4.897  -4.632  -1.678
  284   1HG2  VAL  18          HG21      VAL  18   3.291  -4.406  -2.981
  285   2HG2  VAL  18          HG22      VAL  18   1.907  -4.136  -1.923
  286   3HG2  VAL  18          HG23      VAL  18   1.893  -5.473  -3.073
  287    H    CYS  19           H        CYS  19   1.215  -7.714  -3.003
  288    HA   CYS  19           HA       CYS  19   0.404  -9.510  -0.761
  289   1HB   CYS  19          HB2       CYS  19  -1.667  -8.652  -2.677
  290   2HB   CYS  19          HB1       CYS  19  -1.702  -8.674  -0.923
  291    H    GLY  20           H        GLY  20  -0.559  -9.203  -4.187
  292   1HA   GLY  20          HA2       GLY  20  -0.903 -10.891  -5.796
  293   2HA   GLY  20          HA1       GLY  20   0.558 -11.625  -5.126
  294    H    GLU  21           H        GLU  21   0.341 -13.418  -3.779
  295    HA   GLU  21           HA       GLU  21  -2.038 -14.943  -3.805
  296   1HB   GLU  21          HB2       GLU  21   0.072 -14.935  -1.618
  297   2HB   GLU  21          HB1       GLU  21  -1.047 -16.249  -1.986
  298   1HG   GLU  21          HG2       GLU  21   0.658 -15.247  -4.217
  299   2HG   GLU  21          HG1       GLU  21   1.447 -16.205  -2.965
  300    H    ARG  22           H        ARG  22  -1.043 -12.261  -1.857
  301    HA   ARG  22           HA       ARG  22  -3.324 -12.611  -0.004
  302   1HB   ARG  22          HB2       ARG  22  -1.229 -10.421  -0.094
  303   2HB   ARG  22          HB1       ARG  22  -2.372 -10.725   1.214
  304   1HG   ARG  22          HG2       ARG  22  -0.242 -12.670   0.275
  305   2HG   ARG  22          HG1       ARG  22  -0.131 -11.664   1.720
  306   1HD   ARG  22          HD2       ARG  22  -1.298 -13.190   2.888
  307   2HD   ARG  22          HD1       ARG  22  -2.648 -13.029   1.764
  308    HE   ARG  22           HE       ARG  22  -1.241 -14.723   0.336
  309   1HH1  ARG  22          HH21      ARG  22  -0.025 -14.538   3.423
  310   2HH1  ARG  22          HH22      ARG  22  -0.282 -16.201   3.831
  311   1HH2  ARG  22          HH11      ARG  22  -2.159 -16.883   0.998
  312   2HH2  ARG  22          HH12      ARG  22  -1.489 -17.528   2.458
  313    H    GLY  23           H        GLY  23  -3.984 -12.275  -2.667
  314   1HA   GLY  23          HA2       GLY  23  -4.561 -10.345  -4.201
  315   2HA   GLY  23          HA1       GLY  23  -5.981 -10.974  -3.376
  316    H    PHE  24           H        PHE  24  -4.025  -8.238  -3.876
  317    HA   PHE  24           HA       PHE  24  -4.670  -6.729  -1.502
  318   1HB   PHE  24          HB2       PHE  24  -3.915  -4.780  -2.782
  319   2HB   PHE  24          HB1       PHE  24  -2.816  -6.122  -3.048
  320    HD1  PHE  24           HD1      PHE  24  -5.009  -3.744  -4.601
  321    HD2  PHE  24           HD2      PHE  24  -3.092  -7.544  -5.179
  322    HE1  PHE  24           HE1      PHE  24  -5.387  -3.562  -7.043
  323    HE2  PHE  24           HE2      PHE  24  -3.473  -7.363  -7.619
  324    HZ   PHE  24           HZ       PHE  24  -4.618  -5.373  -8.553
  325    H    PHE  25           H        PHE  25  -6.308  -4.984  -1.374
  326    HA   PHE  25           HA       PHE  25  -8.552  -5.436  -3.296
  327   1HB   PHE  25          HB2       PHE  25 -10.106  -5.417  -1.590
  328   2HB   PHE  25          HB1       PHE  25  -8.734  -6.115  -0.739
  329    HD1  PHE  25           HD1      PHE  25 -11.298  -3.935  -0.284
  330    HD2  PHE  25           HD2      PHE  25  -7.012  -3.998   0.026
  331    HE1  PHE  25           HE1      PHE  25 -11.389  -2.075   1.351
  332    HE2  PHE  25           HE2      PHE  25  -7.103  -2.137   1.662
  333    HZ   PHE  25           HZ       PHE  25  -9.291  -1.172   2.324
  334    H    TYR  26           H        TYR  26  -6.597  -3.568  -3.884
  335    HA   TYR  26           HA       TYR  26  -6.839  -0.925  -3.083
  336   1HB   TYR  26          HB2       TYR  26  -5.248  -1.560  -4.795
  337   2HB   TYR  26          HB1       TYR  26  -6.535  -2.054  -5.882
  338    HD1  TYR  26           HD1      TYR  26  -5.861   1.002  -3.802
  339    HD2  TYR  26           HD2      TYR  26  -6.783  -0.616  -7.674
  340    HE1  TYR  26           HE1      TYR  26  -5.923   3.292  -4.747
  341    HE2  TYR  26           HE2      TYR  26  -6.841   1.673  -8.623
  342    HH   TYR  26           HH       TYR  26  -5.526   4.179  -7.468
  343    H    THR  27           H        THR  27  -8.260   0.844  -3.761
  344    HA   THR  27           HA       THR  27 -10.825  -0.091  -4.974
  345    HB   THR  27           HB       THR  27 -11.562   0.063  -2.795
  346    HG1  THR  27           HG1      THR  27 -12.829   1.756  -2.844
  347   1HG2  THR  27          HG21      THR  27  -9.189   1.783  -2.494
  348   2HG2  THR  27          HG22      THR  27  -9.894   0.629  -1.366
  349   3HG2  THR  27          HG23      THR  27 -10.557   2.258  -1.491
  350    H    LYS  28           H        LYS  28  -9.455   3.023  -3.817
  351    HA   LYS  28           HA       LYS  28  -9.016   4.983  -5.078
  352   1HB   LYS  28          HB2       LYS  28  -8.707   3.173  -7.004
  353   2HB   LYS  28          HB1       LYS  28 -10.262   3.809  -7.536
  354   1HG   LYS  28          HG2       LYS  28  -9.370   6.056  -7.666
  355   2HG   LYS  28          HG1       LYS  28  -7.848   5.540  -6.938
  356   1HD   LYS  28          HD2       LYS  28  -7.073   5.115  -9.010
  357   2HD   LYS  28          HD1       LYS  28  -8.261   3.816  -9.127
  358   1HE   LYS  28          HE2       LYS  28  -9.920   5.752  -9.742
  359   2HE   LYS  28          HE1       LYS  28  -8.449   6.642 -10.130
  360   1HZ   LYS  28          HZ1       LYS  28  -9.438   4.125 -11.325
  361   2HZ   LYS  28          HZ2       LYS  28  -7.815   4.607 -11.474
  362   3HZ   LYS  28          HZ3       LYS  28  -9.055   5.581 -12.104
  363    HA   PRO  29           HA       PRO  29 -13.488   5.742  -4.404
  364   1HB   PRO  29          HB2       PRO  29 -13.070   7.673  -2.490
  365   2HB   PRO  29          HB1       PRO  29 -13.186   5.943  -2.126
  366   1HG   PRO  29          HG2       PRO  29 -10.768   7.690  -2.201
  367   2HG   PRO  29          HG1       PRO  29 -11.054   6.210  -1.270
  368   1HD   PRO  29          HD2       PRO  29  -9.527   6.401  -3.641
  369   2HD   PRO  29          HD1       PRO  29 -10.110   4.897  -2.894
  370    H    THR  30           H        THR  30 -12.987   6.671  -6.682
  371    HA   THR  30           HA       THR  30 -12.556   9.621  -6.594
  372    HB   THR  30           HB       THR  30 -12.589   7.797  -9.015
  373    HG1  THR  30           HG1      THR  30 -10.876   7.161  -7.815
  374   1HG2  THR  30          HG21      THR  30 -11.200   9.764  -9.908
  375   2HG2  THR  30          HG22      THR  30 -11.788  10.663  -8.509
  376   3HG2  THR  30          HG23      THR  30 -12.928  10.041  -9.701
  Start of MODEL    3
    1   1H    GLY   1           HT1      GLY   1  -7.164   7.793   0.870
    2   2H    GLY   1           HT2      GLY   1  -6.181   6.609   1.590
    3   3H    GLY   1           HT3      GLY   1  -6.826   6.351   0.040
    4   1HA   GLY   1          HA1       GLY   1  -5.278   7.747  -0.901
    5   2HA   GLY   1          HA2       GLY   1  -5.095   8.769   0.556
    6    H    ILE   2           H        ILE   2  -4.995   5.193   0.120
    7    HA   ILE   2           HA       ILE   2  -2.358   4.628   0.497
    8    HB   ILE   2           HB       ILE   2  -4.301   3.032  -0.064
    9   1HG1  ILE   2          HG12      ILE   2  -2.571   1.410  -1.196
   10   2HG1  ILE   2          HG11      ILE   2  -1.432   2.721  -0.882
   11   1HG2  ILE   2          HG21      ILE   2  -4.416   2.288  -2.399
   12   2HG2  ILE   2          HG22      ILE   2  -3.200   3.482  -2.855
   13   3HG2  ILE   2          HG23      ILE   2  -4.787   4.010  -2.295
   14   1HD1  ILE   2          HD11      ILE   2  -3.153   2.208   1.413
   15   2HD1  ILE   2          HD12      ILE   2  -1.393   2.278   1.330
   16   3HD1  ILE   2          HD13      ILE   2  -2.234   0.776   0.948
   17    H    VAL   3           H        VAL   3  -3.744   5.577  -2.664
   18    HA   VAL   3           HA       VAL   3  -1.362   5.399  -4.182
   19    HB   VAL   3           HB       VAL   3  -3.644   7.382  -4.424
   20   1HG1  VAL   3          HG11      VAL   3  -2.787   7.423  -6.856
   21   2HG1  VAL   3          HG12      VAL   3  -1.297   6.736  -6.212
   22   3HG1  VAL   3          HG13      VAL   3  -1.847   8.318  -5.661
   23   1HG2  VAL   3          HG21      VAL   3  -3.436   5.300  -6.435
   24   2HG2  VAL   3          HG22      VAL   3  -4.796   5.702  -5.388
   25   3HG2  VAL   3          HG23      VAL   3  -3.540   4.603  -4.818
   26    H    GLU   4           H        GLU   4  -2.673   8.586  -3.382
   27    HA   GLU   4           HA       GLU   4  -0.273   9.983  -3.532
   28   1HB   GLU   4          HB2       GLU   4  -2.256  11.271  -3.345
   29   2HB   GLU   4          HB1       GLU   4  -2.758  10.436  -1.874
   30   1HG   GLU   4          HG2       GLU   4  -0.995  11.488  -0.596
   31   2HG   GLU   4          HG1       GLU   4  -0.292  12.179  -2.054
   32    H    GLN   5           H        GLN   5  -1.732   8.622  -0.559
   33    HA   GLN   5           HA       GLN   5   0.182   9.306   1.315
   34   1HB   GLN   5          HB2       GLN   5  -1.919   7.747   1.505
   35   2HB   GLN   5          HB1       GLN   5  -0.758   6.452   1.209
   36   1HG   GLN   5          HG2       GLN   5  -0.713   6.612   3.543
   37   2HG   GLN   5          HG1       GLN   5   0.640   7.647   3.082
   38   1HE2  GLN   5          HE21      GLN   5  -2.790   7.735   4.096
   39   2HE2  GLN   5          HE22      GLN   5  -2.757   9.349   4.621
   40    H    CYS   6           H        CYS   6   0.457   6.834  -1.208
   41    HA   CYS   6           HA       CYS   6   3.242   6.305  -0.285
   42   1HB   CYS   6          HB2       CYS   6   1.455   4.741  -2.171
   43   2HB   CYS   6          HB1       CYS   6   3.121   4.320  -1.790
   44    H    CYS   7           H        CYS   7   1.512   8.036  -2.666
   45    HA   CYS   7           HA       CYS   7   3.807   7.864  -4.547
   46   1HB   CYS   7          HB2       CYS   7   1.570   7.600  -5.542
   47   2HB   CYS   7          HB1       CYS   7   1.083   9.164  -4.909
   48    H    THR   8           H        THR   8   1.780  10.766  -4.247
   49    HA   THR   8           HA       THR   8   3.842  12.636  -4.363
   50    HB   THR   8           HB       THR   8   1.282  12.731  -2.746
   51    HG1  THR   8           HG1      THR   8   1.594  12.766  -5.229
   52   1HG2  THR   8          HG21      THR   8   2.194  15.341  -3.315
   53   2HG2  THR   8          HG22      THR   8   3.569  14.474  -2.630
   54   3HG2  THR   8          HG23      THR   8   2.053  14.578  -1.732
   55    H    SER   9           H        SER   9   2.570  10.935  -1.567
   56    HA   SER   9           HA       SER   9   4.961  11.760   0.022
   57   1HB   SER   9          HB2       SER   9   2.562  12.108   0.953
   58   2HB   SER   9          HB1       SER   9   2.492  10.353   1.078
   59    HG   SER   9           HG       SER   9   4.258  12.163   2.351
   60    H    ILE  10           H        ILE  10   5.808   9.763   1.364
   61    HA   ILE  10           HA       ILE  10   5.450   7.351  -0.370
   62    HB   ILE  10           HB       ILE  10   7.940   8.321   1.058
   63   1HG1  ILE  10          HG12      ILE  10   8.867   8.264  -1.241
   64   2HG1  ILE  10          HG11      ILE  10   7.295   7.759  -1.860
   65   1HG2  ILE  10          HG21      ILE  10   8.977   6.260   0.190
   66   2HG2  ILE  10          HG22      ILE  10   7.422   5.757  -0.461
   67   3HG2  ILE  10          HG23      ILE  10   7.645   5.873   1.280
   68   1HD1  ILE  10          HD11      ILE  10   8.113  10.355  -1.708
   69   2HD1  ILE  10          HD12      ILE  10   7.251  10.187  -0.180
   70   3HD1  ILE  10          HD13      ILE  10   6.423   9.852  -1.701
   71    H    CYS  11           H        CYS  11   5.221   5.346   0.650
   72    HA   CYS  11           HA       CYS  11   4.855   5.494   3.622
   73   1HB   CYS  11          HB2       CYS  11   3.182   3.675   3.348
   74   2HB   CYS  11          HB1       CYS  11   2.725   5.128   2.461
   75    H    SER  12           H        SER  12   4.760   2.882   4.310
   76    HA   SER  12           HA       SER  12   7.442   1.886   3.453
   77   1HB   SER  12          HB2       SER  12   7.607   0.810   5.601
   78   2HB   SER  12          HB1       SER  12   7.066   2.462   5.892
   79    HG   SER  12           HG       SER  12   5.354   1.638   6.765
   80    H    LEU  13           H        LEU  13   7.640  -0.543   3.434
   81    HA   LEU  13           HA       LEU  13   5.711  -1.716   1.700
   82   1HB   LEU  13          HB2       LEU  13   8.125  -2.598   3.144
   83   2HB   LEU  13          HB1       LEU  13   6.949  -3.881   2.854
   84    HG   LEU  13           HG       LEU  13   8.627  -3.588   0.996
   85   1HD1  LEU  13          HD11      LEU  13   5.669  -3.195   0.514
   86   2HD1  LEU  13          HD12      LEU  13   6.601  -4.689   0.417
   87   3HD1  LEU  13          HD13      LEU  13   6.804  -3.442  -0.813
   88   1HD2  LEU  13          HD21      LEU  13   7.121  -1.172   0.098
   89   2HD2  LEU  13          HD22      LEU  13   8.800  -1.620  -0.195
   90   3HD2  LEU  13          HD23      LEU  13   8.328  -0.944   1.364
   91    H    TYR  14           H        TYR  14   6.084  -1.828   5.218
   92    HA   TYR  14           HA       TYR  14   4.160  -3.880   5.718
   93   1HB   TYR  14          HB2       TYR  14   5.707  -3.088   7.456
   94   2HB   TYR  14          HB1       TYR  14   4.933  -1.503   7.439
   95    HD1  TYR  14           HD1      TYR  14   3.487  -4.953   7.296
   96    HD2  TYR  14           HD2      TYR  14   3.784  -1.259   9.474
   97    HE1  TYR  14           HE1      TYR  14   1.788  -5.768   8.909
   98    HE2  TYR  14           HE2      TYR  14   2.083  -2.075  11.088
   99    HH   TYR  14           HH       TYR  14   0.384  -5.132  10.577
  100    H    GLN  15           H        GLN  15   3.818  -0.480   4.934
  101    HA   GLN  15           HA       GLN  15   1.067  -0.326   5.823
  102   1HB   GLN  15          HB2       GLN  15   2.617   1.440   3.906
  103   2HB   GLN  15          HB1       GLN  15   1.035   1.824   4.585
  104   1HG   GLN  15          HG2       GLN  15   2.331   1.275   6.871
  105   2HG   GLN  15          HG1       GLN  15   3.704   1.810   5.902
  106   1HE2  GLN  15          HE21      GLN  15   0.326   2.861   6.637
  107   2HE2  GLN  15          HE22      GLN  15   0.696   4.517   6.667
  108    H    LEU  16           H        LEU  16   2.540  -0.505   2.544
  109    HA   LEU  16           HA       LEU  16   0.094  -0.762   1.149
  110   1HB   LEU  16          HB2       LEU  16   2.908  -1.283   0.590
  111   2HB   LEU  16          HB1       LEU  16   1.886  -2.519  -0.137
  112    HG   LEU  16           HG       LEU  16   1.969  -0.894  -1.816
  113   1HD1  LEU  16          HD11      LEU  16  -0.339   0.439  -0.531
  114   2HD1  LEU  16          HD12      LEU  16  -0.443  -1.318  -0.628
  115   3HD1  LEU  16          HD13      LEU  16  -0.232  -0.364  -2.096
  116   1HD2  LEU  16          HD21      LEU  16   1.710   1.191   0.366
  117   2HD2  LEU  16          HD22      LEU  16   1.830   1.534  -1.360
  118   3HD2  LEU  16          HD23      LEU  16   3.184   0.786  -0.512
  119    H    GLU  17           H        GLU  17   1.670  -2.878   3.332
  120    HA   GLU  17           HA       GLU  17   0.457  -5.363   2.425
  121   1HB   GLU  17          HB2       GLU  17   1.853  -4.462   4.940
  122   2HB   GLU  17          HB1       GLU  17   1.031  -6.018   4.889
  123   1HG   GLU  17          HG2       GLU  17   2.896  -5.364   2.648
  124   2HG   GLU  17          HG1       GLU  17   3.603  -5.775   4.211
  125    H    ASN  18           H        ASN  18  -0.403  -2.741   4.581
  126    HA   ASN  18           HA       ASN  18  -2.537  -4.032   5.960
  127   1HB   ASN  18          HB2       ASN  18  -1.913  -1.146   5.331
  128   2HB   ASN  18          HB1       ASN  18  -3.294  -1.628   6.307
  129   1HD2  ASN  18          HD21      ASN  18  -0.546  -3.729   6.605
  130   2HD2  ASN  18          HD22      ASN  18   0.009  -3.136   8.091
  131    H    TYR  19           H        TYR  19  -2.264  -2.740   2.747
  132    HA   TYR  19           HA       TYR  19  -5.215  -2.885   2.475
  133   1HB   TYR  19          HB2       TYR  19  -3.142  -1.618   0.665
  134   2HB   TYR  19          HB1       TYR  19  -4.881  -1.632   0.354
  135    HD1  TYR  19           HD1      TYR  19  -2.378  -0.690   2.958
  136    HD2  TYR  19           HD2      TYR  19  -6.261   0.041   1.273
  137    HE1  TYR  19           HE1      TYR  19  -2.664   1.249   4.475
  138    HE2  TYR  19           HE2      TYR  19  -6.552   1.981   2.795
  139    HH   TYR  19           HH       TYR  19  -4.615   2.526   5.472
  140    H    CYS  20           H        CYS  20  -2.745  -4.928   2.232
  141    HA   CYS  20           HA       CYS  20  -3.188  -6.107  -0.380
  142   1HB   CYS  20          HB2       CYS  20  -1.725  -6.829   2.113
  143   2HB   CYS  20          HB1       CYS  20  -2.070  -8.112   0.991
  144    H    ASN  21           H        ASN  21  -4.071  -8.540  -0.349
  145    HA   ASN  21           HA       ASN  21  -6.642  -8.404   1.123
  146   1HB   ASN  21          HB2       ASN  21  -6.753  -9.008  -1.246
  147   2HB   ASN  21          HB1       ASN  21  -5.674 -10.374  -0.971
  148   1HD2  ASN  21          HD21      ASN  21  -8.933  -9.123  -0.220
  149   2HD2  ASN  21          HD22      ASN  21  -9.589 -10.630   0.202
  150   1H    PHE   1           HT1      PHE   1  10.683  -3.019  -0.394
  151   2H    PHE   1           HT2      PHE   1  12.283  -2.984   0.176
  152   3H    PHE   1           HT3      PHE   1  11.800  -4.175  -0.934
  153    HA   PHE   1           HA       PHE   1  12.936  -2.683  -2.269
  154   1HB   PHE   1          HB2       PHE   1  10.220  -1.428  -2.466
  155   2HB   PHE   1          HB1       PHE   1  11.293  -1.971  -3.755
  156    HD1  PHE   1           HD1      PHE   1   8.328  -2.721  -2.068
  157    HD2  PHE   1           HD2      PHE   1  11.874  -4.617  -3.584
  158    HE1  PHE   1           HE1      PHE   1   7.135  -4.894  -2.139
  159    HE2  PHE   1           HE2      PHE   1  10.681  -6.791  -3.655
  160    HZ   PHE   1           HZ       PHE   1   8.310  -6.929  -2.934
  161    H    VAL   2           H        VAL   2  13.195  -0.327  -2.953
  162    HA   VAL   2           HA       VAL   2  13.164   1.388  -0.507
  163    HB   VAL   2           HB       VAL   2  14.955   2.681  -1.666
  164   1HG1  VAL   2          HG11      VAL   2  15.395  -0.309  -1.386
  165   2HG1  VAL   2          HG12      VAL   2  15.615   0.911  -0.131
  166   3HG1  VAL   2          HG13      VAL   2  16.693   0.877  -1.525
  167   1HG2  VAL   2          HG21      VAL   2  15.737   0.779  -3.625
  168   2HG2  VAL   2          HG22      VAL   2  15.188   2.434  -3.894
  169   3HG2  VAL   2          HG23      VAL   2  14.026   1.107  -3.892
  170    H    ASN   3           H        ASN   3  13.091   3.852  -1.218
  171    HA   ASN   3           HA       ASN   3  11.511   5.486  -1.879
  172   1HB   ASN   3          HB2       ASN   3  11.441   5.756  -4.331
  173   2HB   ASN   3          HB1       ASN   3  13.083   5.418  -3.781
  174   1HD2  ASN   3          HD21      ASN   3  10.522   4.296  -5.831
  175   2HD2  ASN   3          HD22      ASN   3  11.259   2.845  -6.313
  176    H    GLN   4           H        GLN   4   9.669   4.512  -0.797
  177    HA   GLN   4           HA       GLN   4   7.957   2.639  -2.260
  178   1HB   GLN   4          HB2       GLN   4   8.276   3.376   0.413
  179   2HB   GLN   4          HB1       GLN   4   6.739   4.112  -0.022
  180   1HG   GLN   4          HG2       GLN   4   7.460   1.187  -0.368
  181   2HG   GLN   4          HG1       GLN   4   6.391   1.848   0.865
  182   1HE2  GLN   4          HE21      GLN   4   5.262   3.822  -1.194
  183   2HE2  GLN   4          HE22      GLN   4   4.209   2.879  -2.134
  184    H    HIS   5           H        HIS   5   8.292   4.647  -3.998
  185    HA   HIS   5           HA       HIS   5   6.083   6.610  -3.669
  186   1HB   HIS   5          HB2       HIS   5   8.115   6.396  -5.913
  187   2HB   HIS   5          HB1       HIS   5   7.046   7.756  -5.587
  188    HD2  HIS   5           HD2      HIS   5   8.318   9.706  -4.166
  189    HE1  HIS   5           HE1      HIS   5  11.224   7.279  -2.288
  190    HE2  HIS   5           HE2      HIS   5  10.382   9.668  -2.583
  191    H    LEU   6           H        LEU   6   4.249   5.225  -4.069
  192    HA   LEU   6           HA       LEU   6   4.154   4.059  -6.826
  193   1HB   LEU   6          HB2       LEU   6   2.957   3.171  -4.231
  194   2HB   LEU   6          HB1       LEU   6   2.256   2.694  -5.770
  195    HG   LEU   6           HG       LEU   6   3.970   1.246  -6.248
  196   1HD1  LEU   6          HD11      LEU   6   5.845   3.102  -4.750
  197   2HD1  LEU   6          HD12      LEU   6   5.665   3.013  -6.502
  198   3HD1  LEU   6          HD13      LEU   6   6.336   1.647  -5.613
  199   1HD2  LEU   6          HD21      LEU   6   3.185   1.031  -3.724
  200   2HD2  LEU   6          HD22      LEU   6   4.860   1.478  -3.407
  201   3HD2  LEU   6          HD23      LEU   6   4.499   0.032  -4.347
  202    H    CYS   7           H        CYS   7   2.649   4.826  -8.190
  203    HA   CYS   7           HA       CYS   7   0.253   6.116  -7.008
  204   1HB   CYS   7          HB2       CYS   7   1.136   7.336  -9.538
  205   2HB   CYS   7          HB1       CYS   7   0.522   8.105  -8.081
  206    H    GLY   8           H        GLY   8  -1.643   5.730  -8.196
  207   1HA   GLY   8          HA2       GLY   8  -3.003   4.332  -9.526
  208   2HA   GLY   8          HA1       GLY   8  -2.040   5.040 -10.819
  209    H    SER   9           H        SER   9  -1.642   3.333 -12.149
  210    HA   SER   9           HA       SER   9  -1.490   0.643 -11.694
  211   1HB   SER   9          HB2       SER   9   0.259   0.550 -13.526
  212   2HB   SER   9          HB1       SER   9  -1.200   1.454 -13.924
  213    HG   SER   9           HG       SER   9   1.401   2.339 -13.433
  214    H    ASP  10           H        ASP  10   1.460   2.697 -11.554
  215    HA   ASP  10           HA       ASP  10   3.280   0.815 -10.642
  216   1HB   ASP  10          HB2       ASP  10   2.996   3.640  -9.566
  217   2HB   ASP  10          HB1       ASP  10   4.452   2.649  -9.493
  218    H    LEU  11           H        LEU  11   0.604   2.226  -8.894
  219    HA   LEU  11           HA       LEU  11   1.433   1.233  -6.291
  220   1HB   LEU  11          HB2       LEU  11  -0.185   3.178  -6.810
  221   2HB   LEU  11          HB1       LEU  11  -1.387   1.926  -7.112
  222    HG   LEU  11           HG       LEU  11  -1.167   1.087  -4.843
  223   1HD1  LEU  11          HD11      LEU  11   1.238   1.462  -4.510
  224   2HD1  LEU  11          HD12      LEU  11   0.318   2.241  -3.225
  225   3HD1  LEU  11          HD13      LEU  11   0.975   3.206  -4.544
  226   1HD2  LEU  11          HD21      LEU  11  -1.632   3.969  -5.353
  227   2HD2  LEU  11          HD22      LEU  11  -1.463   3.486  -3.665
  228   3HD2  LEU  11          HD23      LEU  11  -2.716   2.756  -4.671
  229    H    THR  12           H        THR  12  -0.671   0.107  -8.900
  230    HA   THR  12           HA       THR  12  -1.630  -2.220  -7.464
  231    HB   THR  12           HB       THR  12  -1.406  -1.710 -10.446
  232    HG1  THR  12           HG1      THR  12  -3.470  -0.987 -10.277
  233   1HG2  THR  12          HG21      THR  12  -2.185  -4.034  -8.908
  234   2HG2  THR  12          HG22      THR  12  -2.010  -3.863 -10.654
  235   3HG2  THR  12          HG23      THR  12  -3.535  -3.445  -9.876
  236    H    GLU  13           H        GLU  13   0.876  -1.707  -9.948
  237    HA   GLU  13           HA       GLU  13   1.891  -4.268 -10.237
  238   1HB   GLU  13          HB2       GLU  13   2.802  -1.630 -10.729
  239   2HB   GLU  13          HB1       GLU  13   4.106  -2.453  -9.880
  240   1HG   GLU  13          HG2       GLU  13   4.187  -4.206 -11.509
  241   2HG   GLU  13          HG1       GLU  13   2.668  -3.683 -12.240
  242    H    ALA  14           H        ALA  14   3.093  -1.943  -7.772
  243    HA   ALA  14           HA       ALA  14   4.603  -3.927  -6.353
  244   1HB   ALA  14          HB1       ALA  14   3.765  -1.925  -4.517
  245   2HB   ALA  14          HB2       ALA  14   4.008  -1.128  -6.072
  246   3HB   ALA  14          HB3       ALA  14   5.321  -2.050  -5.339
  247    H    LEU  15           H        LEU  15   1.417  -2.466  -5.647
  248    HA   LEU  15           HA       LEU  15   0.723  -3.968  -3.374
  249   1HB   LEU  15          HB2       LEU  15  -0.810  -2.716  -5.616
  250   2HB   LEU  15          HB1       LEU  15  -1.674  -3.821  -4.554
  251    HG   LEU  15           HG       LEU  15   0.037  -1.608  -3.434
  252   1HD1  LEU  15          HD11      LEU  15  -2.935  -1.387  -3.950
  253   2HD1  LEU  15          HD12      LEU  15  -1.737  -0.763  -5.084
  254   3HD1  LEU  15          HD13      LEU  15  -1.822  -0.115  -3.445
  255   1HD2  LEU  15          HD21      LEU  15  -2.011  -1.928  -1.728
  256   2HD2  LEU  15          HD22      LEU  15  -0.574  -2.948  -1.655
  257   3HD2  LEU  15          HD23      LEU  15  -2.030  -3.531  -2.463
  258    H    TYR  16           H        TYR  16   0.245  -4.776  -6.794
  259    HA   TYR  16           HA       TYR  16  -1.029  -7.256  -6.509
  260   1HB   TYR  16          HB2       TYR  16  -0.227  -5.792  -8.608
  261   2HB   TYR  16          HB1       TYR  16   1.090  -6.957  -8.601
  262    HD1  TYR  16           HD1      TYR  16  -0.253  -7.101 -10.973
  263    HD2  TYR  16           HD2      TYR  16  -1.589  -8.711  -7.216
  264    HE1  TYR  16           HE1      TYR  16  -1.697  -8.716 -12.175
  265    HE2  TYR  16           HE2      TYR  16  -3.033 -10.317  -8.419
  266    HH   TYR  16           HH       TYR  16  -4.076 -10.625 -10.543
  267    H    LEU  17           H        LEU  17   2.418  -6.451  -6.336
  268    HA   LEU  17           HA       LEU  17   3.192  -9.266  -6.096
  269   1HB   LEU  17          HB2       LEU  17   4.510  -7.099  -7.022
  270   2HB   LEU  17          HB1       LEU  17   5.126  -7.145  -5.367
  271    HG   LEU  17           HG       LEU  17   5.189  -9.403  -7.395
  272   1HD1  LEU  17          HD11      LEU  17   7.382  -7.816  -6.026
  273   2HD1  LEU  17          HD12      LEU  17   6.927  -7.703  -7.726
  274   3HD1  LEU  17          HD13      LEU  17   7.643  -9.189  -7.102
  275   1HD2  LEU  17          HD21      LEU  17   5.702  -9.314  -4.431
  276   2HD2  LEU  17          HD22      LEU  17   6.599 -10.445  -5.445
  277   3HD2  LEU  17          HD23      LEU  17   4.840 -10.530  -5.373
  278    H    VAL  18           H        VAL  18   3.491  -6.420  -3.899
  279    HA   VAL  18           HA       VAL  18   4.470  -7.631  -1.632
  280    HB   VAL  18           HB       VAL  18   2.420  -6.218  -0.471
  281   1HG1  VAL  18          HG11      VAL  18   5.109  -5.403  -1.541
  282   2HG1  VAL  18          HG12      VAL  18   4.633  -5.731   0.126
  283   3HG1  VAL  18          HG13      VAL  18   4.086  -4.258  -0.674
  284   1HG2  VAL  18          HG21      VAL  18   1.616  -4.555  -1.829
  285   2HG2  VAL  18          HG22      VAL  18   1.883  -5.780  -3.068
  286   3HG2  VAL  18          HG23      VAL  18   3.077  -4.508  -2.816
  287    H    CYS  19           H        CYS  19   1.112  -7.730  -2.680
  288    HA   CYS  19           HA       CYS  19   0.441  -9.637  -0.540
  289   1HB   CYS  19          HB2       CYS  19  -1.461  -9.217  -2.779
  290   2HB   CYS  19          HB1       CYS  19  -1.749  -9.231  -1.046
  291    H    GLY  20           H        GLY  20  -0.133  -9.802  -4.063
  292   1HA   GLY  20          HA2       GLY  20   0.252 -11.578  -5.568
  293   2HA   GLY  20          HA1       GLY  20   1.338 -12.282  -4.366
  294    H    GLU  21           H        GLU  21   0.598 -14.058  -3.238
  295    HA   GLU  21           HA       GLU  21  -1.764 -15.412  -3.942
  296   1HB   GLU  21          HB2       GLU  21  -0.491 -15.464  -1.188
  297   2HB   GLU  21          HB1       GLU  21  -1.471 -16.732  -1.922
  298   1HG   GLU  21          HG2       GLU  21   1.269 -15.796  -2.818
  299   2HG   GLU  21          HG1       GLU  21   0.850 -17.372  -2.146
  300    H    ARG  22           H        ARG  22  -1.197 -12.995  -1.437
  301    HA   ARG  22           HA       ARG  22  -4.102 -12.968  -0.807
  302   1HB   ARG  22          HB2       ARG  22  -1.814 -11.400   0.442
  303   2HB   ARG  22          HB1       ARG  22  -3.476 -11.458   1.031
  304   1HG   ARG  22          HG2       ARG  22  -3.209 -13.516   1.969
  305   2HG   ARG  22          HG1       ARG  22  -2.197 -14.097   0.645
  306   1HD   ARG  22          HD2       ARG  22  -0.761 -12.034   1.995
  307   2HD   ARG  22          HD1       ARG  22  -1.373 -13.149   3.216
  308    HE   ARG  22           HE       ARG  22  -0.312 -14.822   1.287
  309   1HH1  ARG  22          HH21      ARG  22   1.094 -11.843   1.791
  310   2HH1  ARG  22          HH22      ARG  22   2.612 -12.446   2.369
  311   1HH2  ARG  22          HH11      ARG  22   1.523 -15.729   2.597
  312   2HH2  ARG  22          HH12      ARG  22   2.855 -14.645   2.822
  313    H    GLY  23           H        GLY  23  -3.121 -12.185  -3.385
  314   1HA   GLY  23          HA2       GLY  23  -2.532  -9.827  -4.325
  315   2HA   GLY  23          HA1       GLY  23  -4.098 -10.468  -4.808
  316    H    PHE  24           H        PHE  24  -2.800  -7.695  -3.921
  317    HA   PHE  24           HA       PHE  24  -4.232  -6.683  -1.703
  318   1HB   PHE  24          HB2       PHE  24  -3.866  -4.485  -2.661
  319   2HB   PHE  24          HB1       PHE  24  -2.443  -5.452  -3.008
  320    HD1  PHE  24           HD1      PHE  24  -5.390  -3.800  -4.408
  321    HD2  PHE  24           HD2      PHE  24  -2.051  -6.360  -5.268
  322    HE1  PHE  24           HE1      PHE  24  -5.742  -3.438  -6.836
  323    HE2  PHE  24           HE2      PHE  24  -2.399  -6.000  -7.698
  324    HZ   PHE  24           HZ       PHE  24  -4.244  -4.538  -8.483
  325    H    PHE  25           H        PHE  25  -5.879  -4.693  -2.328
  326    HA   PHE  25           HA       PHE  25  -7.945  -5.844  -4.140
  327   1HB   PHE  25          HB2       PHE  25  -9.698  -5.428  -2.624
  328   2HB   PHE  25          HB1       PHE  25  -8.430  -6.121  -1.620
  329    HD1  PHE  25           HD1      PHE  25 -10.460  -3.210  -2.314
  330    HD2  PHE  25           HD2      PHE  25  -6.990  -4.615  -0.210
  331    HE1  PHE  25           HE1      PHE  25 -10.523  -1.191  -0.880
  332    HE2  PHE  25           HE2      PHE  25  -7.045  -2.592   1.226
  333    HZ   PHE  25           HZ       PHE  25  -8.811  -0.877   0.892
  334    H    TYR  26           H        TYR  26  -6.964  -2.850  -2.398
  335    HA   TYR  26           HA       TYR  26  -7.040  -0.606  -3.114
  336   1HB   TYR  26          HB2       TYR  26  -5.279  -1.428  -4.557
  337   2HB   TYR  26          HB1       TYR  26  -6.441  -2.078  -5.693
  338    HD1  TYR  26           HD1      TYR  26  -6.487   1.241  -3.970
  339    HD2  TYR  26           HD2      TYR  26  -6.033  -0.907  -7.663
  340    HE1  TYR  26           HE1      TYR  26  -6.445   3.386  -5.220
  341    HE2  TYR  26           HE2      TYR  26  -5.987   1.233  -8.911
  342    HH   TYR  26           HH       TYR  26  -6.334   3.450  -8.764
  343    H    THR  27           H        THR  27  -8.996   0.396  -3.002
  344    HA   THR  27           HA       THR  27 -11.176  -0.486  -4.826
  345    HB   THR  27           HB       THR  27 -11.608  -0.446  -2.384
  346    HG1  THR  27           HG1      THR  27 -13.210   0.122  -4.079
  347   1HG2  THR  27          HG21      THR  27 -11.007   2.501  -2.752
  348   2HG2  THR  27          HG22      THR  27 -10.177   1.365  -1.689
  349   3HG2  THR  27          HG23      THR  27 -11.835   1.850  -1.337
  350    H    LYS  28           H        LYS  28  -9.280   2.394  -4.027
  351    HA   LYS  28           HA       LYS  28  -9.071   4.403  -5.258
  352   1HB   LYS  28          HB2       LYS  28 -11.177   3.272  -7.133
  353   2HB   LYS  28          HB1       LYS  28 -10.118   4.643  -7.435
  354   1HG   LYS  28          HG2       LYS  28  -8.244   3.317  -7.725
  355   2HG   LYS  28          HG1       LYS  28  -8.903   1.979  -6.782
  356   1HD   LYS  28          HD2       LYS  28  -8.886   1.437  -9.191
  357   2HD   LYS  28          HD1       LYS  28 -10.539   1.534  -8.583
  358   1HE   LYS  28          HE2       LYS  28 -11.004   3.133 -10.094
  359   2HE   LYS  28          HE1       LYS  28  -9.748   4.156  -9.397
  360   1HZ   LYS  28          HZ1       LYS  28  -9.459   3.607 -11.800
  361   2HZ   LYS  28          HZ2       LYS  28  -9.188   1.992 -11.347
  362   3HZ   LYS  28          HZ3       LYS  28  -8.132   3.213 -10.820
  363    HA   PRO  29           HA       PRO  29 -12.885   5.666  -3.060
  364   1HB   PRO  29          HB2       PRO  29 -11.577   7.377  -1.350
  365   2HB   PRO  29          HB1       PRO  29 -11.815   5.653  -1.021
  366   1HG   PRO  29          HG2       PRO  29  -9.333   7.079  -1.861
  367   2HG   PRO  29          HG1       PRO  29  -9.506   5.577  -0.938
  368   1HD   PRO  29          HD2       PRO  29  -8.850   5.764  -3.685
  369   2HD   PRO  29          HD1       PRO  29  -9.356   4.290  -2.833
  370    H    THR  30           H        THR  30 -13.300   8.229  -2.424
  371    HA   THR  30           HA       THR  30 -13.249   9.613  -4.972
  372    HB   THR  30           HB       THR  30 -13.891  10.808  -2.264
  373    HG1  THR  30           HG1      THR  30 -15.466   9.444  -2.233
  374   1HG2  THR  30          HG21      THR  30 -15.607  11.931  -3.981
  375   2HG2  THR  30          HG22      THR  30 -14.316  11.546  -5.121
  376   3HG2  THR  30          HG23      THR  30 -13.986  12.578  -3.728
  Start of MODEL    4
    1   1H    GLY   1           HT1      GLY   1  -7.273   8.461  -0.963
    2   2H    GLY   1           HT2      GLY   1  -6.091   7.903  -2.048
    3   3H    GLY   1           HT3      GLY   1  -6.036   9.502  -1.479
    4   1HA   GLY   1          HA1       GLY   1  -4.771   8.770   0.207
    5   2HA   GLY   1          HA2       GLY   1  -6.127   7.768   0.807
    6    H    ILE   2           H        ILE   2  -5.090   5.577   0.123
    7    HA   ILE   2           HA       ILE   2  -2.389   5.187   0.465
    8    HB   ILE   2           HB       ILE   2  -4.549   3.602  -0.711
    9   1HG1  ILE   2          HG12      ILE   2  -2.084   2.479   0.543
   10   2HG1  ILE   2          HG11      ILE   2  -3.123   3.516   1.524
   11   1HG2  ILE   2          HG21      ILE   2  -3.287   3.343  -2.705
   12   2HG2  ILE   2          HG22      ILE   2  -2.864   1.935  -1.731
   13   3HG2  ILE   2          HG23      ILE   2  -1.756   3.305  -1.829
   14   1HD1  ILE   2          HD11      ILE   2  -3.622   0.804   0.473
   15   2HD1  ILE   2          HD12      ILE   2  -4.977   1.924   0.320
   16   3HD1  ILE   2          HD13      ILE   2  -4.276   1.599   1.903
   17    H    VAL   3           H        VAL   3  -3.873   5.387  -2.798
   18    HA   VAL   3           HA       VAL   3  -1.652   5.321  -4.400
   19    HB   VAL   3           HB       VAL   3  -3.967   7.265  -4.583
   20   1HG1  VAL   3          HG11      VAL   3  -2.888   8.273  -6.284
   21   2HG1  VAL   3          HG12      VAL   3  -2.763   6.723  -7.115
   22   3HG1  VAL   3          HG13      VAL   3  -1.486   7.240  -6.016
   23   1HG2  VAL   3          HG21      VAL   3  -4.960   5.248  -5.012
   24   2HG2  VAL   3          HG22      VAL   3  -3.431   4.464  -5.406
   25   3HG2  VAL   3          HG23      VAL   3  -4.239   5.474  -6.605
   26    H    GLU   4           H        GLU   4  -2.866   8.406  -3.031
   27    HA   GLU   4           HA       GLU   4  -0.431   9.776  -3.681
   28   1HB   GLU   4          HB2       GLU   4  -2.842  10.408  -1.986
   29   2HB   GLU   4          HB1       GLU   4  -1.453  11.483  -2.009
   30   1HG   GLU   4          HG2       GLU   4  -2.680  10.547  -4.589
   31   2HG   GLU   4          HG1       GLU   4  -3.381  11.908  -3.713
   32    H    GLN   5           H        GLN   5  -1.794   8.633  -0.557
   33    HA   GLN   5           HA       GLN   5   0.265   9.399   1.153
   34   1HB   GLN   5          HB2       GLN   5  -1.811   8.118   1.817
   35   2HB   GLN   5          HB1       GLN   5  -1.025   6.655   1.224
   36   1HG   GLN   5          HG2       GLN   5   0.858   7.044   2.785
   37   2HG   GLN   5          HG1       GLN   5   0.038   8.478   3.402
   38   1HE2  GLN   5          HE21      GLN   5  -2.668   7.171   3.198
   39   2HE2  GLN   5          HE22      GLN   5  -2.731   6.065   4.484
   40    H    CYS   6           H        CYS   6   0.263   6.832  -1.245
   41    HA   CYS   6           HA       CYS   6   3.040   6.109  -0.439
   42   1HB   CYS   6          HB2       CYS   6   0.906   4.679  -2.024
   43   2HB   CYS   6          HB1       CYS   6   2.592   4.191  -2.108
   44    H    CYS   7           H        CYS   7   1.266   7.862  -2.781
   45    HA   CYS   7           HA       CYS   7   3.433   7.591  -4.794
   46   1HB   CYS   7          HB2       CYS   7   1.099   7.439  -5.597
   47   2HB   CYS   7          HB1       CYS   7   0.762   9.041  -4.944
   48    H    THR   8           H        THR   8   1.539  10.560  -4.193
   49    HA   THR   8           HA       THR   8   3.601  12.394  -4.561
   50    HB   THR   8           HB       THR   8   2.300  13.593  -2.481
   51    HG1  THR   8           HG1      THR   8   0.623  12.477  -1.958
   52   1HG2  THR   8          HG21      THR   8   2.251  14.674  -4.554
   53   2HG2  THR   8          HG22      THR   8   0.562  14.219  -4.333
   54   3HG2  THR   8          HG23      THR   8   1.602  13.259  -5.385
   55    H    SER   9           H        SER   9   2.740  10.602  -1.672
   56    HA   SER   9           HA       SER   9   5.352  11.337  -0.427
   57   1HB   SER   9          HB2       SER   9   2.690  10.458   0.685
   58   2HB   SER   9          HB1       SER   9   4.162  10.136   1.596
   59    HG   SER   9           HG       SER   9   3.184  12.166   2.107
   60    H    ILE  10           H        ILE  10   6.420   9.332   0.637
   61    HA   ILE  10           HA       ILE  10   5.808   6.973  -1.101
   62    HB   ILE  10           HB       ILE  10   8.420   7.817   0.196
   63   1HG1  ILE  10          HG12      ILE  10   9.235   8.009  -2.072
   64   2HG1  ILE  10          HG11      ILE  10   7.750   7.327  -2.723
   65   1HG2  ILE  10          HG21      ILE  10   7.403   5.227  -0.585
   66   2HG2  ILE  10          HG22      ILE  10   8.937   5.628   0.180
   67   3HG2  ILE  10          HG23      ILE  10   8.788   5.671  -1.577
   68   1HD1  ILE  10          HD11      ILE  10   8.143   9.944  -2.730
   69   2HD1  ILE  10          HD12      ILE  10   7.573   9.818  -1.065
   70   3HD1  ILE  10          HD13      ILE  10   6.544   9.282  -2.394
   71    H    CYS  11           H        CYS  11   5.679   4.879  -0.065
   72    HA   CYS  11           HA       CYS  11   5.570   5.086   2.929
   73   1HB   CYS  11          HB2       CYS  11   3.751   3.366   2.859
   74   2HB   CYS  11          HB1       CYS  11   3.295   4.905   2.132
   75    H    SER  12           H        SER  12   5.258   2.546   3.681
   76    HA   SER  12           HA       SER  12   7.696   1.205   2.599
   77   1HB   SER  12          HB2       SER  12   8.217   0.501   4.748
   78   2HB   SER  12          HB1       SER  12   7.440   2.043   5.097
   79    HG   SER  12           HG       SER  12   5.617   0.994   5.687
   80    H    LEU  13           H        LEU  13   7.560  -1.275   3.175
   81    HA   LEU  13           HA       LEU  13   5.323  -2.326   1.661
   82   1HB   LEU  13          HB2       LEU  13   7.602  -3.611   3.173
   83   2HB   LEU  13          HB1       LEU  13   6.370  -4.557   2.350
   84    HG   LEU  13           HG       LEU  13   8.711  -3.321   1.240
   85   1HD1  LEU  13          HD11      LEU  13   7.743  -5.581   0.788
   86   2HD1  LEU  13          HD12      LEU  13   8.112  -4.674  -0.678
   87   3HD1  LEU  13          HD13      LEU  13   6.444  -4.802  -0.116
   88   1HD2  LEU  13          HD21      LEU  13   6.142  -2.443  -0.125
   89   2HD2  LEU  13          HD22      LEU  13   7.792  -2.076  -0.625
   90   3HD2  LEU  13          HD23      LEU  13   7.145  -1.369   0.845
   91    H    TYR  14           H        TYR  14   5.990  -1.870   5.053
   92    HA   TYR  14           HA       TYR  14   4.143  -3.826   6.054
   93   1HB   TYR  14          HB2       TYR  14   5.825  -2.699   7.494
   94   2HB   TYR  14          HB1       TYR  14   4.958  -1.176   7.291
   95    HD1  TYR  14           HD1      TYR  14   4.317  -4.739   8.288
   96    HD2  TYR  14           HD2      TYR  14   3.332  -0.595   8.866
   97    HE1  TYR  14           HE1      TYR  14   2.786  -5.361  10.141
   98    HE2  TYR  14           HE2      TYR  14   1.801  -1.218  10.718
   99    HH   TYR  14           HH       TYR  14   0.453  -3.726  11.223
  100    H    GLN  15           H        GLN  15   3.799  -0.543   4.836
  101    HA   GLN  15           HA       GLN  15   1.043  -0.302   5.716
  102   1HB   GLN  15          HB2       GLN  15   2.641   1.289   3.691
  103   2HB   GLN  15          HB1       GLN  15   1.047   1.744   4.298
  104   1HG   GLN  15          HG2       GLN  15   2.179   1.423   6.653
  105   2HG   GLN  15          HG1       GLN  15   3.671   1.672   5.745
  106   1HE2  GLN  15          HE21      GLN  15   0.852   3.258   7.049
  107   2HE2  GLN  15          HE22      GLN  15   1.226   4.820   6.502
  108    H    LEU  16           H        LEU  16   2.555  -0.774   2.482
  109    HA   LEU  16           HA       LEU  16   0.053  -1.236   1.162
  110   1HB   LEU  16          HB2       LEU  16   2.901  -2.063   0.581
  111   2HB   LEU  16          HB1       LEU  16   1.590  -2.728  -0.380
  112    HG   LEU  16           HG       LEU  16   2.077  -0.880  -1.672
  113   1HD1  LEU  16          HD11      LEU  16  -0.262  -0.613  -0.729
  114   2HD1  LEU  16          HD12      LEU  16   0.482   0.870  -1.327
  115   3HD1  LEU  16          HD13      LEU  16   0.414   0.553   0.408
  116   1HD2  LEU  16          HD21      LEU  16   3.138   1.110  -0.901
  117   2HD2  LEU  16          HD22      LEU  16   3.900  -0.216  -0.026
  118   3HD2  LEU  16          HD23      LEU  16   2.689   0.787   0.773
  119    H    GLU  17           H        GLU  17   1.785  -3.026   3.502
  120    HA   GLU  17           HA       GLU  17   0.790  -5.676   2.800
  121   1HB   GLU  17          HB2       GLU  17   2.080  -4.471   5.253
  122   2HB   GLU  17          HB1       GLU  17   1.383  -6.086   5.312
  123   1HG   GLU  17          HG2       GLU  17   3.235  -5.452   3.056
  124   2HG   GLU  17          HG1       GLU  17   3.937  -5.703   4.656
  125    H    ASN  18           H        ASN  18  -0.080  -3.133   5.118
  126    HA   ASN  18           HA       ASN  18  -2.368  -4.467   6.206
  127   1HB   ASN  18          HB2       ASN  18  -2.163  -1.475   5.997
  128   2HB   ASN  18          HB1       ASN  18  -2.767  -2.459   7.326
  129   1HD2  ASN  18          HD21      ASN  18  -0.319  -4.290   7.024
  130   2HD2  ASN  18          HD22      ASN  18   0.940  -3.424   7.758
  131    H    TYR  19           H        TYR  19  -1.759  -3.089   3.167
  132    HA   TYR  19           HA       TYR  19  -4.647  -2.615   2.708
  133   1HB   TYR  19          HB2       TYR  19  -2.241  -1.825   1.051
  134   2HB   TYR  19          HB1       TYR  19  -3.920  -1.422   0.675
  135    HD1  TYR  19           HD1      TYR  19  -1.243   0.232   1.656
  136    HD2  TYR  19           HD2      TYR  19  -5.032  -0.882   3.346
  137    HE1  TYR  19           HE1      TYR  19  -1.105   2.150   3.225
  138    HE2  TYR  19           HE2      TYR  19  -4.897   1.034   4.919
  139    HH   TYR  19           HH       TYR  19  -3.803   3.141   5.156
  140    H    CYS  20           H        CYS  20  -2.866  -5.190   2.679
  141    HA   CYS  20           HA       CYS  20  -3.469  -6.162  -0.058
  142   1HB   CYS  20          HB2       CYS  20  -1.723  -7.055   2.208
  143   2HB   CYS  20          HB1       CYS  20  -2.110  -8.161   0.926
  144    H    ASN  21           H        ASN  21  -4.281  -8.567  -0.022
  145    HA   ASN  21           HA       ASN  21  -6.626  -8.653   1.786
  146   1HB   ASN  21          HB2       ASN  21  -6.168  -9.462  -0.875
  147   2HB   ASN  21          HB1       ASN  21  -6.386 -10.951   0.040
  148   1HD2  ASN  21          HD21      ASN  21  -8.452 -11.226   1.202
  149   2HD2  ASN  21          HD22      ASN  21  -9.811 -10.305   0.772
  150   1H    PHE   1           HT1      PHE   1  10.244  -3.145   0.128
  151   2H    PHE   1           HT2      PHE   1  11.544  -2.775   1.158
  152   3H    PHE   1           HT3      PHE   1  11.758  -3.864  -0.127
  153    HA   PHE   1           HA       PHE   1  12.574  -2.119  -1.231
  154   1HB   PHE   1          HB2       PHE   1   9.769  -1.022  -1.287
  155   2HB   PHE   1          HB1       PHE   1  10.955  -1.096  -2.590
  156    HD1  PHE   1           HD1      PHE   1   7.984  -2.154  -2.504
  157    HD2  PHE   1           HD2      PHE   1  11.819  -4.017  -1.985
  158    HE1  PHE   1           HE1      PHE   1   7.036  -4.316  -3.260
  159    HE2  PHE   1           HE2      PHE   1  10.871  -6.180  -2.734
  160    HZ   PHE   1           HZ       PHE   1   8.477  -6.331  -3.371
  161    H    VAL   2           H        VAL   2  13.607  -0.221  -0.771
  162    HA   VAL   2           HA       VAL   2  12.778   1.250   1.666
  163    HB   VAL   2           HB       VAL   2  14.992   2.412   1.324
  164   1HG1  VAL   2          HG11      VAL   2  15.781  -0.409   1.197
  165   2HG1  VAL   2          HG12      VAL   2  14.431  -0.122   2.295
  166   3HG1  VAL   2          HG13      VAL   2  15.951   0.744   2.521
  167   1HG2  VAL   2          HG21      VAL   2  16.443   1.770  -0.428
  168   2HG2  VAL   2          HG22      VAL   2  14.873   1.877  -1.225
  169   3HG2  VAL   2          HG23      VAL   2  15.523   0.304  -0.768
  170    H    ASN   3           H        ASN   3  11.850   3.274   1.581
  171    HA   ASN   3           HA       ASN   3  10.661   5.039   0.528
  172   1HB   ASN   3          HB2       ASN   3  13.527   5.171  -0.246
  173   2HB   ASN   3          HB1       ASN   3  12.423   6.169  -1.191
  174   1HD2  ASN   3          HD21      ASN   3  14.309   7.425   0.504
  175   2HD2  ASN   3          HD22      ASN   3  13.495   8.138   1.813
  176    H    GLN   4           H        GLN   4   9.194   3.606  -0.625
  177    HA   GLN   4           HA       GLN   4   9.922   3.268  -3.496
  178   1HB   GLN   4          HB2       GLN   4   9.431   1.149  -2.513
  179   2HB   GLN   4          HB1       GLN   4   7.992   1.773  -1.712
  180   1HG   GLN   4          HG2       GLN   4   6.715   1.686  -3.620
  181   2HG   GLN   4          HG1       GLN   4   8.079   2.065  -4.672
  182   1HE2  GLN   4          HE21      GLN   4   6.116  -0.499  -3.476
  183   2HE2  GLN   4          HE22      GLN   4   7.035  -1.787  -4.092
  184    H    HIS   5           H        HIS   5   8.857   4.412  -4.969
  185    HA   HIS   5           HA       HIS   5   6.501   6.017  -4.147
  186   1HB   HIS   5          HB2       HIS   5   7.879   6.068  -6.842
  187   2HB   HIS   5          HB1       HIS   5   6.877   7.320  -6.110
  188    HD2  HIS   5           HD2      HIS   5  10.473   5.752  -5.533
  189    HE1  HIS   5           HE1      HIS   5  10.320   9.595  -3.774
  190    HE2  HIS   5           HE2      HIS   5  11.826   7.604  -4.305
  191    H    LEU   6           H        LEU   6   4.473   5.615  -5.082
  192    HA   LEU   6           HA       LEU   6   4.328   3.148  -6.769
  193   1HB   LEU   6          HB2       LEU   6   2.436   4.255  -4.716
  194   2HB   LEU   6          HB1       LEU   6   2.060   2.898  -5.765
  195    HG   LEU   6           HG       LEU   6   2.891   1.864  -3.779
  196   1HD1  LEU   6          HD11      LEU   6   5.512   2.169  -5.224
  197   2HD1  LEU   6          HD12      LEU   6   4.182   1.308  -5.995
  198   3HD1  LEU   6          HD13      LEU   6   4.830   0.735  -4.459
  199   1HD2  LEU   6          HD21      LEU   6   4.111   4.375  -3.407
  200   2HD2  LEU   6          HD22      LEU   6   5.430   3.204  -3.432
  201   3HD2  LEU   6          HD23      LEU   6   4.106   3.019  -2.280
  202    H    CYS   7           H        CYS   7   1.442   4.865  -6.202
  203    HA   CYS   7           HA       CYS   7   0.226   6.368  -7.484
  204   1HB   CYS   7          HB2       CYS   7   2.298   6.337  -9.650
  205   2HB   CYS   7          HB1       CYS   7   1.172   7.621  -9.235
  206    H    GLY   8           H        GLY   8  -1.488   5.414  -8.375
  207   1HA   GLY   8          HA2       GLY   8  -2.714   3.707  -9.492
  208   2HA   GLY   8          HA1       GLY   8  -1.980   4.537 -10.857
  209    H    SER   9           H        SER   9  -1.136   3.124 -12.255
  210    HA   SER   9           HA       SER   9  -0.791   0.427 -12.049
  211   1HB   SER   9          HB2       SER   9   1.248   0.762 -13.641
  212   2HB   SER   9          HB1       SER   9  -0.346   1.288 -14.173
  213    HG   SER   9           HG       SER   9   1.888   2.738 -13.727
  214    H    ASP  10           H        ASP  10   2.044   2.580 -11.590
  215    HA   ASP  10           HA       ASP  10   3.801   0.694 -10.543
  216   1HB   ASP  10          HB2       ASP  10   3.383   3.616  -9.959
  217   2HB   ASP  10          HB1       ASP  10   4.592   2.705  -9.050
  218    H    LEU  11           H        LEU  11   1.072   2.274  -8.952
  219    HA   LEU  11           HA       LEU  11   1.666   1.194  -6.332
  220   1HB   LEU  11          HB2       LEU  11   0.181   3.199  -6.790
  221   2HB   LEU  11          HB1       LEU  11  -1.032   2.067  -7.378
  222    HG   LEU  11           HG       LEU  11  -1.104   0.955  -5.194
  223   1HD1  LEU  11          HD11      LEU  11   0.174   1.751  -3.306
  224   2HD1  LEU  11          HD12      LEU  11   0.835   3.078  -4.254
  225   3HD1  LEU  11          HD13      LEU  11   1.313   1.417  -4.607
  226   1HD2  LEU  11          HD21      LEU  11  -2.655   2.534  -4.839
  227   2HD2  LEU  11          HD22      LEU  11  -1.675   3.766  -5.636
  228   3HD2  LEU  11          HD23      LEU  11  -1.418   3.403  -3.929
  229    H    THR  12           H        THR  12  -0.663   0.304  -8.895
  230    HA   THR  12           HA       THR  12  -1.612  -2.070  -7.647
  231    HB   THR  12           HB       THR  12  -1.191  -1.423 -10.582
  232    HG1  THR  12           HG1      THR  12  -3.020  -0.451 -10.347
  233   1HG2  THR  12          HG21      THR  12  -1.802  -3.520 -11.123
  234   2HG2  THR  12          HG22      THR  12  -3.176  -3.458 -10.020
  235   3HG2  THR  12          HG23      THR  12  -1.591  -3.952  -9.426
  236    H    GLU  13           H        GLU  13   1.071  -1.592  -9.955
  237    HA   GLU  13           HA       GLU  13   2.110  -4.157 -10.094
  238   1HB   GLU  13          HB2       GLU  13   3.188  -1.434 -10.275
  239   2HB   GLU  13          HB1       GLU  13   4.391  -2.624  -9.782
  240   1HG   GLU  13          HG2       GLU  13   3.969  -3.985 -11.716
  241   2HG   GLU  13          HG1       GLU  13   2.543  -3.039 -12.142
  242    H    ALA  14           H        ALA  14   2.931  -1.749  -7.554
  243    HA   ALA  14           HA       ALA  14   4.405  -3.658  -5.969
  244   1HB   ALA  14          HB1       ALA  14   4.976  -1.710  -4.981
  245   2HB   ALA  14          HB2       ALA  14   3.378  -1.680  -4.236
  246   3HB   ALA  14          HB3       ALA  14   3.647  -0.866  -5.778
  247    H    LEU  15           H        LEU  15   1.266  -2.105  -5.290
  248    HA   LEU  15           HA       LEU  15   0.324  -3.696  -3.219
  249   1HB   LEU  15          HB2       LEU  15  -0.821  -2.040  -5.303
  250   2HB   LEU  15          HB1       LEU  15  -1.845  -3.438  -5.045
  251    HG   LEU  15           HG       LEU  15  -1.100  -1.253  -3.112
  252   1HD1  LEU  15          HD11      LEU  15  -3.648  -1.688  -2.666
  253   2HD1  LEU  15          HD12      LEU  15  -3.581  -2.528  -4.215
  254   3HD1  LEU  15          HD13      LEU  15  -3.155  -0.819  -4.120
  255   1HD2  LEU  15          HD21      LEU  15  -2.441  -2.820  -1.458
  256   2HD2  LEU  15          HD22      LEU  15  -0.696  -2.996  -1.627
  257   3HD2  LEU  15          HD23      LEU  15  -1.780  -4.104  -2.470
  258    H    TYR  16           H        TYR  16   0.074  -4.384  -6.697
  259    HA   TYR  16           HA       TYR  16  -1.193  -6.923  -6.503
  260   1HB   TYR  16          HB2       TYR  16  -0.676  -5.354  -8.553
  261   2HB   TYR  16          HB1       TYR  16   0.797  -6.308  -8.666
  262    HD1  TYR  16           HD1      TYR  16  -2.633  -6.111  -9.522
  263    HD2  TYR  16           HD2      TYR  16   0.493  -8.912  -8.614
  264    HE1  TYR  16           HE1      TYR  16  -3.925  -7.907 -10.642
  265    HE2  TYR  16           HE2      TYR  16  -0.797 -10.714  -9.735
  266    HH   TYR  16           HH       TYR  16  -2.856 -10.494 -11.792
  267    H    LEU  17           H        LEU  17   2.211  -5.982  -6.271
  268    HA   LEU  17           HA       LEU  17   3.050  -8.806  -6.253
  269   1HB   LEU  17          HB2       LEU  17   4.372  -6.821  -7.269
  270   2HB   LEU  17          HB1       LEU  17   4.841  -6.474  -5.603
  271    HG   LEU  17           HG       LEU  17   5.228  -9.135  -7.012
  272   1HD1  LEU  17          HD11      LEU  17   7.265  -7.049  -6.186
  273   2HD1  LEU  17          HD12      LEU  17   6.720  -7.324  -7.839
  274   3HD1  LEU  17          HD13      LEU  17   7.609  -8.584  -6.982
  275   1HD2  LEU  17          HD21      LEU  17   5.573  -8.187  -4.207
  276   2HD2  LEU  17          HD22      LEU  17   6.830  -9.244  -4.850
  277   3HD2  LEU  17          HD23      LEU  17   5.155  -9.792  -4.806
  278    H    VAL  18           H        VAL  18   3.144  -6.042  -3.942
  279    HA   VAL  18           HA       VAL  18   4.226  -7.362  -1.744
  280    HB   VAL  18           HB       VAL  18   2.180  -6.008  -0.500
  281   1HG1  VAL  18          HG11      VAL  18   4.786  -5.829  -0.443
  282   2HG1  VAL  18          HG12      VAL  18   3.817  -4.430   0.017
  283   3HG1  VAL  18          HG13      VAL  18   4.542  -4.512  -1.589
  284   1HG2  VAL  18          HG21      VAL  18   1.599  -5.415  -3.038
  285   2HG2  VAL  18          HG22      VAL  18   2.853  -4.202  -2.781
  286   3HG2  VAL  18          HG23      VAL  18   1.422  -4.222  -1.751
  287    H    CYS  19           H        CYS  19   0.857  -7.441  -2.802
  288    HA   CYS  19           HA       CYS  19   0.338  -9.624  -0.845
  289   1HB   CYS  19          HB2       CYS  19  -1.854  -8.964  -2.677
  290   2HB   CYS  19          HB1       CYS  19  -1.839  -9.017  -0.925
  291    H    GLY  20           H        GLY  20  -0.677  -9.096  -4.212
  292   1HA   GLY  20          HA2       GLY  20  -0.638 -10.540  -6.068
  293   2HA   GLY  20          HA1       GLY  20   0.715 -11.368  -5.288
  294    H    GLU  21           H        GLU  21   0.301 -13.439  -4.682
  295    HA   GLU  21           HA       GLU  21  -2.230 -14.682  -4.969
  296   1HB   GLU  21          HB2       GLU  21   0.031 -15.477  -3.104
  297   2HB   GLU  21          HB1       GLU  21  -1.287 -16.526  -3.627
  298   1HG   GLU  21          HG2       GLU  21   0.639 -15.178  -5.537
  299   2HG   GLU  21          HG1       GLU  21   0.847 -16.826  -4.940
  300    H    ARG  22           H        ARG  22  -0.978 -12.636  -2.504
  301    HA   ARG  22           HA       ARG  22  -2.905 -13.504  -0.471
  302   1HB   ARG  22          HB2       ARG  22  -0.874 -11.270  -0.581
  303   2HB   ARG  22          HB1       ARG  22  -1.980 -11.492   0.777
  304   1HG   ARG  22          HG2       ARG  22   0.104 -13.451  -0.221
  305   2HG   ARG  22          HG1       ARG  22   0.079 -12.618   1.333
  306   1HD   ARG  22          HD2       ARG  22  -0.853 -14.610   2.007
  307   2HD   ARG  22          HD1       ARG  22  -2.326 -13.800   1.471
  308    HE   ARG  22           HE       ARG  22  -1.111 -15.191  -0.733
  309   1HH1  ARG  22          HH21      ARG  22  -4.046 -15.174   0.107
  310   2HH1  ARG  22          HH22      ARG  22  -4.284 -16.841   0.512
  311   1HH2  ARG  22          HH11      ARG  22  -0.896 -17.552   0.699
  312   2HH2  ARG  22          HH12      ARG  22  -2.500 -18.186   0.849
  313    H    GLY  23           H        GLY  23  -3.419 -12.023  -3.244
  314   1HA   GLY  23          HA2       GLY  23  -5.072 -10.548  -4.017
  315   2HA   GLY  23          HA1       GLY  23  -5.883 -10.823  -2.472
  316    H    PHE  24           H        PHE  24  -5.552  -8.286  -3.946
  317    HA   PHE  24           HA       PHE  24  -4.228  -6.776  -1.729
  318   1HB   PHE  24          HB2       PHE  24  -3.192  -5.279  -3.294
  319   2HB   PHE  24          HB1       PHE  24  -2.728  -6.914  -3.714
  320    HD1  PHE  24           HD1      PHE  24  -2.194  -5.116  -5.726
  321    HD2  PHE  24           HD2      PHE  24  -6.022  -6.829  -4.801
  322    HE1  PHE  24           HE1      PHE  24  -2.919  -4.747  -8.059
  323    HE2  PHE  24           HE2      PHE  24  -6.745  -6.461  -7.136
  324    HZ   PHE  24           HZ       PHE  24  -5.189  -5.421  -8.768
  325    H    PHE  25           H        PHE  25  -4.834  -4.191  -2.396
  326    HA   PHE  25           HA       PHE  25  -7.803  -4.323  -2.698
  327   1HB   PHE  25          HB2       PHE  25  -6.051  -2.999  -0.750
  328   2HB   PHE  25          HB1       PHE  25  -7.387  -2.016  -1.347
  329    HD1  PHE  25           HD1      PHE  25  -6.764  -5.566  -0.373
  330    HD2  PHE  25           HD2      PHE  25  -9.407  -2.190  -0.200
  331    HE1  PHE  25           HE1      PHE  25  -8.301  -6.859   1.049
  332    HE2  PHE  25           HE2      PHE  25 -10.953  -3.475   1.229
  333    HZ   PHE  25           HZ       PHE  25 -10.416  -5.821   1.862
  334    H    TYR  26           H        TYR  26  -5.912  -1.368  -2.479
  335    HA   TYR  26           HA       TYR  26  -5.469   0.287  -4.151
  336   1HB   TYR  26          HB2       TYR  26  -5.536  -1.665  -5.852
  337   2HB   TYR  26          HB1       TYR  26  -7.242  -1.288  -6.032
  338    HD1  TYR  26           HD1      TYR  26  -6.032  -1.089  -8.466
  339    HD2  TYR  26           HD2      TYR  26  -5.777   1.759  -5.256
  340    HE1  TYR  26           HE1      TYR  26  -5.491   0.696 -10.098
  341    HE2  TYR  26           HE2      TYR  26  -5.233   3.545  -6.891
  342    HH   TYR  26           HH       TYR  26  -5.836   3.479  -9.954
  343    H    THR  27           H        THR  27  -6.990   0.899  -2.260
  344    HA   THR  27           HA       THR  27  -9.807   1.218  -2.899
  345    HB   THR  27           HB       THR  27  -9.064   2.964  -0.786
  346    HG1  THR  27           HG1      THR  27  -7.833   0.416  -0.623
  347   1HG2  THR  27          HG21      THR  27 -10.971   1.915  -0.197
  348   2HG2  THR  27          HG22      THR  27  -9.945   0.591   0.358
  349   3HG2  THR  27          HG23      THR  27 -10.637   0.552  -1.265
  350    H    LYS  28           H        LYS  28  -9.968   2.503  -4.749
  351    HA   LYS  28           HA       LYS  28  -8.878   5.281  -4.542
  352   1HB   LYS  28          HB2       LYS  28  -9.146   5.364  -7.005
  353   2HB   LYS  28          HB1       LYS  28  -8.095   4.030  -6.524
  354   1HG   LYS  28          HG2       LYS  28  -9.466   2.592  -7.579
  355   2HG   LYS  28          HG1       LYS  28 -10.768   3.052  -6.482
  356   1HD   LYS  28          HD2       LYS  28 -11.824   3.900  -8.288
  357   2HD   LYS  28          HD1       LYS  28 -10.618   5.188  -8.261
  358   1HE   LYS  28          HE2       LYS  28  -9.149   3.839  -9.720
  359   2HE   LYS  28          HE1       LYS  28 -10.366   2.562  -9.760
  360   1HZ   LYS  28          HZ1       LYS  28 -10.876   3.729 -11.645
  361   2HZ   LYS  28          HZ2       LYS  28 -10.421   5.229 -10.988
  362   3HZ   LYS  28          HZ3       LYS  28 -11.890   4.508 -10.529
  363    HA   PRO  29           HA       PRO  29 -13.364   5.754  -3.915
  364   1HB   PRO  29          HB2       PRO  29 -13.091   7.929  -2.256
  365   2HB   PRO  29          HB1       PRO  29 -13.010   6.249  -1.696
  366   1HG   PRO  29          HG2       PRO  29 -10.791   8.207  -2.089
  367   2HG   PRO  29          HG1       PRO  29 -10.895   6.838  -0.968
  368   1HD   PRO  29          HD2       PRO  29  -9.462   6.856  -3.397
  369   2HD   PRO  29          HD1       PRO  29  -9.904   5.411  -2.462
  370    H    THR  30           H        THR  30 -14.717   7.861  -4.172
  371    HA   THR  30           HA       THR  30 -13.429   9.952  -5.802
  372    HB   THR  30           HB       THR  30 -14.025   8.143  -7.423
  373    HG1  THR  30           HG1      THR  30 -14.103  10.288  -8.104
  374   1HG2  THR  30          HG21      THR  30 -16.516   7.851  -7.833
  375   2HG2  THR  30          HG22      THR  30 -16.778   8.652  -6.283
  376   3HG2  THR  30          HG23      THR  30 -15.906   7.121  -6.347
  Start of MODEL    5
    1   1H    GLY   1           HT1      GLY   1  -8.570   6.095  -0.678
    2   2H    GLY   1           HT2      GLY   1  -8.472   5.717  -2.330
    3   3H    GLY   1           HT3      GLY   1  -9.462   6.994  -1.808
    4   1HA   GLY   1          HA1       GLY   1  -6.846   7.230  -2.564
    5   2HA   GLY   1          HA2       GLY   1  -7.852   8.532  -1.860
    6    H    ILE   2           H        ILE   2  -5.953   5.379  -1.742
    7    HA   ILE   2           HA       ILE   2  -4.168   6.500   0.366
    8    HB   ILE   2           HB       ILE   2  -4.956   4.436   1.135
    9   1HG1  ILE   2          HG12      ILE   2  -2.355   4.636   0.814
   10   2HG1  ILE   2          HG11      ILE   2  -3.054   3.093   1.296
   11   1HG2  ILE   2          HG21      ILE   2  -4.867   3.663  -1.763
   12   2HG2  ILE   2          HG22      ILE   2  -6.208   3.563  -0.624
   13   3HG2  ILE   2          HG23      ILE   2  -4.881   2.407  -0.525
   14   1HD1  ILE   2          HD11      ILE   2  -2.515   2.094  -0.673
   15   2HD1  ILE   2          HD12      ILE   2  -1.360   3.417  -0.827
   16   3HD1  ILE   2          HD13      ILE   2  -2.931   3.520  -1.621
   17    H    VAL   3           H        VAL   3  -4.319   5.959  -2.965
   18    HA   VAL   3           HA       VAL   3  -1.750   5.055  -3.660
   19    HB   VAL   3           HB       VAL   3  -3.486   7.151  -4.992
   20   1HG1  VAL   3          HG11      VAL   3  -1.004   7.274  -5.562
   21   2HG1  VAL   3          HG12      VAL   3  -2.078   6.966  -6.927
   22   3HG1  VAL   3          HG13      VAL   3  -1.162   5.641  -6.208
   23   1HG2  VAL   3          HG21      VAL   3  -4.688   5.296  -5.471
   24   2HG2  VAL   3          HG22      VAL   3  -3.408   4.226  -4.900
   25   3HG2  VAL   3          HG23      VAL   3  -3.358   4.857  -6.546
   26    H    GLU   4           H        GLU   4  -2.636   8.507  -3.727
   27    HA   GLU   4           HA       GLU   4  -0.098   9.573  -3.790
   28   1HB   GLU   4          HB2       GLU   4  -1.064  11.595  -3.013
   29   2HB   GLU   4          HB1       GLU   4  -2.387  10.754  -3.807
   30   1HG   GLU   4          HG2       GLU   4  -3.156   9.895  -1.625
   31   2HG   GLU   4          HG1       GLU   4  -1.832  10.744  -0.824
   32    H    GLN   5           H        GLN   5  -1.660   7.987  -1.105
   33    HA   GLN   5           HA       GLN   5  -0.093   9.033   1.035
   34   1HB   GLN   5          HB2       GLN   5  -2.149   7.512   1.193
   35   2HB   GLN   5          HB1       GLN   5  -1.052   6.169   0.863
   36   1HG   GLN   5          HG2       GLN   5  -0.646   6.126   3.087
   37   2HG   GLN   5          HG1       GLN   5   0.262   7.620   2.843
   38   1HE2  GLN   5          HE21      GLN   5  -0.559   8.035   5.173
   39   2HE2  GLN   5          HE22      GLN   5  -2.087   8.754   5.338
   40    H    CYS   6           H        CYS   6   0.540   6.400  -1.269
   41    HA   CYS   6           HA       CYS   6   3.203   6.021  -0.003
   42   1HB   CYS   6          HB2       CYS   6   1.576   4.344  -1.899
   43   2HB   CYS   6          HB1       CYS   6   3.306   4.076  -1.693
   44    H    CYS   7           H        CYS   7   1.702   7.564  -2.659
   45    HA   CYS   7           HA       CYS   7   4.197   7.539  -4.256
   46   1HB   CYS   7          HB2       CYS   7   1.994   7.302  -5.412
   47   2HB   CYS   7          HB1       CYS   7   1.541   8.901  -4.847
   48    H    THR   8           H        THR   8   1.987  10.313  -3.657
   49    HA   THR   8           HA       THR   8   3.931  12.324  -3.697
   50    HB   THR   8           HB       THR   8   2.257  13.040  -1.543
   51    HG1  THR   8           HG1      THR   8   0.397  12.109  -1.887
   52   1HG2  THR   8          HG21      THR   8   2.856  14.510  -3.384
   53   2HG2  THR   8          HG22      THR   8   1.099  14.388  -3.300
   54   3HG2  THR   8          HG23      THR   8   1.988  13.487  -4.528
   55    H    SER   9           H        SER   9   2.722  10.694  -0.775
   56    HA   SER   9           HA       SER   9   5.285  11.301   0.599
   57   1HB   SER   9          HB2       SER   9   2.715  11.329   1.556
   58   2HB   SER   9          HB1       SER   9   3.204   9.690   1.977
   59    HG   SER   9           HG       SER   9   4.888  11.894   2.486
   60    H    ILE  10           H        ILE  10   6.711   9.524   1.100
   61    HA   ILE  10           HA       ILE  10   6.095   7.101  -0.487
   62    HB   ILE  10           HB       ILE  10   8.611   8.101   0.865
   63   1HG1  ILE  10          HG12      ILE  10   9.501   7.984  -1.418
   64   2HG1  ILE  10          HG11      ILE  10   7.986   7.302  -1.998
   65   1HG2  ILE  10          HG21      ILE  10   8.015   5.395  -0.358
   66   2HG2  ILE  10          HG22      ILE  10   8.571   5.723   1.281
   67   3HG2  ILE  10          HG23      ILE  10   9.650   5.996  -0.088
   68   1HD1  ILE  10          HD11      ILE  10   6.916   9.328  -1.981
   69   2HD1  ILE  10          HD12      ILE  10   8.562   9.942  -2.130
   70   3HD1  ILE  10          HD13      ILE  10   7.780   9.888  -0.550
   71    H    CYS  11           H        CYS  11   6.109   4.978   0.440
   72    HA   CYS  11           HA       CYS  11   5.890   4.935   3.423
   73   1HB   CYS  11          HB2       CYS  11   3.956   3.473   3.298
   74   2HB   CYS  11          HB1       CYS  11   3.617   4.923   2.356
   75    H    SER  12           H        SER  12   5.367   2.194   3.673
   76    HA   SER  12           HA       SER  12   7.683   0.906   2.300
   77   1HB   SER  12          HB2       SER  12   8.068  -0.285   4.546
   78   2HB   SER  12          HB1       SER  12   8.571   1.401   4.446
   79    HG   SER  12           HG       SER  12   7.037   0.442   6.234
   80    H    LEU  13           H        LEU  13   7.545  -1.563   2.611
   81    HA   LEU  13           HA       LEU  13   5.090  -2.530   1.606
   82   1HB   LEU  13          HB2       LEU  13   6.934  -4.238   3.279
   83   2HB   LEU  13          HB1       LEU  13   5.960  -4.715   1.889
   84    HG   LEU  13           HG       LEU  13   8.464  -3.017   1.903
   85   1HD1  LEU  13          HD11      LEU  13   9.297  -5.096   1.523
   86   2HD1  LEU  13          HD12      LEU  13   8.638  -4.889  -0.100
   87   3HD1  LEU  13          HD13      LEU  13   7.711  -5.757   1.124
   88   1HD2  LEU  13          HD21      LEU  13   6.167  -3.012   0.057
   89   2HD2  LEU  13          HD22      LEU  13   7.719  -3.280  -0.737
   90   3HD2  LEU  13          HD23      LEU  13   7.464  -1.831   0.236
   91    H    TYR  14           H        TYR  14   6.155  -2.048   4.920
   92    HA   TYR  14           HA       TYR  14   4.277  -3.618   6.301
   93   1HB   TYR  14          HB2       TYR  14   6.175  -2.088   7.212
   94   2HB   TYR  14          HB1       TYR  14   4.972  -0.803   7.161
   95    HD1  TYR  14           HD1      TYR  14   4.441  -4.416   7.980
   96    HD2  TYR  14           HD2      TYR  14   4.550  -0.376   9.450
   97    HE1  TYR  14           HE1      TYR  14   3.542  -5.182  10.170
   98    HE2  TYR  14           HE2      TYR  14   3.650  -1.146  11.635
   99    HH   TYR  14           HH       TYR  14   3.785  -3.824  12.829
  100    H    GLN  15           H        GLN  15   3.942  -0.267   5.131
  101    HA   GLN  15           HA       GLN  15   1.152  -0.053   5.868
  102   1HB   GLN  15          HB2       GLN  15   2.568   1.549   3.728
  103   2HB   GLN  15          HB1       GLN  15   1.218   2.055   4.746
  104   1HG   GLN  15          HG2       GLN  15   2.793   1.671   6.740
  105   2HG   GLN  15          HG1       GLN  15   4.095   1.607   5.551
  106   1HE2  GLN  15          HE21      GLN  15   1.311   3.730   6.450
  107   2HE2  GLN  15          HE22      GLN  15   2.117   5.182   6.092
  108    H    LEU  16           H        LEU  16   2.693  -0.289   2.620
  109    HA   LEU  16           HA       LEU  16   0.375  -0.692   1.111
  110   1HB   LEU  16          HB2       LEU  16   3.183  -1.166   0.740
  111   2HB   LEU  16          HB1       LEU  16   2.297  -2.574   0.156
  112    HG   LEU  16           HG       LEU  16   2.583  -0.841  -1.612
  113   1HD1  LEU  16          HD11      LEU  16   0.700  -2.266  -1.896
  114   2HD1  LEU  16          HD12      LEU  16   0.068  -0.633  -2.108
  115   3HD1  LEU  16          HD13      LEU  16  -0.187  -1.486  -0.586
  116   1HD2  LEU  16          HD21      LEU  16   2.060   1.340  -1.268
  117   2HD2  LEU  16          HD22      LEU  16   2.053   0.931   0.448
  118   3HD2  LEU  16          HD23      LEU  16   0.544   0.933  -0.465
  119    H    GLU  17           H        GLU  17   1.865  -2.812   3.435
  120    HA   GLU  17           HA       GLU  17   0.546  -5.247   2.589
  121   1HB   GLU  17          HB2       GLU  17   2.381  -5.687   3.963
  122   2HB   GLU  17          HB1       GLU  17   2.037  -4.327   5.029
  123   1HG   GLU  17          HG2       GLU  17   0.539  -5.522   6.298
  124   2HG   GLU  17          HG1       GLU  17   0.000  -6.498   4.931
  125    H    ASN  18           H        ASN  18  -0.229  -2.603   4.798
  126    HA   ASN  18           HA       ASN  18  -2.533  -3.808   5.992
  127   1HB   ASN  18          HB2       ASN  18  -2.202  -0.846   5.523
  128   2HB   ASN  18          HB1       ASN  18  -2.921  -1.671   6.902
  129   1HD2  ASN  18          HD21      ASN  18  -0.557  -3.668   6.803
  130   2HD2  ASN  18          HD22      ASN  18   0.714  -2.825   7.545
  131    H    TYR  19           H        TYR  19  -1.914  -2.645   2.855
  132    HA   TYR  19           HA       TYR  19  -4.815  -2.257   2.299
  133   1HB   TYR  19          HB2       TYR  19  -2.524  -1.642   0.430
  134   2HB   TYR  19          HB1       TYR  19  -4.162  -0.979   0.407
  135    HD1  TYR  19           HD1      TYR  19  -1.230   0.363   0.729
  136    HD2  TYR  19           HD2      TYR  19  -4.511  -0.520   3.360
  137    HE1  TYR  19           HE1      TYR  19  -0.505   2.186   2.249
  138    HE2  TYR  19           HE2      TYR  19  -3.785   1.300   4.881
  139    HH   TYR  19           HH       TYR  19  -2.471   3.396   4.736
  140    H    CYS  20           H        CYS  20  -2.336  -4.535   2.060
  141    HA   CYS  20           HA       CYS  20  -3.014  -5.792  -0.442
  142   1HB   CYS  20          HB2       CYS  20  -1.553  -6.638   2.054
  143   2HB   CYS  20          HB1       CYS  20  -1.815  -7.763   0.746
  144    H    ASN  21           H        ASN  21  -3.516  -8.489   0.313
  145    HA   ASN  21           HA       ASN  21  -6.290  -8.623   0.506
  146   1HB   ASN  21          HB2       ASN  21  -5.149 -10.657   0.031
  147   2HB   ASN  21          HB1       ASN  21  -4.173 -10.545   1.495
  148   1HD2  ASN  21          HD21      ASN  21  -7.157 -11.743   0.190
  149   2HD2  ASN  21          HD22      ASN  21  -7.812 -12.312   1.650
  150   1H    PHE   1           HT1      PHE   1  10.832  -4.398   0.197
  151   2H    PHE   1           HT2      PHE   1   9.824  -3.063   0.499
  152   3H    PHE   1           HT3      PHE   1  11.036  -3.485   1.612
  153    HA   PHE   1           HA       PHE   1  12.651  -3.102  -0.327
  154   1HB   PHE   1          HB2       PHE   1  10.423  -1.264  -1.201
  155   2HB   PHE   1          HB1       PHE   1  11.893  -1.701  -2.073
  156    HD1  PHE   1           HD1      PHE   1   8.651  -2.015  -2.559
  157    HD2  PHE   1           HD2      PHE   1  11.962  -4.630  -1.742
  158    HE1  PHE   1           HE1      PHE   1   7.445  -3.887  -3.655
  159    HE2  PHE   1           HE2      PHE   1  10.757  -6.501  -2.837
  160    HZ   PHE   1           HZ       PHE   1   8.498  -6.130  -3.795
  161    H    VAL   2           H        VAL   2  13.005  -0.421  -0.715
  162    HA   VAL   2           HA       VAL   2  12.566   0.809   1.974
  163    HB   VAL   2           HB       VAL   2  14.879   1.820   1.704
  164   1HG1  VAL   2          HG11      VAL   2  15.990  -0.566   2.081
  165   2HG1  VAL   2          HG12      VAL   2  14.306  -1.087   2.131
  166   3HG1  VAL   2          HG13      VAL   2  14.891   0.120   3.276
  167   1HG2  VAL   2          HG21      VAL   2  16.170   1.341  -0.103
  168   2HG2  VAL   2          HG22      VAL   2  14.669   0.809  -0.861
  169   3HG2  VAL   2          HG23      VAL   2  15.723  -0.364  -0.075
  170    H    ASN   3           H        ASN   3  11.831   2.906   1.856
  171    HA   ASN   3           HA       ASN   3  10.880   4.787   0.789
  172   1HB   ASN   3          HB2       ASN   3  13.670   4.763   0.464
  173   2HB   ASN   3          HB1       ASN   3  13.032   5.165  -1.131
  174   1HD2  ASN   3          HD21      ASN   3  14.129   7.355  -0.443
  175   2HD2  ASN   3          HD22      ASN   3  13.141   8.454   0.392
  176    H    GLN   4           H        GLN   4   9.156   3.734  -0.330
  177    HA   GLN   4           HA       GLN   4   9.754   3.149  -3.202
  178   1HB   GLN   4          HB2       GLN   4   8.875   1.318  -1.415
  179   2HB   GLN   4          HB1       GLN   4   7.325   1.970  -1.947
  180   1HG   GLN   4          HG2       GLN   4   7.797   0.168  -3.438
  181   2HG   GLN   4          HG1       GLN   4   8.182   1.634  -4.341
  182   1HE2  GLN   4          HE21      GLN   4   9.483  -0.517  -5.321
  183   2HE2  GLN   4          HE22      GLN   4  11.104  -0.563  -4.822
  184    H    HIS   5           H        HIS   5   8.697   4.393  -4.645
  185    HA   HIS   5           HA       HIS   5   6.441   6.087  -3.671
  186   1HB   HIS   5          HB2       HIS   5   7.802   6.493  -6.319
  187   2HB   HIS   5          HB1       HIS   5   7.054   7.692  -5.265
  188    HD2  HIS   5           HD2      HIS   5  10.364   5.496  -5.292
  189    HE1  HIS   5           HE1      HIS   5  10.969   8.915  -2.880
  190    HE2  HIS   5           HE2      HIS   5  12.080   6.846  -3.877
  191    H    LEU   6           H        LEU   6   4.588   4.897  -4.047
  192    HA   LEU   6           HA       LEU   6   4.319   3.627  -6.740
  193   1HB   LEU   6          HB2       LEU   6   3.191   2.925  -4.056
  194   2HB   LEU   6          HB1       LEU   6   2.445   2.370  -5.548
  195    HG   LEU   6           HG       LEU   6   4.227   0.979  -6.084
  196   1HD1  LEU   6          HD11      LEU   6   5.994   2.614  -6.170
  197   2HD1  LEU   6          HD12      LEU   6   6.535   1.328  -5.094
  198   3HD1  LEU   6          HD13      LEU   6   5.943   2.846  -4.422
  199   1HD2  LEU   6          HD21      LEU   6   3.450  -0.037  -4.117
  200   2HD2  LEU   6          HD22      LEU   6   4.073   1.256  -3.091
  201   3HD2  LEU   6          HD23      LEU   6   5.184   0.097  -3.825
  202    H    CYS   7           H        CYS   7   2.894   4.538  -8.085
  203    HA   CYS   7           HA       CYS   7   0.539   5.870  -6.879
  204   1HB   CYS   7          HB2       CYS   7   1.428   7.196  -9.324
  205   2HB   CYS   7          HB1       CYS   7   0.952   7.904  -7.789
  206    H    GLY   8           H        GLY   8  -1.354   5.682  -8.150
  207   1HA   GLY   8          HA2       GLY   8  -2.765   4.473  -9.602
  208   2HA   GLY   8          HA1       GLY   8  -1.641   5.053 -10.830
  209    H    SER   9           H        SER   9  -1.576   3.191 -12.091
  210    HA   SER   9           HA       SER   9  -1.571   0.531 -11.393
  211   1HB   SER   9          HB2       SER   9   0.473   0.668 -13.300
  212   2HB   SER   9          HB1       SER   9  -1.247   0.455 -13.613
  213    HG   SER   9           HG       SER   9  -0.668   2.267 -14.705
  214    H    ASP  10           H        ASP  10   1.404   2.550 -11.516
  215    HA   ASP  10           HA       ASP  10   3.303   0.712 -10.685
  216   1HB   ASP  10          HB2       ASP  10   2.928   3.579  -9.767
  217   2HB   ASP  10          HB1       ASP  10   4.359   2.623  -9.382
  218    H    LEU  11           H        LEU  11   0.670   2.065  -8.843
  219    HA   LEU  11           HA       LEU  11   1.602   1.009  -6.283
  220   1HB   LEU  11          HB2       LEU  11   0.097   3.042  -6.593
  221   2HB   LEU  11          HB1       LEU  11  -1.187   1.918  -7.025
  222    HG   LEU  11           HG       LEU  11  -1.058   0.853  -4.838
  223   1HD1  LEU  11          HD11      LEU  11   1.169   2.834  -4.286
  224   2HD1  LEU  11          HD12      LEU  11   1.373   1.090  -4.460
  225   3HD1  LEU  11          HD13      LEU  11   0.456   1.742  -3.103
  226   1HD2  LEU  11          HD21      LEU  11  -1.110   3.301  -3.553
  227   2HD2  LEU  11          HD22      LEU  11  -2.482   2.525  -4.344
  228   3HD2  LEU  11          HD23      LEU  11  -1.509   3.707  -5.221
  229    H    THR  12           H        THR  12  -0.878   0.139  -8.702
  230    HA   THR  12           HA       THR  12  -1.759  -2.235  -7.343
  231    HB   THR  12           HB       THR  12  -1.704  -1.639 -10.319
  232    HG1  THR  12           HG1      THR  12  -4.107  -1.442  -9.441
  233   1HG2  THR  12          HG21      THR  12  -3.495  -3.566  -8.831
  234   2HG2  THR  12          HG22      THR  12  -1.973  -4.066  -9.568
  235   3HG2  THR  12          HG23      THR  12  -3.269  -3.421 -10.574
  236    H    GLU  13           H        GLU  13   0.678  -1.643  -9.875
  237    HA   GLU  13           HA       GLU  13   1.607  -4.259 -10.269
  238   1HB   GLU  13          HB2       GLU  13   2.609  -1.576 -10.688
  239   2HB   GLU  13          HB1       GLU  13   3.913  -2.626 -10.140
  240   1HG   GLU  13          HG2       GLU  13   3.028  -4.311 -11.894
  241   2HG   GLU  13          HG1       GLU  13   2.150  -2.938 -12.569
  242    H    ALA  14           H        ALA  14   2.978  -1.902  -7.941
  243    HA   ALA  14           HA       ALA  14   4.563  -3.780  -6.511
  244   1HB   ALA  14          HB1       ALA  14   4.479  -2.124  -4.652
  245   2HB   ALA  14          HB2       ALA  14   3.202  -1.257  -5.505
  246   3HB   ALA  14          HB3       ALA  14   4.820  -1.351  -6.200
  247    H    LEU  15           H        LEU  15   1.327  -2.479  -5.687
  248    HA   LEU  15           HA       LEU  15   0.682  -4.052  -3.483
  249   1HB   LEU  15          HB2       LEU  15  -0.850  -2.849  -5.719
  250   2HB   LEU  15          HB1       LEU  15  -1.662  -4.174  -4.891
  251    HG   LEU  15           HG       LEU  15  -0.509  -1.715  -3.540
  252   1HD1  LEU  15          HD11      LEU  15  -3.414  -2.501  -3.842
  253   2HD1  LEU  15          HD12      LEU  15  -2.600  -1.479  -5.024
  254   3HD1  LEU  15          HD13      LEU  15  -2.756  -0.941  -3.352
  255   1HD2  LEU  15          HD21      LEU  15  -0.476  -3.704  -2.090
  256   2HD2  LEU  15          HD22      LEU  15  -2.159  -4.042  -2.493
  257   3HD2  LEU  15          HD23      LEU  15  -1.748  -2.600  -1.566
  258    H    TYR  16           H        TYR  16   0.006  -4.876  -6.864
  259    HA   TYR  16           HA       TYR  16  -0.916  -7.463  -6.661
  260   1HB   TYR  16          HB2       TYR  16  -0.104  -5.873  -8.710
  261   2HB   TYR  16          HB1       TYR  16   1.182  -7.077  -8.716
  262    HD1  TYR  16           HD1      TYR  16  -1.904  -6.329 -10.087
  263    HD2  TYR  16           HD2      TYR  16   0.199  -9.581  -8.234
  264    HE1  TYR  16           HE1      TYR  16  -3.435  -7.936 -11.183
  265    HE2  TYR  16           HE2      TYR  16  -1.330 -11.194  -9.327
  266    HH   TYR  16           HH       TYR  16  -3.328 -10.400 -11.880
  267    H    LEU  17           H        LEU  17   2.449  -6.390  -6.376
  268    HA   LEU  17           HA       LEU  17   3.373  -9.168  -6.129
  269   1HB   LEU  17          HB2       LEU  17   4.578  -6.999  -7.150
  270   2HB   LEU  17          HB1       LEU  17   5.172  -6.881  -5.491
  271    HG   LEU  17           HG       LEU  17   5.404  -9.307  -7.299
  272   1HD1  LEU  17          HD11      LEU  17   7.764  -7.929  -6.124
  273   2HD1  LEU  17          HD12      LEU  17   6.927  -7.087  -7.428
  274   3HD1  LEU  17          HD13      LEU  17   7.581  -8.703  -7.698
  275   1HD2  LEU  17          HD21      LEU  17   5.160 -10.114  -5.068
  276   2HD2  LEU  17          HD22      LEU  17   6.151  -8.812  -4.409
  277   3HD2  LEU  17          HD23      LEU  17   6.898 -10.091  -5.365
  278    H    VAL  18           H        VAL  18   3.682  -6.249  -4.037
  279    HA   VAL  18           HA       VAL  18   4.649  -7.411  -1.729
  280    HB   VAL  18           HB       VAL  18   2.696  -5.851  -0.610
  281   1HG1  VAL  18          HG11      VAL  18   4.411  -3.995  -0.848
  282   2HG1  VAL  18          HG12      VAL  18   5.348  -5.116  -1.836
  283   3HG1  VAL  18          HG13      VAL  18   4.997  -5.505  -0.152
  284   1HG2  VAL  18          HG21      VAL  18   2.058  -5.514  -3.184
  285   2HG2  VAL  18          HG22      VAL  18   3.349  -4.316  -3.087
  286   3HG2  VAL  18          HG23      VAL  18   1.947  -4.190  -2.025
  287    H    CYS  19           H        CYS  19   1.417  -7.654  -3.001
  288    HA   CYS  19           HA       CYS  19   0.692  -9.428  -0.723
  289   1HB   CYS  19          HB2       CYS  19  -1.423  -8.695  -2.643
  290   2HB   CYS  19          HB1       CYS  19  -1.442  -8.650  -0.890
  291    H    GLY  20           H        GLY  20  -0.268  -9.228  -4.152
  292   1HA   GLY  20          HA2       GLY  20  -0.605 -10.973  -5.706
  293   2HA   GLY  20          HA1       GLY  20   0.924 -11.596  -5.076
  294    H    GLU  21           H        GLU  21   0.881 -13.342  -3.647
  295    HA   GLU  21           HA       GLU  21  -1.397 -15.027  -3.574
  296   1HB   GLU  21          HB2       GLU  21   0.730 -14.868  -1.413
  297   2HB   GLU  21          HB1       GLU  21  -0.251 -16.271  -1.843
  298   1HG   GLU  21          HG2       GLU  21   0.795 -16.249  -4.114
  299   2HG   GLU  21          HG1       GLU  21   1.844 -14.935  -3.582
  300    H    ARG  22           H        ARG  22  -0.502 -12.241  -1.729
  301    HA   ARG  22           HA       ARG  22  -2.694 -12.673   0.214
  302   1HB   ARG  22          HB2       ARG  22  -0.887 -10.261   0.071
  303   2HB   ARG  22          HB1       ARG  22  -1.767 -10.879   1.465
  304   1HG   ARG  22          HG2       ARG  22   0.434 -12.433   0.086
  305   2HG   ARG  22          HG1       ARG  22   0.720 -11.379   1.472
  306   1HD   ARG  22          HD2       ARG  22   0.157 -13.102   2.809
  307   2HD   ARG  22          HD1       ARG  22  -1.488 -12.967   2.187
  308    HE   ARG  22           HE       ARG  22  -0.242 -14.472   0.256
  309   1HH1  ARG  22          HH21      ARG  22   1.130 -14.845   3.205
  310   2HH1  ARG  22          HH22      ARG  22   0.584 -16.464   3.494
  311   1HH2  ARG  22          HH11      ARG  22  -1.628 -16.476   0.826
  312   2HH2  ARG  22          HH12      ARG  22  -0.977 -17.387   2.147
  313    H    GLY  23           H        GLY  23  -3.371 -12.367  -2.508
  314   1HA   GLY  23          HA2       GLY  23  -4.151 -10.534  -4.030
  315   2HA   GLY  23          HA1       GLY  23  -5.504 -11.169  -3.106
  316    H    PHE  24           H        PHE  24  -3.891  -8.355  -3.953
  317    HA   PHE  24           HA       PHE  24  -4.328  -6.826  -1.515
  318   1HB   PHE  24          HB2       PHE  24  -3.890  -4.865  -3.008
  319   2HB   PHE  24          HB1       PHE  24  -2.647  -6.096  -3.106
  320    HD1  PHE  24           HD1      PHE  24  -5.607  -4.692  -4.835
  321    HD2  PHE  24           HD2      PHE  24  -2.228  -7.320  -5.118
  322    HE1  PHE  24           HE1      PHE  24  -5.953  -4.857  -7.279
  323    HE2  PHE  24           HE2      PHE  24  -2.570  -7.492  -7.567
  324    HZ   PHE  24           HZ       PHE  24  -4.435  -6.262  -8.650
  325    H    PHE  25           H        PHE  25  -5.820  -4.700  -1.850
  326    HA   PHE  25           HA       PHE  25  -8.293  -5.458  -3.308
  327   1HB   PHE  25          HB2       PHE  25  -9.642  -5.624  -1.478
  328   2HB   PHE  25          HB1       PHE  25  -8.138  -6.020  -0.659
  329    HD1  PHE  25           HD1      PHE  25 -10.984  -4.239  -0.188
  330    HD2  PHE  25           HD2      PHE  25  -6.738  -3.588  -0.235
  331    HE1  PHE  25           HE1      PHE  25 -11.275  -2.250   1.267
  332    HE2  PHE  25           HE2      PHE  25  -7.027  -1.599   1.222
  333    HZ   PHE  25           HZ       PHE  25  -9.295  -0.930   1.972
  334    H    TYR  26           H        TYR  26  -6.264  -3.431  -3.791
  335    HA   TYR  26           HA       TYR  26  -6.633  -0.829  -3.096
  336   1HB   TYR  26          HB2       TYR  26  -5.099  -1.508  -4.861
  337   2HB   TYR  26          HB1       TYR  26  -6.436  -1.946  -5.906
  338    HD1  TYR  26           HD1      TYR  26  -5.026   0.971  -4.034
  339    HD2  TYR  26           HD2      TYR  26  -7.289  -0.399  -7.419
  340    HE1  TYR  26           HE1      TYR  26  -5.053   3.274  -4.949
  341    HE2  TYR  26           HE2      TYR  26  -7.313   1.900  -8.339
  342    HH   TYR  26           HH       TYR  26  -6.451   4.621  -6.502
  343    H    THR  27           H        THR  27  -8.407   0.352  -2.758
  344    HA   THR  27           HA       THR  27 -10.989  -0.493  -3.779
  345    HB   THR  27           HB       THR  27 -11.041   0.432  -1.609
  346    HG1  THR  27           HG1      THR  27 -11.749   2.614  -3.266
  347   1HG2  THR  27          HG21      THR  27 -10.163   2.905  -1.380
  348   2HG2  THR  27          HG22      THR  27  -9.203   2.484  -2.798
  349   3HG2  THR  27          HG23      THR  27  -9.028   1.558  -1.307
  350    H    LYS  28           H        LYS  28 -10.732  -0.278  -6.066
  351    HA   LYS  28           HA       LYS  28  -9.921   1.885  -7.584
  352   1HB   LYS  28          HB2       LYS  28 -12.133  -0.099  -7.893
  353   2HB   LYS  28          HB1       LYS  28 -12.088   1.271  -9.003
  354   1HG   LYS  28          HG2       LYS  28  -9.966   0.673  -9.849
  355   2HG   LYS  28          HG1       LYS  28  -9.624  -0.388  -8.481
  356   1HD   LYS  28          HD2       LYS  28 -11.861  -0.899 -10.457
  357   2HD   LYS  28          HD1       LYS  28 -10.248  -1.595 -10.619
  358   1HE   LYS  28          HE2       LYS  28 -10.521  -2.535  -8.286
  359   2HE   LYS  28          HE1       LYS  28 -12.205  -2.016  -8.347
  360   1HZ   LYS  28          HZ1       LYS  28 -12.592  -3.963  -9.315
  361   2HZ   LYS  28          HZ2       LYS  28 -10.944  -4.261  -9.599
  362   3HZ   LYS  28          HZ3       LYS  28 -11.844  -3.328 -10.699
  363    HA   PRO  29           HA       PRO  29 -12.659   4.949  -5.736
  364   1HB   PRO  29          HB2       PRO  29 -11.245   7.102  -6.703
  365   2HB   PRO  29          HB1       PRO  29 -10.807   6.221  -5.228
  366   1HG   PRO  29          HG2       PRO  29  -9.528   6.122  -7.926
  367   2HG   PRO  29          HG1       PRO  29  -8.810   5.838  -6.332
  368   1HD   PRO  29          HD2       PRO  29  -9.563   3.833  -8.164
  369   2HD   PRO  29          HD1       PRO  29  -9.225   3.581  -6.438
  370    H    THR  30           H        THR  30 -11.441   6.681  -8.521
  371    HA   THR  30           HA       THR  30 -14.129   6.364  -9.795
  372    HB   THR  30           HB       THR  30 -12.272   8.680 -10.314
  373    HG1  THR  30           HG1      THR  30 -13.636   9.726  -8.673
  374   1HG2  THR  30          HG21      THR  30 -13.969   9.121 -11.733
  375   2HG2  THR  30          HG22      THR  30 -14.939   9.476 -10.304
  376   3HG2  THR  30          HG23      THR  30 -14.982   7.866 -11.019
  Start of MODEL    6
    1   1H    GLY   1           HT1      GLY   1  -8.364   8.921  -0.245
    2   2H    GLY   1           HT2      GLY   1  -7.776   9.319  -1.788
    3   3H    GLY   1           HT3      GLY   1  -6.826   9.621  -0.412
    4   1HA   GLY   1          HA1       GLY   1  -7.188   6.997  -0.242
    5   2HA   GLY   1          HA2       GLY   1  -7.180   7.173  -2.023
    6    H    ILE   2           H        ILE   2  -5.508   5.476  -1.113
    7    HA   ILE   2           HA       ILE   2  -3.389   6.572   0.673
    8    HB   ILE   2           HB       ILE   2  -4.049   4.536   1.596
    9   1HG1  ILE   2          HG12      ILE   2  -1.546   4.637   0.768
   10   2HG1  ILE   2          HG11      ILE   2  -2.192   3.136   1.427
   11   1HG2  ILE   2          HG21      ILE   2  -4.420   3.604  -1.253
   12   2HG2  ILE   2          HG22      ILE   2  -5.650   3.808  -0.008
   13   3HG2  ILE   2          HG23      ILE   2  -4.475   2.499   0.120
   14   1HD1  ILE   2          HD11      ILE   2  -2.571   3.552  -1.491
   15   2HD1  ILE   2          HD12      ILE   2  -2.172   2.081  -0.607
   16   3HD1  ILE   2          HD13      ILE   2  -0.916   3.267  -0.954
   17    H    VAL   3           H        VAL   3  -4.076   6.000  -2.585
   18    HA   VAL   3           HA       VAL   3  -1.579   5.096  -3.586
   19    HB   VAL   3           HB       VAL   3  -3.575   7.003  -4.836
   20   1HG1  VAL   3          HG11      VAL   3  -2.252   7.115  -6.669
   21   2HG1  VAL   3          HG12      VAL   3  -1.891   5.390  -6.606
   22   3HG1  VAL   3          HG13      VAL   3  -0.958   6.522  -5.629
   23   1HG2  VAL   3          HG21      VAL   3  -4.808   5.166  -5.250
   24   2HG2  VAL   3          HG22      VAL   3  -3.689   4.232  -4.257
   25   3HG2  VAL   3          HG23      VAL   3  -3.422   4.369  -5.995
   26    H    GLU   4           H        GLU   4  -2.748   8.474  -3.447
   27    HA   GLU   4           HA       GLU   4  -0.274   9.647  -4.108
   28   1HB   GLU   4          HB2       GLU   4  -2.813  10.533  -2.959
   29   2HB   GLU   4          HB1       GLU   4  -1.443  11.434  -2.314
   30   1HG   GLU   4          HG2       GLU   4  -0.675  11.921  -4.610
   31   2HG   GLU   4          HG1       GLU   4  -2.050  11.024  -5.256
   32    H    GLN   5           H        GLN   5  -1.587   8.715  -0.940
   33    HA   GLN   5           HA       GLN   5   0.430   9.772   0.714
   34   1HB   GLN   5          HB2       GLN   5  -1.756   8.305   1.210
   35   2HB   GLN   5          HB1       GLN   5  -0.557   7.014   1.301
   36   1HG   GLN   5          HG2       GLN   5   0.410   9.350   2.700
   37   2HG   GLN   5          HG1       GLN   5  -1.185   8.903   3.308
   38   1HE2  GLN   5          HE21      GLN   5  -1.254   7.172   4.762
   39   2HE2  GLN   5          HE22      GLN   5   0.024   6.085   5.032
   40    H    CYS   6           H        CYS   6   0.421   6.831  -1.265
   41    HA   CYS   6           HA       CYS   6   3.161   6.191  -0.340
   42   1HB   CYS   6          HB2       CYS   6   1.354   4.701  -2.264
   43   2HB   CYS   6          HB1       CYS   6   2.911   4.135  -1.662
   44    H    CYS   7           H        CYS   7   1.636   7.976  -2.796
   45    HA   CYS   7           HA       CYS   7   3.967   7.622  -4.611
   46   1HB   CYS   7          HB2       CYS   7   1.749   7.499  -5.692
   47   2HB   CYS   7          HB1       CYS   7   1.357   9.103  -5.092
   48    H    THR   8           H        THR   8   2.006  10.582  -4.129
   49    HA   THR   8           HA       THR   8   4.100  12.426  -4.289
   50    HB   THR   8           HB       THR   8   2.608  13.589  -2.323
   51    HG1  THR   8           HG1      THR   8   0.545  12.818  -2.439
   52   1HG2  THR   8          HG21      THR   8   2.888  14.570  -4.501
   53   2HG2  THR   8          HG22      THR   8   1.154  14.435  -4.208
   54   3HG2  THR   8          HG23      THR   8   1.963  13.276  -5.263
   55    H    SER   9           H        SER   9   2.990  10.527  -1.562
   56    HA   SER   9           HA       SER   9   5.480  11.225  -0.064
   57   1HB   SER   9          HB2       SER   9   2.688  10.570   0.775
   58   2HB   SER   9          HB1       SER   9   3.982   9.885   1.755
   59    HG   SER   9           HG       SER   9   3.859  11.818   2.634
   60    H    ILE  10           H        ILE  10   6.138   9.044   1.261
   61    HA   ILE  10           HA       ILE  10   5.764   6.819  -0.703
   62    HB   ILE  10           HB       ILE  10   8.241   7.543   0.882
   63   1HG1  ILE  10          HG12      ILE  10   9.253   7.696  -1.371
   64   2HG1  ILE  10          HG11      ILE  10   7.696   7.307  -2.099
   65   1HG2  ILE  10          HG21      ILE  10   8.997   5.522  -0.727
   66   2HG2  ILE  10          HG22      ILE  10   7.327   5.036  -0.430
   67   3HG2  ILE  10          HG23      ILE  10   8.438   5.257   0.923
   68   1HD1  ILE  10          HD11      ILE  10   6.886   9.409  -1.784
   69   2HD1  ILE  10          HD12      ILE  10   8.587   9.848  -1.658
   70   3HD1  ILE  10          HD13      ILE  10   7.642   9.568  -0.198
   71    H    CYS  11           H        CYS  11   5.466   4.734   0.146
   72    HA   CYS  11           HA       CYS  11   4.862   4.687   3.077
   73   1HB   CYS  11          HB2       CYS  11   3.776   2.941   0.843
   74   2HB   CYS  11          HB1       CYS  11   3.354   2.791   2.546
   75    H    SER  12           H        SER  12   4.908   2.141   3.742
   76    HA   SER  12           HA       SER  12   7.593   1.134   2.885
   77   1HB   SER  12          HB2       SER  12   7.911   0.287   5.141
   78   2HB   SER  12          HB1       SER  12   7.488   1.994   5.248
   79    HG   SER  12           HG       SER  12   6.253  -0.072   6.341
   80    H    LEU  13           H        LEU  13   7.653  -1.362   3.689
   81    HA   LEU  13           HA       LEU  13   5.697  -2.702   2.042
   82   1HB   LEU  13          HB2       LEU  13   8.076  -3.438   3.616
   83   2HB   LEU  13          HB1       LEU  13   6.842  -4.695   3.549
   84    HG   LEU  13           HG       LEU  13   8.669  -4.560   1.657
   85   1HD1  LEU  13          HD11      LEU  13   6.828  -5.260  -0.014
   86   2HD1  LEU  13          HD12      LEU  13   5.702  -4.976   1.314
   87   3HD1  LEU  13          HD13      LEU  13   6.970  -6.191   1.476
   88   1HD2  LEU  13          HD21      LEU  13   6.686  -2.881   0.211
   89   2HD2  LEU  13          HD22      LEU  13   8.440  -2.948   0.039
   90   3HD2  LEU  13          HD23      LEU  13   7.719  -2.032   1.361
   91    H    TYR  14           H        TYR  14   5.860  -1.870   5.415
   92    HA   TYR  14           HA       TYR  14   3.921  -3.836   6.300
   93   1HB   TYR  14          HB2       TYR  14   5.550  -2.639   7.815
   94   2HB   TYR  14          HB1       TYR  14   4.598  -1.173   7.589
   95    HD1  TYR  14           HD1      TYR  14   4.444  -4.686   8.831
   96    HD2  TYR  14           HD2      TYR  14   2.568  -0.818   8.787
   97    HE1  TYR  14           HE1      TYR  14   2.887  -5.418  10.622
   98    HE2  TYR  14           HE2      TYR  14   1.011  -1.553  10.578
   99    HH   TYR  14           HH       TYR  14   0.295  -4.471  11.304
  100    H    GLN  15           H        GLN  15   3.766  -0.522   5.069
  101    HA   GLN  15           HA       GLN  15   0.954  -0.206   5.675
  102   1HB   GLN  15          HB2       GLN  15   2.740   1.285   3.730
  103   2HB   GLN  15          HB1       GLN  15   1.112   1.785   4.186
  104   1HG   GLN  15          HG2       GLN  15   2.117   1.519   6.644
  105   2HG   GLN  15          HG1       GLN  15   3.630   1.830   5.792
  106   1HE2  GLN  15          HE21      GLN  15   0.856   3.334   7.143
  107   2HE2  GLN  15          HE22      GLN  15   1.097   4.884   6.493
  108    H    LEU  16           H        LEU  16   2.645  -0.655   2.528
  109    HA   LEU  16           HA       LEU  16   0.314  -1.078   0.999
  110   1HB   LEU  16          HB2       LEU  16   3.149  -2.005   0.759
  111   2HB   LEU  16          HB1       LEU  16   1.944  -2.764  -0.271
  112    HG   LEU  16           HG       LEU  16   2.102  -1.017  -1.690
  113   1HD1  LEU  16          HD11      LEU  16   1.303   0.694   0.684
  114   2HD1  LEU  16          HD12      LEU  16   0.227   0.028  -0.545
  115   3HD1  LEU  16          HD13      LEU  16   1.393   1.280  -0.977
  116   1HD2  LEU  16          HD21      LEU  16   4.166  -0.181  -1.515
  117   2HD2  LEU  16          HD22      LEU  16   4.197  -0.540   0.211
  118   3HD2  LEU  16          HD23      LEU  16   3.555   1.001  -0.358
  119    H    GLU  17           H        GLU  17   1.707  -3.000   3.481
  120    HA   GLU  17           HA       GLU  17   0.544  -5.546   2.686
  121   1HB   GLU  17          HB2       GLU  17   1.726  -4.456   5.241
  122   2HB   GLU  17          HB1       GLU  17   0.892  -6.007   5.233
  123   1HG   GLU  17          HG2       GLU  17   3.010  -5.459   3.179
  124   2HG   GLU  17          HG1       GLU  17   3.483  -5.922   4.814
  125    H    ASN  18           H        ASN  18  -0.376  -2.829   4.739
  126    HA   ASN  18           HA       ASN  18  -2.728  -3.951   5.869
  127   1HB   ASN  18          HB2       ASN  18  -2.336  -1.040   5.184
  128   2HB   ASN  18          HB1       ASN  18  -3.219  -1.735   6.541
  129   1HD2  ASN  18          HD21      ASN  18  -0.874  -3.791   6.770
  130   2HD2  ASN  18          HD22      ASN  18   0.317  -2.926   7.610
  131    H    TYR  19           H        TYR  19  -2.003  -3.049   2.674
  132    HA   TYR  19           HA       TYR  19  -4.888  -2.757   2.036
  133   1HB   TYR  19          HB2       TYR  19  -2.421  -2.069   0.416
  134   2HB   TYR  19          HB1       TYR  19  -4.085  -1.873  -0.152
  135    HD1  TYR  19           HD1      TYR  19  -1.487  -0.591   2.073
  136    HD2  TYR  19           HD2      TYR  19  -5.635  -0.307   0.994
  137    HE1  TYR  19           HE1      TYR  19  -1.666   1.532   3.336
  138    HE2  TYR  19           HE2      TYR  19  -5.819   1.814   2.262
  139    HH   TYR  19           HH       TYR  19  -3.024   3.472   3.489
  140    H    CYS  20           H        CYS  20  -2.486  -5.065   2.133
  141    HA   CYS  20           HA       CYS  20  -3.141  -6.560  -0.271
  142   1HB   CYS  20          HB2       CYS  20  -1.702  -7.197   2.302
  143   2HB   CYS  20          HB1       CYS  20  -1.924  -8.389   1.057
  144    H    ASN  21           H        ASN  21  -4.166  -8.868   0.060
  145    HA   ASN  21           HA       ASN  21  -6.779  -8.670   1.016
  146   1HB   ASN  21          HB2       ASN  21  -6.094 -10.599  -0.289
  147   2HB   ASN  21          HB1       ASN  21  -5.005 -11.130   0.995
  148   1HD2  ASN  21          HD21      ASN  21  -8.436  -9.997   1.007
  149   2HD2  ASN  21          HD22      ASN  21  -9.031 -11.349   1.843
  150   1H    PHE   1           HT1      PHE   1  10.438  -1.411   1.955
  151   2H    PHE   1           HT2      PHE   1   9.856  -2.918   1.430
  152   3H    PHE   1           HT3      PHE   1   9.554  -1.521   0.513
  153    HA   PHE   1           HA       PHE   1  11.955  -3.158   0.689
  154   1HB   PHE   1          HB2       PHE   1  10.750  -1.378  -1.458
  155   2HB   PHE   1          HB1       PHE   1  12.112  -2.474  -1.683
  156    HD1  PHE   1           HD1      PHE   1   9.052  -2.326  -2.815
  157    HD2  PHE   1           HD2      PHE   1  11.211  -4.801  -0.042
  158    HE1  PHE   1           HE1      PHE   1   7.467  -4.185  -3.238
  159    HE2  PHE   1           HE2      PHE   1   9.624  -6.660  -0.466
  160    HZ   PHE   1           HZ       PHE   1   7.752  -6.351  -2.065
  161    H    VAL   2           H        VAL   2  11.763   0.004  -0.860
  162    HA   VAL   2           HA       VAL   2  13.411   1.315   1.162
  163    HB   VAL   2           HB       VAL   2  15.139  -0.003   0.049
  164   1HG1  VAL   2          HG11      VAL   2  14.798   1.301  -2.577
  165   2HG1  VAL   2          HG12      VAL   2  13.523   0.157  -2.157
  166   3HG1  VAL   2          HG13      VAL   2  15.205  -0.371  -2.194
  167   1HG2  VAL   2          HG21      VAL   2  16.479   1.800   0.199
  168   2HG2  VAL   2          HG22      VAL   2  15.055   2.840   0.156
  169   3HG2  VAL   2          HG23      VAL   2  15.873   2.401  -1.345
  170    H    ASN   3           H        ASN   3  11.873   2.994   1.096
  171    HA   ASN   3           HA       ASN   3  10.756   4.873   0.239
  172   1HB   ASN   3          HB2       ASN   3  13.435   4.822  -1.028
  173   2HB   ASN   3          HB1       ASN   3  12.234   5.823  -1.846
  174   1HD2  ASN   3          HD21      ASN   3  12.733   7.934  -1.151
  175   2HD2  ASN   3          HD22      ASN   3  12.883   8.394   0.477
  176    H    GLN   4           H        GLN   4   9.023   3.504  -0.562
  177    HA   GLN   4           HA       GLN   4   9.147   2.865  -3.466
  178   1HB   GLN   4          HB2       GLN   4   8.393   1.263  -1.466
  179   2HB   GLN   4          HB1       GLN   4   6.842   2.052  -1.754
  180   1HG   GLN   4          HG2       GLN   4   6.969   0.052  -3.130
  181   2HG   GLN   4          HG1       GLN   4   7.050   1.470  -4.174
  182   1HE2  GLN   4          HE21      GLN   4   8.563   1.103  -5.798
  183   2HE2  GLN   4          HE22      GLN   4  10.061   0.335  -5.581
  184    H    HIS   5           H        HIS   5   8.468   4.608  -4.649
  185    HA   HIS   5           HA       HIS   5   6.186   6.256  -3.688
  186   1HB   HIS   5          HB2       HIS   5   7.653   6.637  -6.301
  187   2HB   HIS   5          HB1       HIS   5   6.830   7.849  -5.321
  188    HD2  HIS   5           HD2      HIS   5  10.086   5.594  -4.942
  189    HE1  HIS   5           HE1      HIS   5  10.594   9.200  -2.796
  190    HE2  HIS   5           HE2      HIS   5  11.717   7.022  -3.504
  191    H    LEU   6           H        LEU   6   4.267   5.173  -4.127
  192    HA   LEU   6           HA       LEU   6   4.022   3.926  -6.837
  193   1HB   LEU   6          HB2       LEU   6   3.029   3.146  -4.141
  194   2HB   LEU   6          HB1       LEU   6   2.084   2.723  -5.558
  195    HG   LEU   6           HG       LEU   6   3.665   1.225  -6.335
  196   1HD1  LEU   6          HD11      LEU   6   5.482   2.807  -6.638
  197   2HD1  LEU   6          HD12      LEU   6   6.107   1.417  -5.754
  198   3HD1  LEU   6          HD13      LEU   6   5.735   2.911  -4.896
  199   1HD2  LEU   6          HD21      LEU   6   3.108   0.244  -4.257
  200   2HD2  LEU   6          HD22      LEU   6   4.026   1.444  -3.347
  201   3HD2  LEU   6          HD23      LEU   6   4.871   0.207  -4.277
  202    H    CYS   7           H        CYS   7   2.577   4.791  -8.181
  203    HA   CYS   7           HA       CYS   7   0.159   6.055  -7.022
  204   1HB   CYS   7          HB2       CYS   7   0.879   7.456  -9.430
  205   2HB   CYS   7          HB1       CYS   7   0.599   8.112  -7.823
  206    H    GLY   8           H        GLY   8  -1.656   6.041  -8.547
  207   1HA   GLY   8          HA2       GLY   8  -3.003   4.769 -10.011
  208   2HA   GLY   8          HA1       GLY   8  -1.752   5.214 -11.170
  209    H    SER   9           H        SER   9  -1.440   3.356 -12.311
  210    HA   SER   9           HA       SER   9  -1.697   0.708 -11.370
  211   1HB   SER   9          HB2       SER   9  -0.146   0.151 -13.326
  212   2HB   SER   9          HB1       SER   9  -1.611   1.044 -13.723
  213    HG   SER   9           HG       SER   9  -0.031   2.179 -14.688
  214    H    ASP  10           H        ASP  10   1.277   2.705 -11.587
  215    HA   ASP  10           HA       ASP  10   3.182   0.857 -10.763
  216   1HB   ASP  10          HB2       ASP  10   2.863   3.748  -9.897
  217   2HB   ASP  10          HB1       ASP  10   4.299   2.782  -9.557
  218    H    LEU  11           H        LEU  11   0.561   2.231  -8.925
  219    HA   LEU  11           HA       LEU  11   1.557   1.279  -6.350
  220   1HB   LEU  11          HB2       LEU  11   0.061   3.265  -6.560
  221   2HB   LEU  11          HB1       LEU  11  -1.215   2.206  -7.151
  222    HG   LEU  11           HG       LEU  11  -1.247   0.991  -5.036
  223   1HD1  LEU  11          HD11      LEU  11   1.191   1.223  -4.524
  224   2HD1  LEU  11          HD12      LEU  11   0.167   1.665  -3.159
  225   3HD1  LEU  11          HD13      LEU  11   0.915   2.923  -4.141
  226   1HD2  LEU  11          HD21      LEU  11  -1.530   3.218  -3.540
  227   2HD2  LEU  11          HD22      LEU  11  -2.719   2.715  -4.741
  228   3HD2  LEU  11          HD23      LEU  11  -1.518   3.943  -5.147
  229    H    THR  12           H        THR  12  -1.096   0.315  -8.559
  230    HA   THR  12           HA       THR  12  -1.817  -2.039  -7.116
  231    HB   THR  12           HB       THR  12  -1.897  -1.477 -10.094
  232    HG1  THR  12           HG1      THR  12  -4.268  -1.497  -9.232
  233   1HG2  THR  12          HG21      THR  12  -2.624  -3.574 -10.432
  234   2HG2  THR  12          HG22      THR  12  -3.825  -3.407  -9.151
  235   3HG2  THR  12          HG23      THR  12  -2.189  -3.940  -8.763
  236    H    GLU  13           H        GLU  13   0.617  -1.409  -9.615
  237    HA   GLU  13           HA       GLU  13   1.559  -4.014 -10.068
  238   1HB   GLU  13          HB2       GLU  13   2.562  -1.308 -10.405
  239   2HB   GLU  13          HB1       GLU  13   3.861  -2.403  -9.931
  240   1HG   GLU  13          HG2       GLU  13   2.617  -3.955 -11.758
  241   2HG   GLU  13          HG1       GLU  13   2.225  -2.364 -12.412
  242    H    ALA  14           H        ALA  14   2.879  -1.697  -7.658
  243    HA   ALA  14           HA       ALA  14   4.504  -3.590  -6.291
  244   1HB   ALA  14          HB1       ALA  14   3.391  -0.912  -5.730
  245   2HB   ALA  14          HB2       ALA  14   5.007  -1.540  -5.418
  246   3HB   ALA  14          HB3       ALA  14   3.696  -1.884  -4.290
  247    H    LEU  15           H        LEU  15   1.251  -2.394  -5.415
  248    HA   LEU  15           HA       LEU  15   0.624  -4.090  -3.303
  249   1HB   LEU  15          HB2       LEU  15  -0.955  -2.874  -5.537
  250   2HB   LEU  15          HB1       LEU  15  -1.743  -4.099  -4.551
  251    HG   LEU  15           HG       LEU  15  -0.360  -1.646  -3.432
  252   1HD1  LEU  15          HD11      LEU  15  -2.272  -0.480  -3.724
  253   2HD1  LEU  15          HD12      LEU  15  -3.250  -1.810  -3.102
  254   3HD1  LEU  15          HD13      LEU  15  -2.794  -1.772  -4.805
  255   1HD2  LEU  15          HD21      LEU  15  -0.403  -3.289  -1.734
  256   2HD2  LEU  15          HD22      LEU  15  -1.965  -3.916  -2.259
  257   3HD2  LEU  15          HD23      LEU  15  -1.870  -2.358  -1.440
  258    H    TYR  16           H        TYR  16   0.137  -4.751  -6.764
  259    HA   TYR  16           HA       TYR  16  -0.815  -7.376  -6.654
  260   1HB   TYR  16          HB2       TYR  16  -0.063  -5.687  -8.633
  261   2HB   TYR  16          HB1       TYR  16   1.263  -6.840  -8.687
  262    HD1  TYR  16           HD1      TYR  16  -1.835  -6.157 -10.041
  263    HD2  TYR  16           HD2      TYR  16   0.377  -9.401  -8.303
  264    HE1  TYR  16           HE1      TYR  16  -3.296  -7.776 -11.218
  265    HE2  TYR  16           HE2      TYR  16  -1.080 -11.026  -9.480
  266    HH   TYR  16           HH       TYR  16  -2.558 -10.888 -11.719
  267    H    LEU  17           H        LEU  17   2.494  -6.222  -6.219
  268    HA   LEU  17           HA       LEU  17   3.518  -8.979  -6.190
  269   1HB   LEU  17          HB2       LEU  17   4.679  -6.751  -7.041
  270   2HB   LEU  17          HB1       LEU  17   5.187  -6.644  -5.353
  271    HG   LEU  17           HG       LEU  17   5.617  -9.028  -7.184
  272   1HD1  LEU  17          HD11      LEU  17   7.519  -6.946  -6.071
  273   2HD1  LEU  17          HD12      LEU  17   7.091  -7.184  -7.766
  274   3HD1  LEU  17          HD13      LEU  17   8.023  -8.412  -6.912
  275   1HD2  LEU  17          HD21      LEU  17   7.179  -9.606  -5.148
  276   2HD2  LEU  17          HD22      LEU  17   5.455  -9.964  -5.043
  277   3HD2  LEU  17          HD23      LEU  17   6.106  -8.525  -4.258
  278    H    VAL  18           H        VAL  18   3.617  -6.242  -3.851
  279    HA   VAL  18           HA       VAL  18   4.623  -7.489  -1.621
  280    HB   VAL  18           HB       VAL  18   2.463  -6.240  -0.451
  281   1HG1  VAL  18          HG11      VAL  18   4.632  -4.467  -1.395
  282   2HG1  VAL  18          HG12      VAL  18   5.141  -5.913  -0.522
  283   3HG1  VAL  18          HG13      VAL  18   4.044  -4.762   0.240
  284   1HG2  VAL  18          HG21      VAL  18   1.968  -5.702  -3.031
  285   2HG2  VAL  18          HG22      VAL  18   3.124  -4.409  -2.707
  286   3HG2  VAL  18          HG23      VAL  18   1.645  -4.529  -1.754
  287    H    CYS  19           H        CYS  19   1.301  -7.752  -2.729
  288    HA   CYS  19           HA       CYS  19   0.823  -9.908  -0.739
  289   1HB   CYS  19          HB2       CYS  19  -1.370  -9.218  -2.582
  290   2HB   CYS  19          HB1       CYS  19  -1.375  -9.327  -0.831
  291    H    GLY  20           H        GLY  20  -0.151  -9.428  -4.131
  292   1HA   GLY  20          HA2       GLY  20  -0.087 -10.903  -5.962
  293   2HA   GLY  20          HA1       GLY  20   1.286 -11.677  -5.168
  294    H    GLU  21           H        GLU  21   0.956 -13.675  -4.254
  295    HA   GLU  21           HA       GLU  21  -1.383 -15.165  -4.757
  296   1HB   GLU  21          HB2       GLU  21   0.592 -15.511  -2.475
  297   2HB   GLU  21          HB1       GLU  21  -0.567 -16.729  -3.011
  298   1HG   GLU  21          HG2       GLU  21   0.866 -15.798  -5.303
  299   2HG   GLU  21          HG1       GLU  21   2.039 -16.209  -4.050
  300    H    ARG  22           H        ARG  22  -0.652 -12.854  -2.281
  301    HA   ARG  22           HA       ARG  22  -2.907 -13.616  -0.582
  302   1HB   ARG  22          HB2       ARG  22  -1.150 -11.146  -0.568
  303   2HB   ARG  22          HB1       ARG  22  -2.315 -11.574   0.686
  304   1HG   ARG  22          HG2       ARG  22   0.154 -13.136  -0.119
  305   2HG   ARG  22          HG1       ARG  22  -0.131 -12.319   1.419
  306   1HD   ARG  22          HD2       ARG  22  -0.911 -14.315   2.151
  307   2HD   ARG  22          HD1       ARG  22  -2.342 -13.965   1.183
  308    HE   ARG  22           HE       ARG  22  -0.633 -15.118  -0.642
  309   1HH1  ARG  22          HH21      ARG  22  -3.060 -16.574   0.242
  310   2HH1  ARG  22          HH22      ARG  22  -2.403 -18.003   0.968
  311   1HH2  ARG  22          HH11      ARG  22   0.794 -16.696   1.278
  312   2HH2  ARG  22          HH12      ARG  22  -0.222 -18.071   1.555
  313    H    GLY  23           H        GLY  23  -2.753 -12.234  -3.553
  314   1HA   GLY  23          HA2       GLY  23  -4.106 -10.700  -4.733
  315   2HA   GLY  23          HA1       GLY  23  -5.388 -11.518  -3.845
  316    H    PHE  24           H        PHE  24  -3.520  -8.605  -4.101
  317    HA   PHE  24           HA       PHE  24  -4.174  -7.405  -1.574
  318   1HB   PHE  24          HB2       PHE  24  -3.663  -5.283  -2.698
  319   2HB   PHE  24          HB1       PHE  24  -2.485  -6.496  -3.145
  320    HD1  PHE  24           HD1      PHE  24  -5.792  -5.177  -4.367
  321    HD2  PHE  24           HD2      PHE  24  -1.939  -6.794  -5.354
  322    HE1  PHE  24           HE1      PHE  24  -6.281  -4.865  -6.775
  323    HE2  PHE  24           HE2      PHE  24  -2.426  -6.482  -7.766
  324    HZ   PHE  24           HZ       PHE  24  -4.597  -5.518  -8.478
  325    H    PHE  25           H        PHE  25  -5.665  -5.178  -1.864
  326    HA   PHE  25           HA       PHE  25  -8.098  -5.826  -3.411
  327   1HB   PHE  25          HB2       PHE  25  -9.480  -6.280  -1.663
  328   2HB   PHE  25          HB1       PHE  25  -7.992  -6.667  -0.808
  329    HD1  PHE  25           HD1      PHE  25 -10.859  -4.490  -0.972
  330    HD2  PHE  25           HD2      PHE  25  -6.849  -4.811   0.535
  331    HE1  PHE  25           HE1      PHE  25 -11.316  -2.656   0.634
  332    HE2  PHE  25           HE2      PHE  25  -7.303  -2.977   2.142
  333    HZ   PHE  25           HZ       PHE  25  -9.538  -1.900   2.194
  334    H    TYR  26           H        TYR  26  -5.954  -3.699  -3.284
  335    HA   TYR  26           HA       TYR  26  -6.838  -1.253  -2.267
  336   1HB   TYR  26          HB2       TYR  26  -4.825  -0.838  -3.210
  337   2HB   TYR  26          HB1       TYR  26  -4.995  -2.168  -4.348
  338    HD1  TYR  26           HD1      TYR  26  -4.860   1.354  -3.987
  339    HD2  TYR  26           HD2      TYR  26  -6.669  -1.745  -6.352
  340    HE1  TYR  26           HE1      TYR  26  -5.254   2.984  -5.815
  341    HE2  TYR  26           HE2      TYR  26  -7.066  -0.116  -8.180
  342    HH   TYR  26           HH       TYR  26  -7.259   2.243  -8.532
  343    H    THR  27           H        THR  27  -8.030   0.507  -3.311
  344    HA   THR  27           HA       THR  27  -9.750  -0.259  -5.596
  345    HB   THR  27           HB       THR  27 -11.133  -0.996  -3.791
  346    HG1  THR  27           HG1      THR  27 -12.832   0.271  -4.158
  347   1HG2  THR  27          HG21      THR  27 -10.941   1.632  -2.363
  348   2HG2  THR  27          HG22      THR  27  -9.648   0.451  -2.148
  349   3HG2  THR  27          HG23      THR  27 -11.305   0.031  -1.716
  350    H    LYS  28           H        LYS  28  -8.799   2.221  -3.231
  351    HA   LYS  28           HA       LYS  28  -8.613   4.549  -3.470
  352   1HB   LYS  28          HB2       LYS  28  -7.040   3.811  -5.275
  353   2HB   LYS  28          HB1       LYS  28  -8.385   3.857  -6.416
  354   1HG   LYS  28          HG2       LYS  28  -8.640   6.319  -5.340
  355   2HG   LYS  28          HG1       LYS  28  -6.900   6.100  -5.149
  356   1HD   LYS  28          HD2       LYS  28  -6.541   5.892  -7.456
  357   2HD   LYS  28          HD1       LYS  28  -8.220   5.453  -7.774
  358   1HE   LYS  28          HE2       LYS  28  -8.588   7.614  -8.296
  359   2HE   LYS  28          HE1       LYS  28  -8.360   7.988  -6.587
  360   1HZ   LYS  28          HZ1       LYS  28  -5.955   7.637  -8.197
  361   2HZ   LYS  28          HZ2       LYS  28  -6.266   8.722  -6.927
  362   3HZ   LYS  28          HZ3       LYS  28  -6.864   9.040  -8.485
  363    HA   PRO  29           HA       PRO  29 -13.015   4.921  -4.631
  364   1HB   PRO  29          HB2       PRO  29 -13.701   6.279  -2.339
  365   2HB   PRO  29          HB1       PRO  29 -13.671   4.511  -2.462
  366   1HG   PRO  29          HG2       PRO  29 -11.737   6.330  -1.104
  367   2HG   PRO  29          HG1       PRO  29 -12.122   4.637  -0.753
  368   1HD   PRO  29          HD2       PRO  29  -9.839   5.562  -2.147
  369   2HD   PRO  29          HD1       PRO  29 -10.410   3.882  -2.078
  370    H    THR  30           H        THR  30 -10.713   7.313  -3.395
  371    HA   THR  30           HA       THR  30 -12.238   9.461  -4.793
  372    HB   THR  30           HB       THR  30  -9.912   9.731  -2.867
  373    HG1  THR  30           HG1      THR  30 -12.068   8.825  -2.155
  374   1HG2  THR  30          HG21      THR  30 -10.839  12.077  -2.701
  375   2HG2  THR  30          HG22      THR  30 -11.882  11.689  -4.070
  376   3HG2  THR  30          HG23      THR  30 -10.130  11.678  -4.266
  Start of MODEL    7
    1   1H    GLY   1           HT1      GLY   1  -8.456   7.930  -3.546
    2   2H    GLY   1           HT2      GLY   1  -6.863   8.475  -3.316
    3   3H    GLY   1           HT3      GLY   1  -8.075   8.894  -2.203
    4   1HA   GLY   1          HA1       GLY   1  -7.799   6.943  -1.128
    5   2HA   GLY   1          HA2       GLY   1  -7.808   5.981  -2.639
    6    H    ILE   2           H        ILE   2  -5.819   4.937  -1.892
    7    HA   ILE   2           HA       ILE   2  -4.083   6.279   0.117
    8    HB   ILE   2           HB       ILE   2  -4.611   4.150   0.926
    9   1HG1  ILE   2          HG12      ILE   2  -2.050   4.613   0.491
   10   2HG1  ILE   2          HG11      ILE   2  -2.574   3.023   1.040
   11   1HG2  ILE   2          HG21      ILE   2  -4.402   2.116  -0.697
   12   2HG2  ILE   2          HG22      ILE   2  -4.526   3.334  -1.966
   13   3HG2  ILE   2          HG23      ILE   2  -5.831   3.145  -0.795
   14   1HD1  ILE   2          HD11      ILE   2  -2.590   3.407  -1.894
   15   2HD1  ILE   2          HD12      ILE   2  -2.056   2.023  -0.942
   16   3HD1  ILE   2          HD13      ILE   2  -0.995   3.417  -1.142
   17    H    VAL   3           H        VAL   3  -4.281   6.032  -3.163
   18    HA   VAL   3           HA       VAL   3  -1.714   5.260  -4.042
   19    HB   VAL   3           HB       VAL   3  -3.682   7.292  -5.103
   20   1HG1  VAL   3          HG11      VAL   3  -2.053   6.809  -7.218
   21   2HG1  VAL   3          HG12      VAL   3  -0.874   6.752  -5.908
   22   3HG1  VAL   3          HG13      VAL   3  -1.855   8.197  -6.149
   23   1HG2  VAL   3          HG21      VAL   3  -3.692   4.554  -5.139
   24   2HG2  VAL   3          HG22      VAL   3  -2.864   4.914  -6.655
   25   3HG2  VAL   3          HG23      VAL   3  -4.478   5.560  -6.355
   26    H    GLU   4           H        GLU   4  -2.727   8.675  -3.725
   27    HA   GLU   4           HA       GLU   4  -0.142   9.733  -3.794
   28   1HB   GLU   4          HB2       GLU   4  -1.123  11.756  -3.197
   29   2HB   GLU   4          HB1       GLU   4  -2.526  10.869  -3.777
   30   1HG   GLU   4          HG2       GLU   4  -2.781  10.097  -1.304
   31   2HG   GLU   4          HG1       GLU   4  -1.715  11.453  -0.934
   32    H    GLN   5           H        GLN   5  -1.844   8.222  -1.129
   33    HA   GLN   5           HA       GLN   5  -0.294   9.183   1.041
   34   1HB   GLN   5          HB2       GLN   5  -2.347   7.746   1.242
   35   2HB   GLN   5          HB1       GLN   5  -1.371   6.365   0.736
   36   1HG   GLN   5          HG2       GLN   5  -0.750   6.096   2.884
   37   2HG   GLN   5          HG1       GLN   5   0.106   7.634   2.774
   38   1HE2  GLN   5          HE21      GLN   5  -2.061   9.438   2.563
   39   2HE2  GLN   5          HE22      GLN   5  -2.980   9.374   3.989
   40    H    CYS   6           H        CYS   6   0.376   6.626  -1.317
   41    HA   CYS   6           HA       CYS   6   3.033   6.227  -0.023
   42   1HB   CYS   6          HB2       CYS   6   1.438   4.512  -1.931
   43   2HB   CYS   6          HB1       CYS   6   3.137   4.207  -1.571
   44    H    CYS   7           H        CYS   7   1.541   7.835  -2.591
   45    HA   CYS   7           HA       CYS   7   4.016   7.734  -4.241
   46   1HB   CYS   7          HB2       CYS   7   1.835   7.379  -5.400
   47   2HB   CYS   7          HB1       CYS   7   1.326   8.987  -4.909
   48    H    THR   8           H        THR   8   1.748  10.489  -3.879
   49    HA   THR   8           HA       THR   8   3.675  12.515  -3.921
   50    HB   THR   8           HB       THR   8   1.343  12.611  -1.993
   51    HG1  THR   8           HG1      THR   8   1.382  12.430  -4.764
   52   1HG2  THR   8          HG21      THR   8   3.138  14.526  -3.348
   53   2HG2  THR   8          HG22      THR   8   2.265  14.684  -1.823
   54   3HG2  THR   8          HG23      THR   8   1.433  14.973  -3.351
   55    H    SER   9           H        SER   9   2.669  10.412  -1.339
   56    HA   SER   9           HA       SER   9   4.999  11.315   0.295
   57   1HB   SER   9          HB2       SER   9   2.186  10.593   1.106
   58   2HB   SER   9          HB1       SER   9   3.518  10.311   2.224
   59    HG   SER   9           HG       SER   9   3.265  12.353   2.673
   60    H    ILE  10           H        ILE  10   6.448   9.637   0.541
   61    HA   ILE  10           HA       ILE  10   5.743   7.042  -0.602
   62    HB   ILE  10           HB       ILE  10   8.262   8.159   0.646
   63   1HG1  ILE  10          HG12      ILE  10   9.046   7.326  -1.719
   64   2HG1  ILE  10          HG11      ILE  10   7.326   7.352  -2.102
   65   1HG2  ILE  10          HG21      ILE  10   7.439   5.344   0.184
   66   2HG2  ILE  10          HG22      ILE  10   8.628   5.996   1.312
   67   3HG2  ILE  10          HG23      ILE  10   9.049   5.781  -0.387
   68   1HD1  ILE  10          HD11      ILE  10   7.889   9.510  -2.703
   69   2HD1  ILE  10          HD12      ILE  10   9.172   9.621  -1.498
   70   3HD1  ILE  10          HD13      ILE  10   7.486   9.775  -1.006
   71    H    CYS  11           H        CYS  11   5.516   5.076   0.539
   72    HA   CYS  11           HA       CYS  11   5.283   5.402   3.512
   73   1HB   CYS  11          HB2       CYS  11   3.485   3.703   3.468
   74   2HB   CYS  11          HB1       CYS  11   3.058   5.109   2.499
   75    H    SER  12           H        SER  12   4.952   2.709   4.180
   76    HA   SER  12           HA       SER  12   7.611   1.623   3.352
   77   1HB   SER  12          HB2       SER  12   7.403   0.307   5.525
   78   2HB   SER  12          HB1       SER  12   7.611   2.047   5.699
   79    HG   SER  12           HG       SER  12   5.810   1.978   6.767
   80    H    LEU  13           H        LEU  13   7.777  -0.716   3.144
   81    HA   LEU  13           HA       LEU  13   5.819  -1.887   1.486
   82   1HB   LEU  13          HB2       LEU  13   8.217  -2.795   2.943
   83   2HB   LEU  13          HB1       LEU  13   7.029  -4.065   2.651
   84    HG   LEU  13           HG       LEU  13   8.735  -3.773   0.806
   85   1HD1  LEU  13          HD11      LEU  13   6.967  -3.742  -1.012
   86   2HD1  LEU  13          HD12      LEU  13   5.788  -3.365   0.242
   87   3HD1  LEU  13          HD13      LEU  13   6.668  -4.892   0.291
   88   1HD2  LEU  13          HD21      LEU  13   9.073  -1.742  -0.124
   89   2HD2  LEU  13          HD22      LEU  13   8.064  -1.071   1.158
   90   3HD2  LEU  13          HD23      LEU  13   7.344  -1.516  -0.389
   91    H    TYR  14           H        TYR  14   6.242  -2.085   5.003
   92    HA   TYR  14           HA       TYR  14   4.349  -4.097   5.567
   93   1HB   TYR  14          HB2       TYR  14   5.950  -2.909   7.184
   94   2HB   TYR  14          HB1       TYR  14   4.749  -1.623   7.267
   95    HD1  TYR  14           HD1      TYR  14   4.280  -5.337   7.048
   96    HD2  TYR  14           HD2      TYR  14   3.793  -1.776   9.407
   97    HE1  TYR  14           HE1      TYR  14   3.016  -6.633   8.750
   98    HE2  TYR  14           HE2      TYR  14   2.531  -3.075  11.108
   99    HH   TYR  14           HH       TYR  14   1.366  -6.224  10.516
  100    H    GLN  15           H        GLN  15   3.902  -0.702   4.782
  101    HA   GLN  15           HA       GLN  15   1.111  -0.618   5.539
  102   1HB   GLN  15          HB2       GLN  15   2.720   1.131   3.647
  103   2HB   GLN  15          HB1       GLN  15   1.096   1.507   4.229
  104   1HG   GLN  15          HG2       GLN  15   2.529   0.874   6.539
  105   2HG   GLN  15          HG1       GLN  15   3.656   1.829   5.574
  106   1HE2  GLN  15          HE21      GLN  15   0.082   1.985   6.108
  107   2HE2  GLN  15          HE22      GLN  15   0.065   3.639   6.487
  108    H    LEU  16           H        LEU  16   2.677  -0.720   2.281
  109    HA   LEU  16           HA       LEU  16   0.321  -1.074   0.804
  110   1HB   LEU  16          HB2       LEU  16   3.160  -1.855   0.407
  111   2HB   LEU  16          HB1       LEU  16   1.992  -2.787  -0.526
  112    HG   LEU  16           HG       LEU  16   2.557  -0.936  -1.920
  113   1HD1  LEU  16          HD11      LEU  16   0.477  -0.095  -2.359
  114   2HD1  LEU  16          HD12      LEU  16   0.176   0.332  -0.674
  115   3HD1  LEU  16          HD13      LEU  16   0.000  -1.339  -1.206
  116   1HD2  LEU  16          HD21      LEU  16   1.908   1.074   0.199
  117   2HD2  LEU  16          HD22      LEU  16   2.984   1.221  -1.190
  118   3HD2  LEU  16          HD23      LEU  16   3.488   0.290   0.221
  119    H    GLU  17           H        GLU  17   1.898  -3.225   3.024
  120    HA   GLU  17           HA       GLU  17   0.427  -5.627   2.201
  121   1HB   GLU  17          HB2       GLU  17   1.741  -5.034   4.883
  122   2HB   GLU  17          HB1       GLU  17   1.246  -6.615   4.291
  123   1HG   GLU  17          HG2       GLU  17   3.650  -5.006   3.619
  124   2HG   GLU  17          HG1       GLU  17   3.462  -6.748   3.741
  125    H    ASN  18           H        ASN  18   0.271  -3.193   4.750
  126    HA   ASN  18           HA       ASN  18  -2.071  -4.083   6.051
  127   1HB   ASN  18          HB2       ASN  18  -1.324  -2.382   7.343
  128   2HB   ASN  18          HB1       ASN  18  -0.372  -1.737   6.019
  129   1HD2  ASN  18          HD21      ASN  18  -2.000  -0.801   4.223
  130   2HD2  ASN  18          HD22      ASN  18  -3.144   0.281   4.835
  131    H    TYR  19           H        TYR  19  -1.596  -2.606   2.967
  132    HA   TYR  19           HA       TYR  19  -4.490  -1.989   2.704
  133   1HB   TYR  19          HB2       TYR  19  -2.136  -1.441   0.866
  134   2HB   TYR  19          HB1       TYR  19  -3.809  -0.995   0.509
  135    HD1  TYR  19           HD1      TYR  19  -0.795   0.057   2.070
  136    HD2  TYR  19           HD2      TYR  19  -5.070   0.318   2.384
  137    HE1  TYR  19           HE1      TYR  19  -0.565   2.047   3.524
  138    HE2  TYR  19           HE2      TYR  19  -4.848   2.308   3.835
  139    HH   TYR  19           HH       TYR  19  -2.785   4.207   4.040
  140    H    CYS  20           H        CYS  20  -2.290  -4.475   2.133
  141    HA   CYS  20           HA       CYS  20  -3.417  -5.615  -0.260
  142   1HB   CYS  20          HB2       CYS  20  -1.752  -6.619   2.031
  143   2HB   CYS  20          HB1       CYS  20  -2.295  -7.696   0.794
  144    H    ASN  21           H        ASN  21  -4.027  -8.290   0.745
  145    HA   ASN  21           HA       ASN  21  -6.465  -7.691   2.380
  146   1HB   ASN  21          HB2       ASN  21  -6.684  -8.406  -0.172
  147   2HB   ASN  21          HB1       ASN  21  -6.436 -10.017   0.502
  148   1HD2  ASN  21          HD21      ASN  21  -8.718  -7.372   0.251
  149   2HD2  ASN  21          HD22      ASN  21  -9.973  -8.119   1.114
  150   1H    PHE   1           HT1      PHE   1  11.453  -4.507  -0.658
  151   2H    PHE   1           HT2      PHE   1  10.215  -3.417  -0.256
  152   3H    PHE   1           HT3      PHE   1  11.558  -3.594   0.769
  153    HA   PHE   1           HA       PHE   1  12.918  -2.862  -1.281
  154   1HB   PHE   1          HB2       PHE   1  10.539  -1.219  -1.952
  155   2HB   PHE   1          HB1       PHE   1  11.797  -1.858  -3.006
  156    HD1  PHE   1           HD1      PHE   1   8.423  -2.012  -2.478
  157    HD2  PHE   1           HD2      PHE   1  11.789  -4.661  -2.832
  158    HE1  PHE   1           HE1      PHE   1   6.907  -3.848  -3.170
  159    HE2  PHE   1           HE2      PHE   1  10.271  -6.496  -3.524
  160    HZ   PHE   1           HZ       PHE   1   7.829  -6.089  -3.695
  161    H    VAL   2           H        VAL   2  12.842  -0.188  -1.533
  162    HA   VAL   2           HA       VAL   2  12.413   0.841   1.248
  163    HB   VAL   2           HB       VAL   2  14.396   2.448   0.423
  164   1HG1  VAL   2          HG11      VAL   2  14.377   0.937   2.423
  165   2HG1  VAL   2          HG12      VAL   2  15.952   1.019   1.633
  166   3HG1  VAL   2          HG13      VAL   2  14.914  -0.384   1.383
  167   1HG2  VAL   2          HG21      VAL   2  14.308   0.960  -1.786
  168   2HG2  VAL   2          HG22      VAL   2  15.332  -0.109  -0.828
  169   3HG2  VAL   2          HG23      VAL   2  15.845   1.547  -1.151
  170    H    ASN   3           H        ASN   3  13.524   2.639  -1.604
  171    HA   ASN   3           HA       ASN   3  11.773   4.810  -1.292
  172   1HB   ASN   3          HB2       ASN   3  12.621   3.708  -3.986
  173   2HB   ASN   3          HB1       ASN   3  12.260   5.385  -3.580
  174   1HD2  ASN   3          HD21      ASN   3  14.855   3.498  -4.250
  175   2HD2  ASN   3          HD22      ASN   3  16.024   4.225  -3.258
  176    H    GLN   4           H        GLN   4   9.676   4.072  -0.724
  177    HA   GLN   4           HA       GLN   4   8.272   2.333  -2.651
  178   1HB   GLN   4          HB2       GLN   4   8.029   1.887  -0.235
  179   2HB   GLN   4          HB1       GLN   4   7.326   3.490  -0.015
  180   1HG   GLN   4          HG2       GLN   4   5.334   2.489  -0.399
  181   2HG   GLN   4          HG1       GLN   4   5.824   2.448  -2.091
  182   1HE2  GLN   4          HE21      GLN   4   6.433   0.401  -2.995
  183   2HE2  GLN   4          HE22      GLN   4   6.316  -1.056  -2.132
  184    H    HIS   5           H        HIS   5   8.361   4.061  -4.324
  185    HA   HIS   5           HA       HIS   5   6.359   6.234  -3.912
  186   1HB   HIS   5          HB2       HIS   5   8.321   5.778  -6.189
  187   2HB   HIS   5          HB1       HIS   5   7.245   7.164  -6.029
  188    HD2  HIS   5           HD2      HIS   5  10.052   5.591  -3.663
  189    HE1  HIS   5           HE1      HIS   5  10.265   9.814  -3.558
  190    HE2  HIS   5           HE2      HIS   5  11.318   7.654  -2.703
  191    H    LEU   6           H        LEU   6   4.482   4.958  -4.099
  192    HA   LEU   6           HA       LEU   6   4.143   3.563  -6.719
  193   1HB   LEU   6          HB2       LEU   6   3.028   3.080  -3.981
  194   2HB   LEU   6          HB1       LEU   6   2.225   2.475  -5.418
  195    HG   LEU   6           HG       LEU   6   3.885   0.921  -5.854
  196   1HD1  LEU   6          HD11      LEU   6   5.701   2.507  -6.187
  197   2HD1  LEU   6          HD12      LEU   6   6.263   1.229  -5.111
  198   3HD1  LEU   6          HD13      LEU   6   5.811   2.800  -4.452
  199   1HD2  LEU   6          HD21      LEU   6   3.005   0.602  -3.505
  200   2HD2  LEU   6          HD22      LEU   6   4.456   1.418  -2.923
  201   3HD2  LEU   6          HD23      LEU   6   4.593  -0.110  -3.793
  202    H    CYS   7           H        CYS   7   2.746   4.503  -8.102
  203    HA   CYS   7           HA       CYS   7   0.406   5.906  -6.946
  204   1HB   CYS   7          HB2       CYS   7   1.392   7.182  -9.395
  205   2HB   CYS   7          HB1       CYS   7   0.835   7.920  -7.902
  206    H    GLY   8           H        GLY   8  -1.445   5.211  -7.958
  207   1HA   GLY   8          HA2       GLY   8  -2.808   4.059  -9.481
  208   2HA   GLY   8          HA1       GLY   8  -1.784   4.777 -10.724
  209    H    SER   9           H        SER   9  -0.899   3.256 -12.029
  210    HA   SER   9           HA       SER   9  -0.939   0.480 -11.563
  211   1HB   SER   9          HB2       SER   9   1.350   1.133 -13.172
  212   2HB   SER   9          HB1       SER   9  -0.195   0.457 -13.676
  213    HG   SER   9           HG       SER   9  -0.981   2.476 -13.984
  214    H    ASP  10           H        ASP  10   1.919   2.648 -11.231
  215    HA   ASP  10           HA       ASP  10   3.753   0.800 -10.242
  216   1HB   ASP  10          HB2       ASP  10   3.281   3.708  -9.741
  217   2HB   ASP  10          HB1       ASP  10   4.369   2.868  -8.636
  218    H    LEU  11           H        LEU  11   0.946   2.161  -8.666
  219    HA   LEU  11           HA       LEU  11   1.603   1.060  -6.038
  220   1HB   LEU  11          HB2       LEU  11   0.153   3.122  -6.490
  221   2HB   LEU  11          HB1       LEU  11  -1.097   2.004  -7.025
  222    HG   LEU  11           HG       LEU  11  -1.152   0.945  -4.824
  223   1HD1  LEU  11          HD11      LEU  11   1.009   2.943  -4.104
  224   2HD1  LEU  11          HD12      LEU  11   1.230   1.197  -4.232
  225   3HD1  LEU  11          HD13      LEU  11   0.193   1.866  -2.973
  226   1HD2  LEU  11          HD21      LEU  11  -2.631   2.635  -4.548
  227   2HD2  LEU  11          HD22      LEU  11  -1.522   3.829  -5.224
  228   3HD2  LEU  11          HD23      LEU  11  -1.377   3.347  -3.534
  229    H    THR  12           H        THR  12  -0.750   0.297  -8.615
  230    HA   THR  12           HA       THR  12  -1.723  -2.099  -7.402
  231    HB   THR  12           HB       THR  12  -1.405  -1.484 -10.359
  232    HG1  THR  12           HG1      THR  12  -3.224  -0.407 -10.195
  233   1HG2  THR  12          HG21      THR  12  -3.664  -3.047  -9.973
  234   2HG2  THR  12          HG22      THR  12  -2.486  -3.751  -8.864
  235   3HG2  THR  12          HG23      THR  12  -2.109  -3.616 -10.582
  236    H    GLU  13           H        GLU  13   0.769  -1.634  -9.921
  237    HA   GLU  13           HA       GLU  13   1.722  -4.217 -10.197
  238   1HB   GLU  13          HB2       GLU  13   2.782  -1.550 -10.581
  239   2HB   GLU  13          HB1       GLU  13   4.049  -2.634 -10.010
  240   1HG   GLU  13          HG2       GLU  13   2.720  -4.199 -11.857
  241   2HG   GLU  13          HG1       GLU  13   2.643  -2.597 -12.591
  242    H    ALA  14           H        ALA  14   2.981  -1.893  -7.759
  243    HA   ALA  14           HA       ALA  14   4.513  -3.865  -6.352
  244   1HB   ALA  14          HB1       ALA  14   3.284  -1.404  -5.091
  245   2HB   ALA  14          HB2       ALA  14   4.690  -1.315  -6.152
  246   3HB   ALA  14          HB3       ALA  14   4.781  -2.220  -4.642
  247    H    LEU  15           H        LEU  15   1.360  -2.385  -5.515
  248    HA   LEU  15           HA       LEU  15   0.677  -3.956  -3.306
  249   1HB   LEU  15          HB2       LEU  15  -0.826  -2.562  -5.448
  250   2HB   LEU  15          HB1       LEU  15  -1.713  -3.824  -4.605
  251    HG   LEU  15           HG       LEU  15  -0.222  -1.583  -3.222
  252   1HD1  LEU  15          HD11      LEU  15  -2.188  -0.364  -3.115
  253   2HD1  LEU  15          HD12      LEU  15  -3.206  -1.795  -3.272
  254   3HD1  LEU  15          HD13      LEU  15  -2.395  -1.131  -4.689
  255   1HD2  LEU  15          HD21      LEU  15  -1.940  -2.445  -1.394
  256   2HD2  LEU  15          HD22      LEU  15  -0.400  -3.270  -1.630
  257   3HD2  LEU  15          HD23      LEU  15  -1.872  -3.929  -2.345
  258    H    TYR  16           H        TYR  16  -0.015  -4.660  -6.716
  259    HA   TYR  16           HA       TYR  16  -1.204  -7.154  -6.532
  260   1HB   TYR  16          HB2       TYR  16  -0.279  -5.624  -8.566
  261   2HB   TYR  16          HB1       TYR  16   0.934  -6.896  -8.577
  262    HD1  TYR  16           HD1      TYR  16  -2.041  -5.957 -10.020
  263    HD2  TYR  16           HD2      TYR  16  -0.228  -9.351  -8.113
  264    HE1  TYR  16           HE1      TYR  16  -3.633  -7.457 -11.186
  265    HE2  TYR  16           HE2      TYR  16  -1.817 -10.857  -9.280
  266    HH   TYR  16           HH       TYR  16  -3.211 -10.815 -11.347
  267    H    LEU  17           H        LEU  17   2.249  -6.386  -6.234
  268    HA   LEU  17           HA       LEU  17   2.944  -9.233  -6.045
  269   1HB   LEU  17          HB2       LEU  17   4.336  -7.202  -7.035
  270   2HB   LEU  17          HB1       LEU  17   4.892  -7.072  -5.365
  271    HG   LEU  17           HG       LEU  17   5.002  -9.582  -7.072
  272   1HD1  LEU  17          HD11      LEU  17   6.628  -7.593  -7.506
  273   2HD1  LEU  17          HD12      LEU  17   7.309  -9.207  -7.309
  274   3HD1  LEU  17          HD13      LEU  17   7.355  -8.061  -5.970
  275   1HD2  LEU  17          HD21      LEU  17   4.817 -10.407  -4.899
  276   2HD2  LEU  17          HD22      LEU  17   5.585  -8.987  -4.187
  277   3HD2  LEU  17          HD23      LEU  17   6.563 -10.191  -5.026
  278    H    VAL  18           H        VAL  18   3.428  -6.415  -3.849
  279    HA   VAL  18           HA       VAL  18   4.340  -7.659  -1.584
  280    HB   VAL  18           HB       VAL  18   2.367  -6.130  -0.432
  281   1HG1  VAL  18          HG11      VAL  18   4.173  -4.273  -0.674
  282   2HG1  VAL  18          HG12      VAL  18   5.116  -5.532  -1.472
  283   3HG1  VAL  18          HG13      VAL  18   4.584  -5.753   0.194
  284   1HG2  VAL  18          HG21      VAL  18   1.804  -4.315  -1.780
  285   2HG2  VAL  18          HG22      VAL  18   1.745  -5.647  -2.931
  286   3HG2  VAL  18          HG23      VAL  18   3.153  -4.591  -2.883
  287    H    CYS  19           H        CYS  19   0.998  -7.667  -2.660
  288    HA   CYS  19           HA       CYS  19   0.271  -9.534  -0.479
  289   1HB   CYS  19          HB2       CYS  19  -1.725  -9.095  -2.595
  290   2HB   CYS  19          HB1       CYS  19  -1.881  -8.923  -0.859
  291    H    GLY  20           H        GLY  20  -0.331  -9.515  -3.979
  292   1HA   GLY  20          HA2       GLY  20   0.140 -11.207  -5.578
  293   2HA   GLY  20          HA1       GLY  20   0.895 -12.161  -4.296
  294    H    GLU  21           H        GLU  21  -0.219 -14.000  -3.857
  295    HA   GLU  21           HA       GLU  21  -2.880 -14.460  -4.798
  296   1HB   GLU  21          HB2       GLU  21  -1.419 -15.875  -2.543
  297   2HB   GLU  21          HB1       GLU  21  -2.817 -16.495  -3.424
  298   1HG   GLU  21          HG2       GLU  21  -1.595 -16.879  -5.368
  299   2HG   GLU  21          HG1       GLU  21  -0.373 -15.674  -4.957
  300    H    ARG  22           H        ARG  22  -1.627 -12.808  -2.077
  301    HA   ARG  22           HA       ARG  22  -3.956 -13.074  -0.373
  302   1HB   ARG  22          HB2       ARG  22  -1.923 -10.828  -0.379
  303   2HB   ARG  22          HB1       ARG  22  -2.945 -11.341   0.965
  304   1HG   ARG  22          HG2       ARG  22  -0.790 -13.031  -0.341
  305   2HG   ARG  22          HG1       ARG  22  -0.636 -12.202   1.209
  306   1HD   ARG  22          HD2       ARG  22  -1.760 -13.831   2.288
  307   2HD   ARG  22          HD1       ARG  22  -3.062 -13.807   1.097
  308    HE   ARG  22           HE       ARG  22  -0.962 -15.121  -0.180
  309   1HH1  ARG  22          HH21      ARG  22  -3.669 -15.881   1.532
  310   2HH1  ARG  22          HH22      ARG  22  -3.118 -17.412   2.125
  311   1HH2  ARG  22          HH11      ARG  22   0.164 -16.922   1.109
  312   2HH2  ARG  22          HH12      ARG  22  -0.946 -18.002   1.885
  313    H    GLY  23           H        GLY  23  -3.221 -11.341  -3.220
  314   1HA   GLY  23          HA2       GLY  23  -4.418  -9.725  -4.421
  315   2HA   GLY  23          HA1       GLY  23  -5.831 -10.285  -3.529
  316    H    PHE  24           H        PHE  24  -4.860  -7.520  -4.291
  317    HA   PHE  24           HA       PHE  24  -4.671  -6.309  -1.551
  318   1HB   PHE  24          HB2       PHE  24  -3.994  -4.239  -2.830
  319   2HB   PHE  24          HB1       PHE  24  -2.878  -5.573  -3.023
  320    HD1  PHE  24           HD1      PHE  24  -5.246  -3.382  -4.693
  321    HD2  PHE  24           HD2      PHE  24  -2.896  -6.955  -5.111
  322    HE1  PHE  24           HE1      PHE  24  -5.552  -3.293  -7.150
  323    HE2  PHE  24           HE2      PHE  24  -3.202  -6.867  -7.571
  324    HZ   PHE  24           HZ       PHE  24  -4.529  -5.035  -8.592
  325    H    PHE  25           H        PHE  25  -6.455  -5.025  -0.880
  326    HA   PHE  25           HA       PHE  25  -8.767  -5.021  -2.727
  327   1HB   PHE  25          HB2       PHE  25 -10.120  -4.873  -0.879
  328   2HB   PHE  25          HB1       PHE  25  -8.699  -5.555  -0.102
  329    HD1  PHE  25           HD1      PHE  25 -11.132  -3.156   0.298
  330    HD2  PHE  25           HD2      PHE  25  -6.864  -3.562   0.448
  331    HE1  PHE  25           HE1      PHE  25 -10.998  -1.173   1.783
  332    HE2  PHE  25           HE2      PHE  25  -6.722  -1.581   1.934
  333    HZ   PHE  25           HZ       PHE  25  -8.792  -0.385   2.602
  334    H    TYR  26           H        TYR  26  -6.682  -3.362  -3.542
  335    HA   TYR  26           HA       TYR  26  -6.688  -0.676  -2.812
  336   1HB   TYR  26          HB2       TYR  26  -5.168  -1.404  -4.503
  337   2HB   TYR  26          HB1       TYR  26  -6.472  -1.983  -5.529
  338    HD1  TYR  26           HD1      TYR  26  -5.572   1.216  -3.772
  339    HD2  TYR  26           HD2      TYR  26  -6.926  -0.680  -7.382
  340    HE1  TYR  26           HE1      TYR  26  -5.657   3.424  -4.901
  341    HE2  TYR  26           HE2      TYR  26  -7.008   1.523  -8.514
  342    HH   TYR  26           HH       TYR  26  -7.301   4.133  -7.432
  343    H    THR  27           H        THR  27  -7.903   1.174  -3.627
  344    HA   THR  27           HA       THR  27 -10.756   0.591  -3.791
  345    HB   THR  27           HB       THR  27 -11.081   2.929  -3.571
  346    HG1  THR  27           HG1      THR  27  -9.768   4.355  -4.423
  347   1HG2  THR  27          HG21      THR  27  -8.397   2.571  -2.245
  348   2HG2  THR  27          HG22      THR  27  -9.826   1.711  -1.675
  349   3HG2  THR  27          HG23      THR  27  -9.796   3.474  -1.662
  350    H    LYS  28           H        LYS  28 -10.726  -0.611  -5.824
  351    HA   LYS  28           HA       LYS  28 -11.018   1.217  -8.138
  352   1HB   LYS  28          HB2       LYS  28  -8.661   0.272  -8.134
  353   2HB   LYS  28          HB1       LYS  28  -9.382  -1.324  -8.346
  354   1HG   LYS  28          HG2       LYS  28 -10.680  -0.105 -10.313
  355   2HG   LYS  28          HG1       LYS  28  -9.293   0.984 -10.249
  356   1HD   LYS  28          HD2       LYS  28  -7.827  -1.109 -10.332
  357   2HD   LYS  28          HD1       LYS  28  -9.290  -1.996 -10.759
  358   1HE   LYS  28          HE2       LYS  28  -8.740  -1.438 -12.894
  359   2HE   LYS  28          HE1       LYS  28  -9.432   0.130 -12.476
  360   1HZ   LYS  28          HZ1       LYS  28  -7.437   1.089 -12.473
  361   2HZ   LYS  28          HZ2       LYS  28  -6.899  -0.283 -13.315
  362   3HZ   LYS  28          HZ3       LYS  28  -6.706  -0.187 -11.630
  363    HA   PRO  29           HA       PRO  29 -14.141  -2.224  -7.773
  364   1HB   PRO  29          HB2       PRO  29 -16.293  -0.622  -7.181
  365   2HB   PRO  29          HB1       PRO  29 -15.245  -1.349  -5.951
  366   1HG   PRO  29          HG2       PRO  29 -15.376   1.483  -6.865
  367   2HG   PRO  29          HG1       PRO  29 -14.839   0.831  -5.308
  368   1HD   PRO  29          HD2       PRO  29 -13.162   1.719  -7.419
  369   2HD   PRO  29          HD1       PRO  29 -12.652   0.802  -5.985
  370    H    THR  30           H        THR  30 -15.715  -2.692  -9.416
  371    HA   THR  30           HA       THR  30 -15.895  -0.629 -11.578
  372    HB   THR  30           HB       THR  30 -16.369  -3.508 -12.191
  373    HG1  THR  30           HG1      THR  30 -13.885  -3.331 -12.549
  374   1HG2  THR  30          HG21      THR  30 -14.585  -2.247 -13.978
  375   2HG2  THR  30          HG22      THR  30 -15.790  -1.031 -13.556
  376   3HG2  THR  30          HG23      THR  30 -16.298  -2.577 -14.236
  Start of MODEL    8
    1   1H    GLY   1           HT1      GLY   1  -7.491   9.211  -1.566
    2   2H    GLY   1           HT2      GLY   1  -8.399   8.132  -2.513
    3   3H    GLY   1           HT3      GLY   1  -6.728   8.294  -2.774
    4   1HA   GLY   1          HA1       GLY   1  -7.394   7.478  -0.130
    5   2HA   GLY   1          HA2       GLY   1  -7.868   6.266  -1.360
    6    H    ILE   2           H        ILE   2  -5.677   5.207  -1.425
    7    HA   ILE   2           HA       ILE   2  -3.606   6.279   0.429
    8    HB   ILE   2           HB       ILE   2  -4.118   4.112   1.140
    9   1HG1  ILE   2          HG12      ILE   2  -1.635   4.531   0.289
   10   2HG1  ILE   2          HG11      ILE   2  -2.123   2.949   0.877
   11   1HG2  ILE   2          HG21      ILE   2  -4.229   2.236  -0.716
   12   2HG2  ILE   2          HG22      ILE   2  -4.585   3.602  -1.773
   13   3HG2  ILE   2          HG23      ILE   2  -5.629   3.258  -0.395
   14   1HD1  ILE   2          HD11      ILE   2  -2.196   2.021  -1.250
   15   2HD1  ILE   2          HD12      ILE   2  -0.871   3.169  -1.434
   16   3HD1  ILE   2          HD13      ILE   2  -2.480   3.576  -2.030
   17    H    VAL   3           H        VAL   3  -4.331   5.972  -2.859
   18    HA   VAL   3           HA       VAL   3  -1.908   5.307  -4.087
   19    HB   VAL   3           HB       VAL   3  -3.953   7.401  -4.848
   20   1HG1  VAL   3          HG11      VAL   3  -2.504   6.568  -7.120
   21   2HG1  VAL   3          HG12      VAL   3  -1.292   6.945  -5.895
   22   3HG1  VAL   3          HG13      VAL   3  -2.473   8.164  -6.368
   23   1HG2  VAL   3          HG21      VAL   3  -5.095   5.535  -5.421
   24   2HG2  VAL   3          HG22      VAL   3  -3.695   4.509  -5.114
   25   3HG2  VAL   3          HG23      VAL   3  -3.887   5.290  -6.684
   26    H    GLU   4           H        GLU   4  -2.838   8.732  -3.802
   27    HA   GLU   4           HA       GLU   4  -0.224   9.700  -4.020
   28   1HB   GLU   4          HB2       GLU   4  -1.105  11.800  -3.360
   29   2HB   GLU   4          HB1       GLU   4  -2.450  10.979  -4.138
   30   1HG   GLU   4          HG2       GLU   4  -3.279  10.255  -1.923
   31   2HG   GLU   4          HG1       GLU   4  -1.947  11.116  -1.151
   32    H    GLN   5           H        GLN   5  -1.991   8.608  -1.165
   33    HA   GLN   5           HA       GLN   5  -0.268   9.596   0.843
   34   1HB   GLN   5          HB2       GLN   5  -2.475   8.184   1.003
   35   2HB   GLN   5          HB1       GLN   5  -1.375   6.806   1.016
   36   1HG   GLN   5          HG2       GLN   5  -0.859   7.185   3.172
   37   2HG   GLN   5          HG1       GLN   5  -0.397   8.847   2.804
   38   1HE2  GLN   5          HE21      GLN   5  -3.498   6.988   2.984
   39   2HE2  GLN   5          HE22      GLN   5  -4.328   8.183   3.856
   40    H    CYS   6           H        CYS   6   0.056   6.791  -1.290
   41    HA   CYS   6           HA       CYS   6   2.728   6.265  -0.081
   42   1HB   CYS   6          HB2       CYS   6   1.088   4.511  -1.937
   43   2HB   CYS   6          HB1       CYS   6   2.613   4.072  -1.168
   44    H    CYS   7           H        CYS   7   1.329   7.884  -2.667
   45    HA   CYS   7           HA       CYS   7   3.641   7.350  -4.470
   46   1HB   CYS   7          HB2       CYS   7   1.379   7.358  -5.516
   47   2HB   CYS   7          HB1       CYS   7   1.137   9.004  -4.951
   48    H    THR   8           H        THR   8   1.859  10.424  -3.963
   49    HA   THR   8           HA       THR   8   4.022  12.166  -4.235
   50    HB   THR   8           HB       THR   8   2.477  13.098  -2.001
   51    HG1  THR   8           HG1      THR   8   0.785  12.322  -4.089
   52   1HG2  THR   8          HG21      THR   8   3.361  13.980  -4.497
   53   2HG2  THR   8          HG22      THR   8   2.421  14.914  -3.334
   54   3HG2  THR   8          HG23      THR   8   1.602  14.024  -4.618
   55    H    SER   9           H        SER   9   3.115  10.093  -1.628
   56    HA   SER   9           HA       SER   9   5.623  10.766  -0.150
   57   1HB   SER   9          HB2       SER   9   2.987  10.734   0.828
   58   2HB   SER   9          HB1       SER   9   3.649   9.181   1.330
   59    HG   SER   9           HG       SER   9   4.345  10.489   2.892
   60    H    ILE  10           H        ILE  10   6.134   8.460   1.167
   61    HA   ILE  10           HA       ILE  10   5.810   6.365  -0.945
   62    HB   ILE  10           HB       ILE  10   8.225   6.877   0.820
   63   1HG1  ILE  10          HG12      ILE  10   9.370   7.159  -1.360
   64   2HG1  ILE  10          HG11      ILE  10   7.835   6.930  -2.192
   65   1HG2  ILE  10          HG21      ILE  10   8.762   4.941  -1.148
   66   2HG2  ILE  10          HG22      ILE  10   7.209   4.484  -0.456
   67   3HG2  ILE  10          HG23      ILE  10   8.612   4.670   0.586
   68   1HD1  ILE  10          HD11      ILE  10   8.852   9.367  -1.456
   69   2HD1  ILE  10          HD12      ILE  10   7.783   9.011  -0.101
   70   3HD1  ILE  10          HD13      ILE  10   7.142   9.050  -1.743
   71    H    CYS  11           H        CYS  11   5.440   4.223  -0.197
   72    HA   CYS  11           HA       CYS  11   4.758   4.106   2.722
   73   1HB   CYS  11          HB2       CYS  11   3.425   2.932   0.302
   74   2HB   CYS  11          HB1       CYS  11   3.282   2.107   1.850
   75    H    SER  12           H        SER  12   5.398   2.260   3.886
   76    HA   SER  12           HA       SER  12   7.723   0.866   2.777
   77   1HB   SER  12          HB2       SER  12   8.022  -0.022   4.980
   78   2HB   SER  12          HB1       SER  12   7.484   1.641   5.200
   79    HG   SER  12           HG       SER  12   6.256   0.331   6.521
   80    H    LEU  13           H        LEU  13   7.796  -1.603   3.098
   81    HA   LEU  13           HA       LEU  13   5.770  -2.817   1.498
   82   1HB   LEU  13          HB2       LEU  13   8.098  -3.736   3.090
   83   2HB   LEU  13          HB1       LEU  13   6.842  -4.943   2.813
   84    HG   LEU  13           HG       LEU  13   8.632  -4.854   1.025
   85   1HD1  LEU  13          HD11      LEU  13   6.399  -5.810   0.600
   86   2HD1  LEU  13          HD12      LEU  13   7.005  -4.976  -0.831
   87   3HD1  LEU  13          HD13      LEU  13   5.789  -4.209   0.187
   88   1HD2  LEU  13          HD21      LEU  13   8.821  -2.996  -0.401
   89   2HD2  LEU  13          HD22      LEU  13   8.602  -2.237   1.176
   90   3HD2  LEU  13          HD23      LEU  13   7.242  -2.362   0.059
   91    H    TYR  14           H        TYR  14   6.125  -2.487   5.001
   92    HA   TYR  14           HA       TYR  14   4.065  -4.351   5.714
   93   1HB   TYR  14          HB2       TYR  14   5.740  -3.397   7.318
   94   2HB   TYR  14          HB1       TYR  14   4.910  -1.846   7.208
   95    HD1  TYR  14           HD1      TYR  14   4.191  -5.470   7.898
   96    HD2  TYR  14           HD2      TYR  14   3.199  -1.369   8.720
   97    HE1  TYR  14           HE1      TYR  14   2.572  -6.208   9.631
   98    HE2  TYR  14           HE2      TYR  14   1.581  -2.108  10.452
   99    HH   TYR  14           HH       TYR  14   1.028  -5.575  11.089
  100    H    GLN  15           H        GLN  15   4.034  -0.939   4.805
  101    HA   GLN  15           HA       GLN  15   1.252  -0.531   5.482
  102   1HB   GLN  15          HB2       GLN  15   3.089   0.971   3.579
  103   2HB   GLN  15          HB1       GLN  15   1.502   1.540   4.088
  104   1HG   GLN  15          HG2       GLN  15   2.855   0.853   6.463
  105   2HG   GLN  15          HG1       GLN  15   4.033   1.724   5.482
  106   1HE2  GLN  15          HE21      GLN  15   0.633   2.002   6.646
  107   2HE2  GLN  15          HE22      GLN  15   0.637   3.698   6.704
  108    H    LEU  16           H        LEU  16   2.806  -0.760   2.229
  109    HA   LEU  16           HA       LEU  16   0.473  -0.981   0.719
  110   1HB   LEU  16          HB2       LEU  16   3.174  -2.273   0.447
  111   2HB   LEU  16          HB1       LEU  16   1.892  -2.703  -0.673
  112    HG   LEU  16           HG       LEU  16   2.367  -0.854  -1.884
  113   1HD1  LEU  16          HD11      LEU  16   2.061   1.441  -0.849
  114   2HD1  LEU  16          HD12      LEU  16   1.733   0.630   0.681
  115   3HD1  LEU  16          HD13      LEU  16   0.666   0.372  -0.699
  116   1HD2  LEU  16          HD21      LEU  16   4.485  -1.014   0.004
  117   2HD2  LEU  16          HD22      LEU  16   4.090   0.693  -0.213
  118   3HD2  LEU  16          HD23      LEU  16   4.514  -0.299  -1.608
  119    H    GLU  17           H        GLU  17   1.855  -3.218   2.977
  120    HA   GLU  17           HA       GLU  17   0.232  -5.529   2.223
  121   1HB   GLU  17          HB2       GLU  17   1.839  -4.817   4.685
  122   2HB   GLU  17          HB1       GLU  17   0.899  -6.301   4.570
  123   1HG   GLU  17          HG2       GLU  17   3.002  -5.506   2.548
  124   2HG   GLU  17          HG1       GLU  17   3.333  -6.541   3.938
  125    H    ASN  18           H        ASN  18   0.156  -2.981   4.632
  126    HA   ASN  18           HA       ASN  18  -2.071  -3.729   6.133
  127   1HB   ASN  18          HB2       ASN  18  -1.732  -1.698   7.094
  128   2HB   ASN  18          HB1       ASN  18  -0.351  -1.598   6.026
  129   1HD2  ASN  18          HD21      ASN  18  -1.332  -0.953   3.595
  130   2HD2  ASN  18          HD22      ASN  18  -2.195   0.500   3.671
  131    H    TYR  19           H        TYR  19  -1.945  -2.535   2.847
  132    HA   TYR  19           HA       TYR  19  -4.916  -2.366   2.840
  133   1HB   TYR  19          HB2       TYR  19  -2.848  -1.255   0.946
  134   2HB   TYR  19          HB1       TYR  19  -4.587  -1.175   0.650
  135    HD1  TYR  19           HD1      TYR  19  -2.948   1.297   0.896
  136    HD2  TYR  19           HD2      TYR  19  -4.892  -1.054   3.925
  137    HE1  TYR  19           HE1      TYR  19  -3.050   3.271   2.395
  138    HE2  TYR  19           HE2      TYR  19  -4.992   0.904   5.403
  139    HH   TYR  19           HH       TYR  19  -4.651   3.983   4.401
  140    H    CYS  20           H        CYS  20  -2.498  -4.543   2.050
  141    HA   CYS  20           HA       CYS  20  -3.466  -5.552  -0.440
  142   1HB   CYS  20          HB2       CYS  20  -1.984  -6.834   1.869
  143   2HB   CYS  20          HB1       CYS  20  -2.352  -7.682   0.388
  144    H    ASN  21           H        ASN  21  -4.027  -8.364   0.543
  145    HA   ASN  21           HA       ASN  21  -6.869  -7.863   1.163
  146   1HB   ASN  21          HB2       ASN  21  -5.989  -9.615  -0.524
  147   2HB   ASN  21          HB1       ASN  21  -5.591 -10.583   0.897
  148   1HD2  ASN  21          HD21      ASN  21  -7.262 -11.867   1.695
  149   2HD2  ASN  21          HD22      ASN  21  -8.909 -11.639   1.355
  150   1H    PHE   1           HT1      PHE   1  13.264  -3.004  -1.272
  151   2H    PHE   1           HT2      PHE   1  12.541  -3.111  -2.806
  152   3H    PHE   1           HT3      PHE   1  12.946  -4.523  -1.954
  153    HA   PHE   1           HA       PHE   1  10.514  -3.267  -1.958
  154   1HB   PHE   1          HB2       PHE   1  11.827  -5.575  -0.809
  155   2HB   PHE   1          HB1       PHE   1  10.680  -4.894   0.344
  156    HD1  PHE   1           HD1      PHE   1  10.302  -4.543  -3.319
  157    HD2  PHE   1           HD2      PHE   1   9.061  -6.698   0.187
  158    HE1  PHE   1           HE1      PHE   1   8.425  -5.541  -4.598
  159    HE2  PHE   1           HE2      PHE   1   7.186  -7.697  -1.093
  160    HZ   PHE   1           HZ       PHE   1   6.867  -7.117  -3.485
  161    H    VAL   2           H        VAL   2  12.351  -1.248  -1.077
  162    HA   VAL   2           HA       VAL   2  11.062  -0.575   1.519
  163    HB   VAL   2           HB       VAL   2  13.331  -1.526   1.988
  164   1HG1  VAL   2          HG11      VAL   2  14.130  -0.398  -0.299
  165   2HG1  VAL   2          HG12      VAL   2  15.257  -0.685   1.027
  166   3HG1  VAL   2          HG13      VAL   2  14.562   0.920   0.790
  167   1HG2  VAL   2          HG21      VAL   2  14.125   0.948   2.911
  168   2HG2  VAL   2          HG22      VAL   2  12.976  -0.109   3.731
  169   3HG2  VAL   2          HG23      VAL   2  12.393   1.179   2.676
  170    H    ASN   3           H        ASN   3  10.678   1.669   1.748
  171    HA   ASN   3           HA       ASN   3  10.190   3.802   0.859
  172   1HB   ASN   3          HB2       ASN   3  13.033   3.359   0.863
  173   2HB   ASN   3          HB1       ASN   3  12.604   4.327  -0.549
  174   1HD2  ASN   3          HD21      ASN   3  13.934   5.130   2.095
  175   2HD2  ASN   3          HD22      ASN   3  12.981   6.412   2.668
  176    H    GLN   4           H        GLN   4   8.684   2.661  -0.680
  177    HA   GLN   4           HA       GLN   4   9.745   2.691  -3.470
  178   1HB   GLN   4          HB2       GLN   4   8.503   0.627  -2.236
  179   2HB   GLN   4          HB1       GLN   4   7.101   1.458  -2.909
  180   1HG   GLN   4          HG2       GLN   4   7.923  -0.167  -4.534
  181   2HG   GLN   4          HG1       GLN   4   8.216   1.464  -5.141
  182   1HE2  GLN   4          HE21      GLN   4  10.137   1.067  -6.354
  183   2HE2  GLN   4          HE22      GLN   4  11.578   0.505  -5.654
  184    H    HIS   5           H        HIS   5   8.871   4.066  -4.929
  185    HA   HIS   5           HA       HIS   5   6.856   6.015  -3.993
  186   1HB   HIS   5          HB2       HIS   5   7.860   6.107  -6.793
  187   2HB   HIS   5          HB1       HIS   5   7.657   7.418  -5.633
  188    HD2  HIS   5           HD2      HIS   5  10.571   6.364  -7.334
  189    HE1  HIS   5           HE1      HIS   5  11.908   6.158  -3.328
  190    HE2  HIS   5           HE2      HIS   5  12.645   6.209  -5.771
  191    H    LEU   6           H        LEU   6   5.081   4.483  -3.937
  192    HA   LEU   6           HA       LEU   6   4.253   3.120  -6.389
  193   1HB   LEU   6          HB2       LEU   6   2.884   3.556  -3.755
  194   2HB   LEU   6          HB1       LEU   6   2.243   2.573  -5.046
  195    HG   LEU   6           HG       LEU   6   3.306   0.898  -3.887
  196   1HD1  LEU   6          HD11      LEU   6   4.565   1.027  -5.976
  197   2HD1  LEU   6          HD12      LEU   6   5.632   0.551  -4.654
  198   3HD1  LEU   6          HD13      LEU   6   5.662   2.208  -5.259
  199   1HD2  LEU   6          HD21      LEU   6   5.314   2.947  -2.908
  200   2HD2  LEU   6          HD22      LEU   6   5.160   1.288  -2.333
  201   3HD2  LEU   6          HD23      LEU   6   3.868   2.450  -2.031
  202    H    CYS   7           H        CYS   7   2.553   3.709  -7.738
  203    HA   CYS   7           HA       CYS   7   0.811   5.938  -7.012
  204   1HB   CYS   7          HB2       CYS   7   2.457   6.212  -9.523
  205   2HB   CYS   7          HB1       CYS   7   1.390   7.413  -8.810
  206    H    GLY   8           H        GLY   8  -1.168   5.342  -7.762
  207   1HA   GLY   8          HA2       GLY   8  -2.757   4.030  -8.925
  208   2HA   GLY   8          HA1       GLY   8  -1.979   4.777 -10.321
  209    H    SER   9           H        SER   9  -0.886   3.442 -11.721
  210    HA   SER   9           HA       SER   9  -1.114   0.619 -11.521
  211   1HB   SER   9          HB2       SER   9   1.020   0.914 -13.195
  212   2HB   SER   9          HB1       SER   9  -0.659   1.098 -13.696
  213    HG   SER   9           HG       SER   9  -0.088   3.064 -14.167
  214    H    ASP  10           H        ASP  10   1.960   2.467 -11.331
  215    HA   ASP  10           HA       ASP  10   3.615   0.459 -10.367
  216   1HB   ASP  10          HB2       ASP  10   3.500   3.377  -9.546
  217   2HB   ASP  10          HB1       ASP  10   4.822   2.293  -9.103
  218    H    LEU  11           H        LEU  11   1.117   2.225  -8.646
  219    HA   LEU  11           HA       LEU  11   1.780   1.196  -6.019
  220   1HB   LEU  11          HB2       LEU  11   0.434   3.248  -6.342
  221   2HB   LEU  11          HB1       LEU  11  -0.824   2.298  -7.122
  222    HG   LEU  11           HG       LEU  11  -1.204   1.047  -5.048
  223   1HD1  LEU  11          HD11      LEU  11   1.163   1.197  -4.218
  224   2HD1  LEU  11          HD12      LEU  11  -0.034   1.624  -2.996
  225   3HD1  LEU  11          HD13      LEU  11   0.869   2.891  -3.826
  226   1HD2  LEU  11          HD21      LEU  11  -1.443   3.945  -5.315
  227   2HD2  LEU  11          HD22      LEU  11  -1.445   3.414  -3.634
  228   3HD2  LEU  11          HD23      LEU  11  -2.636   2.769  -4.764
  229    H    THR  12           H        THR  12  -0.626   0.320  -8.509
  230    HA   THR  12           HA       THR  12  -1.620  -1.988  -7.106
  231    HB   THR  12           HB       THR  12  -1.525  -1.288 -10.054
  232    HG1  THR  12           HG1      THR  12  -3.263  -0.264  -9.550
  233   1HG2  THR  12          HG21      THR  12  -3.191  -3.154 -10.304
  234   2HG2  THR  12          HG22      THR  12  -2.803  -3.649  -8.657
  235   3HG2  THR  12          HG23      THR  12  -1.562  -3.699  -9.909
  236    H    GLU  13           H        GLU  13   0.811  -1.600  -9.695
  237    HA   GLU  13           HA       GLU  13   1.696  -4.229  -9.958
  238   1HB   GLU  13          HB2       GLU  13   2.961  -1.556 -10.199
  239   2HB   GLU  13          HB1       GLU  13   4.075  -2.910 -10.007
  240   1HG   GLU  13          HG2       GLU  13   2.632  -4.059 -11.848
  241   2HG   GLU  13          HG1       GLU  13   2.062  -2.426 -12.195
  242    H    ALA  14           H        ALA  14   2.906  -1.824  -7.601
  243    HA   ALA  14           HA       ALA  14   4.541  -3.646  -6.134
  244   1HB   ALA  14          HB1       ALA  14   4.422  -1.984  -4.315
  245   2HB   ALA  14          HB2       ALA  14   3.068  -1.189  -5.120
  246   3HB   ALA  14          HB3       ALA  14   4.667  -1.179  -5.866
  247    H    LEU  15           H        LEU  15   1.338  -2.339  -5.174
  248    HA   LEU  15           HA       LEU  15   0.756  -4.095  -3.085
  249   1HB   LEU  15          HB2       LEU  15  -0.984  -2.840  -5.201
  250   2HB   LEU  15          HB1       LEU  15  -1.682  -3.937  -4.012
  251    HG   LEU  15           HG       LEU  15  -0.007  -1.526  -3.271
  252   1HD1  LEU  15          HD11      LEU  15  -2.705  -1.654  -4.247
  253   2HD1  LEU  15          HD12      LEU  15  -1.808  -0.243  -3.685
  254   3HD1  LEU  15          HD13      LEU  15  -2.737  -1.211  -2.540
  255   1HD2  LEU  15          HD21      LEU  15  -1.292  -3.744  -1.827
  256   2HD2  LEU  15          HD22      LEU  15  -1.713  -2.154  -1.190
  257   3HD2  LEU  15          HD23      LEU  15  -0.022  -2.644  -1.290
  258    H    TYR  16           H        TYR  16  -0.396  -4.595  -6.416
  259    HA   TYR  16           HA       TYR  16  -1.271  -7.190  -6.354
  260   1HB   TYR  16          HB2       TYR  16  -0.732  -5.457  -8.345
  261   2HB   TYR  16          HB1       TYR  16   0.607  -6.582  -8.581
  262    HD1  TYR  16           HD1      TYR  16  -2.863  -5.974  -9.154
  263    HD2  TYR  16           HD2      TYR  16   0.029  -9.108  -8.650
  264    HE1  TYR  16           HE1      TYR  16  -4.406  -7.568 -10.256
  265    HE2  TYR  16           HE2      TYR  16  -1.512 -10.708  -9.752
  266    HH   TYR  16           HH       TYR  16  -4.765  -9.692 -10.814
  267    H    LEU  17           H        LEU  17   2.080  -6.159  -6.040
  268    HA   LEU  17           HA       LEU  17   2.945  -9.004  -6.150
  269   1HB   LEU  17          HB2       LEU  17   4.092  -6.791  -7.259
  270   2HB   LEU  17          HB1       LEU  17   4.981  -6.908  -5.738
  271    HG   LEU  17           HG       LEU  17   4.708  -9.026  -7.891
  272   1HD1  LEU  17          HD11      LEU  17   6.503  -7.491  -8.345
  273   2HD1  LEU  17          HD12      LEU  17   7.238  -8.955  -7.689
  274   3HD1  LEU  17          HD13      LEU  17   7.043  -7.532  -6.665
  275   1HD2  LEU  17          HD21      LEU  17   4.566 -10.399  -6.038
  276   2HD2  LEU  17          HD22      LEU  17   5.394  -9.247  -4.989
  277   3HD2  LEU  17          HD23      LEU  17   6.319 -10.222  -6.131
  278    H    VAL  18           H        VAL  18   3.338  -6.111  -4.056
  279    HA   VAL  18           HA       VAL  18   4.760  -7.260  -1.957
  280    HB   VAL  18           HB       VAL  18   4.095  -5.513  -0.653
  281   1HG1  VAL  18          HG11      VAL  18   4.334  -4.815  -3.213
  282   2HG1  VAL  18          HG12      VAL  18   4.019  -3.643  -1.934
  283   3HG1  VAL  18          HG13      VAL  18   2.688  -4.262  -2.909
  284   1HG2  VAL  18          HG21      VAL  18   1.918  -4.651  -0.309
  285   2HG2  VAL  18          HG22      VAL  18   1.768  -6.406  -0.339
  286   3HG2  VAL  18          HG23      VAL  18   1.314  -5.455  -1.754
  287    H    CYS  19           H        CYS  19   1.418  -7.506  -2.706
  288    HA   CYS  19           HA       CYS  19   0.895  -9.384  -0.475
  289   1HB   CYS  19          HB2       CYS  19  -1.244  -9.065  -2.469
  290   2HB   CYS  19          HB1       CYS  19  -1.303  -8.854  -0.732
  291    H    GLY  20           H        GLY  20   0.066  -9.414  -3.937
  292   1HA   GLY  20          HA2       GLY  20   0.380 -11.094  -5.565
  293   2HA   GLY  20          HA1       GLY  20   1.488 -11.897  -4.450
  294    H    GLU  21           H        GLU  21   0.758 -13.888  -3.840
  295    HA   GLU  21           HA       GLU  21  -1.807 -14.910  -4.366
  296   1HB   GLU  21          HB2       GLU  21   0.054 -15.634  -2.076
  297   2HB   GLU  21          HB1       GLU  21  -1.303 -16.616  -2.629
  298   1HG   GLU  21          HG2       GLU  21  -0.281 -16.901  -4.814
  299   2HG   GLU  21          HG1       GLU  21   1.016 -15.783  -4.393
  300    H    ARG  22           H        ARG  22  -0.678 -12.850  -1.793
  301    HA   ARG  22           HA       ARG  22  -3.004 -13.168  -0.085
  302   1HB   ARG  22          HB2       ARG  22  -0.943 -10.948  -0.222
  303   2HB   ARG  22          HB1       ARG  22  -2.121 -11.164   1.072
  304   1HG   ARG  22          HG2       ARG  22  -0.248 -13.398   0.317
  305   2HG   ARG  22          HG1       ARG  22   0.271 -12.123   1.420
  306   1HD   ARG  22          HD2       ARG  22  -0.623 -13.580   2.966
  307   2HD   ARG  22          HD1       ARG  22  -2.087 -12.683   2.557
  308    HE   ARG  22           HE       ARG  22  -2.111 -14.710   0.712
  309   1HH1  ARG  22          HH21      ARG  22  -3.488 -14.368   3.598
  310   2HH1  ARG  22          HH22      ARG  22  -3.364 -16.013   4.128
  311   1HH2  ARG  22          HH11      ARG  22  -1.161 -16.936   1.619
  312   2HH2  ARG  22          HH12      ARG  22  -2.047 -17.463   3.011
  313    H    GLY  23           H        GLY  23  -2.657 -11.837  -3.103
  314   1HA   GLY  23          HA2       GLY  23  -3.865 -10.236  -4.326
  315   2HA   GLY  23          HA1       GLY  23  -5.218 -10.779  -3.335
  316    H    PHE  24           H        PHE  24  -5.543  -8.294  -3.904
  317    HA   PHE  24           HA       PHE  24  -5.019  -6.863  -1.393
  318   1HB   PHE  24          HB2       PHE  24  -3.988  -4.924  -2.440
  319   2HB   PHE  24          HB1       PHE  24  -3.025  -6.350  -2.796
  320    HD1  PHE  24           HD1      PHE  24  -4.079  -3.449  -4.223
  321    HD2  PHE  24           HD2      PHE  24  -4.169  -7.673  -5.021
  322    HE1  PHE  24           HE1      PHE  24  -4.292  -2.990  -6.651
  323    HE2  PHE  24           HE2      PHE  24  -4.385  -7.211  -7.442
  324    HZ   PHE  24           HZ       PHE  24  -4.449  -4.870  -8.260
  325    H    PHE  25           H        PHE  25  -6.198  -4.619  -1.558
  326    HA   PHE  25           HA       PHE  25  -8.594  -5.003  -3.295
  327   1HB   PHE  25          HB2       PHE  25 -10.031  -4.606  -1.547
  328   2HB   PHE  25          HB1       PHE  25  -8.693  -5.300  -0.639
  329    HD1  PHE  25           HD1      PHE  25 -11.006  -2.978  -0.194
  330    HD2  PHE  25           HD2      PHE  25  -6.727  -3.131  -0.552
  331    HE1  PHE  25           HE1      PHE  25 -10.825  -0.875   1.109
  332    HE2  PHE  25           HE2      PHE  25  -6.545  -1.026   0.751
  333    HZ   PHE  25           HZ       PHE  25  -8.593   0.101   1.584
  334    H    TYR  26           H        TYR  26  -6.242  -3.438  -3.967
  335    HA   TYR  26           HA       TYR  26  -6.296  -0.702  -3.515
  336   1HB   TYR  26          HB2       TYR  26  -4.649  -1.535  -5.024
  337   2HB   TYR  26          HB1       TYR  26  -5.867  -2.246  -6.076
  338    HD1  TYR  26           HD1      TYR  26  -5.619   1.172  -4.543
  339    HD2  TYR  26           HD2      TYR  26  -5.750  -1.176  -8.140
  340    HE1  TYR  26           HE1      TYR  26  -5.669   3.249  -5.902
  341    HE2  TYR  26           HE2      TYR  26  -5.801   0.899  -9.498
  342    HH   TYR  26           HH       TYR  26  -5.173   4.005  -8.116
  343    H    THR  27           H        THR  27  -8.136   0.528  -3.371
  344    HA   THR  27           HA       THR  27 -10.513  -0.123  -4.931
  345    HB   THR  27           HB       THR  27 -10.852   0.733  -2.710
  346    HG1  THR  27           HG1      THR  27 -12.317   1.471  -4.294
  347   1HG2  THR  27          HG21      THR  27  -9.359   2.170  -1.845
  348   2HG2  THR  27          HG22      THR  27 -10.018   3.434  -2.884
  349   3HG2  THR  27          HG23      THR  27  -8.663   2.450  -3.440
  350    H    LYS  28           H        LYS  28  -9.730   0.164  -7.109
  351    HA   LYS  28           HA       LYS  28 -10.440   2.478  -8.422
  352   1HB   LYS  28          HB2       LYS  28  -7.871   2.812  -7.036
  353   2HB   LYS  28          HB1       LYS  28  -7.801   3.201  -8.754
  354   1HG   LYS  28          HG2       LYS  28 -10.227   4.282  -7.674
  355   2HG   LYS  28          HG1       LYS  28  -8.879   4.790  -6.658
  356   1HD   LYS  28          HD2       LYS  28  -7.698   5.705  -8.553
  357   2HD   LYS  28          HD1       LYS  28  -8.871   5.019  -9.678
  358   1HE   LYS  28          HE2       LYS  28 -10.368   6.692  -9.325
  359   2HE   LYS  28          HE1       LYS  28 -10.059   6.725  -7.589
  360   1HZ   LYS  28          HZ1       LYS  28  -9.315   8.682  -9.152
  361   2HZ   LYS  28          HZ2       LYS  28  -7.954   7.690  -9.377
  362   3HZ   LYS  28          HZ3       LYS  28  -8.377   8.214  -7.818
  363    HA   PRO  29           HA       PRO  29  -8.700  -0.986 -10.954
  364   1HB   PRO  29          HB2       PRO  29 -11.110  -1.738 -12.042
  365   2HB   PRO  29          HB1       PRO  29 -10.461  -2.413 -10.537
  366   1HG   PRO  29          HG2       PRO  29 -12.670  -0.447 -10.913
  367   2HG   PRO  29          HG1       PRO  29 -12.400  -1.591  -9.587
  368   1HD   PRO  29          HD2       PRO  29 -11.845   1.187  -9.521
  369   2HD   PRO  29          HD1       PRO  29 -11.285  -0.019  -8.344
  370    H    THR  30           H        THR  30 -11.467   1.086 -11.942
  371    HA   THR  30           HA       THR  30  -9.928   1.723 -14.430
  372    HB   THR  30           HB       THR  30 -12.770   2.219 -14.683
  373    HG1  THR  30           HG1      THR  30 -12.123  -0.497 -14.352
  374   1HG2  THR  30          HG21      THR  30 -10.836   0.338 -16.064
  375   2HG2  THR  30          HG22      THR  30 -11.230   1.983 -16.564
  376   3HG2  THR  30          HG23      THR  30 -12.458   0.720 -16.644
  Start of MODEL    9
    1   1H    GLY   1           HT1      GLY   1  -8.056   8.635  -0.016
    2   2H    GLY   1           HT2      GLY   1  -7.462   8.154   1.500
    3   3H    GLY   1           HT3      GLY   1  -7.678   7.005   0.268
    4   1HA   GLY   1          HA1       GLY   1  -5.892   8.082  -0.964
    5   2HA   GLY   1          HA2       GLY   1  -5.700   9.327   0.307
    6    H    ILE   2           H        ILE   2  -5.916   5.995  -1.214
    7    HA   ILE   2           HA       ILE   2  -3.774   4.887   0.421
    8    HB   ILE   2           HB       ILE   2  -5.948   3.710  -0.444
    9   1HG1  ILE   2          HG12      ILE   2  -4.192   2.543   0.739
   10   2HG1  ILE   2          HG11      ILE   2  -4.691   1.562  -0.644
   11   1HG2  ILE   2          HG21      ILE   2  -5.451   2.475  -2.613
   12   2HG2  ILE   2          HG22      ILE   2  -4.169   3.650  -2.893
   13   3HG2  ILE   2          HG23      ILE   2  -5.845   4.184  -2.783
   14   1HD1  ILE   2          HD11      ILE   2  -2.401   1.536  -0.932
   15   2HD1  ILE   2          HD12      ILE   2  -2.196   3.151  -0.254
   16   3HD1  ILE   2          HD13      ILE   2  -2.831   2.949  -1.886
   17    H    VAL   3           H        VAL   3  -4.329   6.141  -2.833
   18    HA   VAL   3           HA       VAL   3  -1.779   5.250  -3.879
   19    HB   VAL   3           HB       VAL   3  -3.640   7.431  -4.850
   20   1HG1  VAL   3          HG11      VAL   3  -1.378   6.011  -6.290
   21   2HG1  VAL   3          HG12      VAL   3  -1.270   7.644  -5.632
   22   3HG1  VAL   3          HG13      VAL   3  -2.397   7.293  -6.943
   23   1HG2  VAL   3          HG21      VAL   3  -3.248   4.670  -6.006
   24   2HG2  VAL   3          HG22      VAL   3  -4.574   5.800  -6.290
   25   3HG2  VAL   3          HG23      VAL   3  -4.434   4.974  -4.737
   26    H    GLU   4           H        GLU   4  -2.904   8.590  -3.270
   27    HA   GLU   4           HA       GLU   4  -0.389   9.788  -3.429
   28   1HB   GLU   4          HB2       GLU   4  -2.950  10.458  -2.028
   29   2HB   GLU   4          HB1       GLU   4  -1.523  11.423  -1.678
   30   1HG   GLU   4          HG2       GLU   4  -1.382  12.260  -3.837
   31   2HG   GLU   4          HG1       GLU   4  -2.202  10.864  -4.537
   32    H    GLN   5           H        GLN   5  -1.717   7.830  -0.872
   33    HA   GLN   5           HA       GLN   5  -0.072   8.762   1.275
   34   1HB   GLN   5          HB2       GLN   5  -2.039   7.228   1.535
   35   2HB   GLN   5          HB1       GLN   5  -1.066   5.931   0.839
   36   1HG   GLN   5          HG2       GLN   5  -0.840   5.694   3.203
   37   2HG   GLN   5          HG1       GLN   5   0.658   6.449   2.660
   38   1HE2  GLN   5          HE21      GLN   5   0.826   8.855   2.957
   39   2HE2  GLN   5          HE22      GLN   5  -0.066   9.602   4.193
   40    H    CYS   6           H        CYS   6   0.510   6.415  -1.315
   41    HA   CYS   6           HA       CYS   6   3.262   6.024  -0.236
   42   1HB   CYS   6          HB2       CYS   6   1.674   4.427  -2.264
   43   2HB   CYS   6          HB1       CYS   6   3.359   4.111  -1.854
   44    H    CYS   7           H        CYS   7   1.580   7.797  -2.568
   45    HA   CYS   7           HA       CYS   7   3.963   7.872  -4.345
   46   1HB   CYS   7          HB2       CYS   7   1.766   7.487  -5.441
   47   2HB   CYS   7          HB1       CYS   7   1.185   9.017  -4.815
   48    H    THR   8           H        THR   8   1.634  10.533  -3.822
   49    HA   THR   8           HA       THR   8   3.510  12.609  -3.782
   50    HB   THR   8           HB       THR   8   1.757  13.487  -1.868
   51    HG1  THR   8           HG1      THR   8   0.265  12.039  -1.688
   52   1HG2  THR   8          HG21      THR   8   1.343  14.872  -3.585
   53   2HG2  THR   8          HG22      THR   8   0.399  13.612  -4.381
   54   3HG2  THR   8          HG23      THR   8   2.132  13.738  -4.682
   55    H    SER   9           H        SER   9   2.391  10.557  -1.161
   56    HA   SER   9           HA       SER   9   4.746  11.386   0.482
   57   1HB   SER   9          HB2       SER   9   2.022  10.295   1.253
   58   2HB   SER   9          HB1       SER   9   3.386  10.287   2.367
   59    HG   SER   9           HG       SER   9   2.623  12.631   0.995
   60    H    ILE  10           H        ILE  10   6.154   9.644   1.050
   61    HA   ILE  10           HA       ILE  10   5.661   7.190  -0.517
   62    HB   ILE  10           HB       ILE  10   8.064   8.217   1.008
   63   1HG1  ILE  10          HG12      ILE  10   9.035   7.780  -1.358
   64   2HG1  ILE  10          HG11      ILE  10   7.355   7.702  -1.880
   65   1HG2  ILE  10          HG21      ILE  10   8.204   5.903   1.421
   66   2HG2  ILE  10          HG22      ILE  10   9.114   6.096  -0.076
   67   3HG2  ILE  10          HG23      ILE  10   7.459   5.493  -0.124
   68   1HD1  ILE  10          HD11      ILE  10   7.426  10.003  -0.326
   69   2HD1  ILE  10          HD12      ILE  10   7.474   9.957  -2.088
   70   3HD1  ILE  10          HD13      ILE  10   8.976  10.034  -1.168
   71    H    CYS  11           H        CYS  11   5.729   5.064   0.434
   72    HA   CYS  11           HA       CYS  11   5.280   5.049   3.396
   73   1HB   CYS  11          HB2       CYS  11   3.483   3.424   3.158
   74   2HB   CYS  11          HB1       CYS  11   3.085   4.851   2.207
   75    H    SER  12           H        SER  12   5.407   2.671   4.206
   76    HA   SER  12           HA       SER  12   7.850   1.497   2.998
   77   1HB   SER  12          HB2       SER  12   7.842   0.119   5.126
   78   2HB   SER  12          HB1       SER  12   8.010   1.855   5.374
   79    HG   SER  12           HG       SER  12   6.405   1.365   6.719
   80    H    LEU  13           H        LEU  13   7.847  -1.040   3.183
   81    HA   LEU  13           HA       LEU  13   5.713  -1.997   1.484
   82   1HB   LEU  13          HB2       LEU  13   8.139  -3.163   2.775
   83   2HB   LEU  13          HB1       LEU  13   6.876  -4.281   2.261
   84    HG   LEU  13           HG       LEU  13   8.720  -3.697   0.550
   85   1HD1  LEU  13          HD11      LEU  13   7.102  -3.760  -1.294
   86   2HD1  LEU  13          HD12      LEU  13   5.814  -3.261  -0.200
   87   3HD1  LEU  13          HD13      LEU  13   6.583  -4.836   0.003
   88   1HD2  LEU  13          HD21      LEU  13   8.720  -1.614  -0.479
   89   2HD2  LEU  13          HD22      LEU  13   8.271  -1.148   1.162
   90   3HD2  LEU  13          HD23      LEU  13   7.030  -1.303  -0.082
   91    H    TYR  14           H        TYR  14   6.273  -1.939   4.928
   92    HA   TYR  14           HA       TYR  14   4.469  -4.025   5.696
   93   1HB   TYR  14          HB2       TYR  14   6.066  -2.996   7.271
   94   2HB   TYR  14          HB1       TYR  14   5.193  -1.466   7.161
   95    HD1  TYR  14           HD1      TYR  14   4.491  -5.100   7.824
   96    HD2  TYR  14           HD2      TYR  14   3.601  -1.010   8.799
   97    HE1  TYR  14           HE1      TYR  14   2.937  -5.863   9.599
   98    HE2  TYR  14           HE2      TYR  14   2.045  -1.774  10.575
   99    HH   TYR  14           HH       TYR  14   1.904  -4.057  12.037
  100    H    GLN  15           H        GLN  15   3.994  -0.594   4.954
  101    HA   GLN  15           HA       GLN  15   1.174  -0.611   5.691
  102   1HB   GLN  15          HB2       GLN  15   2.738   1.319   3.927
  103   2HB   GLN  15          HB1       GLN  15   1.148   1.625   4.623
  104   1HG   GLN  15          HG2       GLN  15   2.719   0.839   6.800
  105   2HG   GLN  15          HG1       GLN  15   3.776   1.884   5.850
  106   1HE2  GLN  15          HE21      GLN  15   3.659   3.856   6.989
  107   2HE2  GLN  15          HE22      GLN  15   2.210   4.669   7.334
  108    H    LEU  16           H        LEU  16   2.953  -0.705   2.572
  109    HA   LEU  16           HA       LEU  16   0.756  -0.804   0.834
  110   1HB   LEU  16          HB2       LEU  16   3.525  -1.607   0.750
  111   2HB   LEU  16          HB1       LEU  16   2.517  -2.788  -0.091
  112    HG   LEU  16           HG       LEU  16   1.640  -1.156  -1.568
  113   1HD1  LEU  16          HD11      LEU  16   2.497   0.735   0.578
  114   2HD1  LEU  16          HD12      LEU  16   1.025   0.734  -0.394
  115   3HD1  LEU  16          HD13      LEU  16   2.536   1.330  -1.082
  116   1HD2  LEU  16          HD21      LEU  16   3.929   0.244  -1.994
  117   2HD2  LEU  16          HD22      LEU  16   3.670  -1.414  -2.535
  118   3HD2  LEU  16          HD23      LEU  16   4.534  -1.102  -1.029
  119    H    GLU  17           H        GLU  17   1.887  -3.094   3.160
  120    HA   GLU  17           HA       GLU  17   0.295  -5.362   2.202
  121   1HB   GLU  17          HB2       GLU  17   1.797  -4.767   4.764
  122   2HB   GLU  17          HB1       GLU  17   0.805  -6.212   4.584
  123   1HG   GLU  17          HG2       GLU  17   2.841  -5.583   2.474
  124   2HG   GLU  17          HG1       GLU  17   3.380  -6.286   4.000
  125    H    ASN  18           H        ASN  18   0.040  -2.750   4.511
  126    HA   ASN  18           HA       ASN  18  -2.302  -3.590   5.868
  127   1HB   ASN  18          HB2       ASN  18  -1.997  -1.657   7.009
  128   2HB   ASN  18          HB1       ASN  18  -0.526  -1.510   6.072
  129   1HD2  ASN  18          HD21      ASN  18  -1.418  -0.803   3.595
  130   2HD2  ASN  18          HD22      ASN  18  -2.227   0.666   3.690
  131    H    TYR  19           H        TYR  19  -1.854  -2.389   2.650
  132    HA   TYR  19           HA       TYR  19  -4.799  -2.001   2.411
  133   1HB   TYR  19          HB2       TYR  19  -2.593  -1.164   0.496
  134   2HB   TYR  19          HB1       TYR  19  -4.315  -0.913   0.240
  135    HD1  TYR  19           HD1      TYR  19  -1.794   1.047   0.731
  136    HD2  TYR  19           HD2      TYR  19  -5.157  -0.291   3.041
  137    HE1  TYR  19           HE1      TYR  19  -1.683   3.117   2.086
  138    HE2  TYR  19           HE2      TYR  19  -5.049   1.766   4.408
  139    HH   TYR  19           HH       TYR  19  -2.932   4.442   3.542
  140    H    CYS  20           H        CYS  20  -2.508  -4.352   2.050
  141    HA   CYS  20           HA       CYS  20  -3.269  -5.533  -0.476
  142   1HB   CYS  20          HB2       CYS  20  -1.775  -6.398   1.969
  143   2HB   CYS  20          HB1       CYS  20  -2.255  -7.611   0.815
  144    H    ASN  21           H        ASN  21  -3.920  -8.189   0.235
  145    HA   ASN  21           HA       ASN  21  -6.541  -7.813   1.638
  146   1HB   ASN  21          HB2       ASN  21  -6.118  -8.642  -1.007
  147   2HB   ASN  21          HB1       ASN  21  -6.452 -10.130  -0.120
  148   1HD2  ASN  21          HD21      ASN  21  -7.746  -6.838   0.523
  149   2HD2  ASN  21          HD22      ASN  21  -9.372  -7.274   0.309
  150   1H    PHE   1           HT1      PHE   1  13.249  -1.245  -0.134
  151   2H    PHE   1           HT2      PHE   1  12.678  -0.406  -1.496
  152   3H    PHE   1           HT3      PHE   1  13.023  -2.066  -1.601
  153    HA   PHE   1           HA       PHE   1  10.579  -1.242  -1.341
  154   1HB   PHE   1          HB2       PHE   1  12.049  -3.624  -0.562
  155   2HB   PHE   1          HB1       PHE   1  10.640  -3.392   0.472
  156    HD1  PHE   1           HD1      PHE   1  10.789  -2.114  -2.989
  157    HD2  PHE   1           HD2      PHE   1   9.383  -5.277  -0.439
  158    HE1  PHE   1           HE1      PHE   1   9.310  -2.927  -4.807
  159    HE2  PHE   1           HE2      PHE   1   7.907  -6.088  -2.259
  160    HZ   PHE   1           HZ       PHE   1   7.869  -4.912  -4.443
  161    H    VAL   2           H        VAL   2  11.928   0.681   0.244
  162    HA   VAL   2           HA       VAL   2  10.412   0.410   2.808
  163    HB   VAL   2           HB       VAL   2  12.247   1.558   3.972
  164   1HG1  VAL   2          HG11      VAL   2  12.215  -0.997   3.547
  165   2HG1  VAL   2          HG12      VAL   2  13.732  -0.279   4.091
  166   3HG1  VAL   2          HG13      VAL   2  13.506  -0.681   2.389
  167   1HG2  VAL   2          HG21      VAL   2  13.171   2.937   2.251
  168   2HG2  VAL   2          HG22      VAL   2  13.473   1.548   1.204
  169   3HG2  VAL   2          HG23      VAL   2  14.439   1.782   2.663
  170    H    ASN   3           H        ASN   3  12.028   2.648   0.558
  171    HA   ASN   3           HA       ASN   3   9.908   4.670   1.190
  172   1HB   ASN   3          HB2       ASN   3  12.848   4.992   0.571
  173   2HB   ASN   3          HB1       ASN   3  11.710   6.310   0.290
  174   1HD2  ASN   3          HD21      ASN   3  10.993   7.502   2.109
  175   2HD2  ASN   3          HD22      ASN   3  11.433   7.136   3.707
  176    H    GLN   4           H        GLN   4   8.574   3.803  -0.480
  177    HA   GLN   4           HA       GLN   4   9.687   4.192  -3.222
  178   1HB   GLN   4          HB2       GLN   4   8.726   1.858  -2.191
  179   2HB   GLN   4          HB1       GLN   4   7.269   2.522  -2.930
  180   1HG   GLN   4          HG2       GLN   4   8.548   1.126  -4.533
  181   2HG   GLN   4          HG1       GLN   4   8.456   2.806  -5.062
  182   1HE2  GLN   4          HE21      GLN   4  10.442   3.515  -5.845
  183   2HE2  GLN   4          HE22      GLN   4  11.956   3.049  -5.236
  184    H    HIS   5           H        HIS   5   8.484   5.307  -4.703
  185    HA   HIS   5           HA       HIS   5   6.149   6.827  -3.642
  186   1HB   HIS   5          HB2       HIS   5   7.728   7.471  -6.143
  187   2HB   HIS   5          HB1       HIS   5   6.701   8.552  -5.205
  188    HD2  HIS   5           HD2      HIS   5   9.805   6.369  -3.976
  189    HE1  HIS   5           HE1      HIS   5  10.325  10.392  -2.788
  190    HE2  HIS   5           HE2      HIS   5  11.321   8.045  -2.692
  191    H    LEU   6           H        LEU   6   5.012   4.690  -4.117
  192    HA   LEU   6           HA       LEU   6   4.643   3.939  -6.905
  193   1HB   LEU   6          HB2       LEU   6   3.365   3.112  -4.321
  194   2HB   LEU   6          HB1       LEU   6   2.788   2.535  -5.877
  195    HG   LEU   6           HG       LEU   6   4.583   1.136  -6.148
  196   1HD1  LEU   6          HD11      LEU   6   6.310   3.172  -4.699
  197   2HD1  LEU   6          HD12      LEU   6   6.178   3.007  -6.450
  198   3HD1  LEU   6          HD13      LEU   6   6.895   1.711  -5.495
  199   1HD2  LEU   6          HD21      LEU   6   5.671   0.597  -3.849
  200   2HD2  LEU   6          HD22      LEU   6   3.931   0.359  -4.024
  201   3HD2  LEU   6          HD23      LEU   6   4.547   1.798  -3.210
  202    H    CYS   7           H        CYS   7   3.174   4.707  -8.291
  203    HA   CYS   7           HA       CYS   7   0.754   6.001  -7.169
  204   1HB   CYS   7          HB2       CYS   7   1.935   7.250  -9.610
  205   2HB   CYS   7          HB1       CYS   7   1.027   7.997  -8.297
  206    H    GLY   8           H        GLY   8  -1.055   5.945  -8.669
  207   1HA   GLY   8          HA2       GLY   8  -2.406   4.712 -10.152
  208   2HA   GLY   8          HA1       GLY   8  -1.147   5.141 -11.306
  209    H    SER   9           H        SER   9  -0.915   3.268 -12.457
  210    HA   SER   9           HA       SER   9  -1.224   0.630 -11.574
  211   1HB   SER   9          HB2       SER   9   0.716   0.308 -13.444
  212   2HB   SER   9          HB1       SER   9  -0.978   0.596 -13.834
  213    HG   SER   9           HG       SER   9  -0.540   2.685 -14.238
  214    H    ASP  10           H        ASP  10   1.839   2.513 -11.648
  215    HA   ASP  10           HA       ASP  10   3.611   0.564 -10.738
  216   1HB   ASP  10          HB2       ASP  10   3.433   3.454  -9.806
  217   2HB   ASP  10          HB1       ASP  10   4.832   2.403  -9.571
  218    H    LEU  11           H        LEU  11   0.985   2.086  -9.039
  219    HA   LEU  11           HA       LEU  11   1.779   1.157  -6.401
  220   1HB   LEU  11          HB2       LEU  11   0.222   3.131  -7.000
  221   2HB   LEU  11          HB1       LEU  11  -1.014   1.905  -7.264
  222    HG   LEU  11           HG       LEU  11  -0.892   1.175  -4.972
  223   1HD1  LEU  11          HD11      LEU  11   0.694   2.233  -3.379
  224   2HD1  LEU  11          HD12      LEU  11   1.440   3.093  -4.721
  225   3HD1  LEU  11          HD13      LEU  11   1.539   1.334  -4.636
  226   1HD2  LEU  11          HD21      LEU  11  -0.828   4.175  -5.302
  227   2HD2  LEU  11          HD22      LEU  11  -1.270   3.391  -3.785
  228   3HD2  LEU  11          HD23      LEU  11  -2.246   3.129  -5.232
  229    H    THR  12           H        THR  12  -0.750   0.179  -8.738
  230    HA   THR  12           HA       THR  12  -1.617  -2.138  -7.338
  231    HB   THR  12           HB       THR  12  -1.487  -1.495 -10.290
  232    HG1  THR  12           HG1      THR  12  -3.901  -1.932  -9.136
  233   1HG2  THR  12          HG21      THR  12  -1.884  -4.066  -9.014
  234   2HG2  THR  12          HG22      THR  12  -1.782  -3.679 -10.733
  235   3HG2  THR  12          HG23      THR  12  -3.331  -3.574  -9.895
  236    H    GLU  13           H        GLU  13   0.872  -1.776  -9.868
  237    HA   GLU  13           HA       GLU  13   1.813  -4.384 -10.057
  238   1HB   GLU  13          HB2       GLU  13   2.848  -1.731 -10.554
  239   2HB   GLU  13          HB1       GLU  13   4.125  -2.749  -9.898
  240   1HG   GLU  13          HG2       GLU  13   3.248  -4.520 -11.614
  241   2HG   GLU  13          HG1       GLU  13   2.519  -3.125 -12.412
  242    H    ALA  14           H        ALA  14   2.854  -1.935  -7.661
  243    HA   ALA  14           HA       ALA  14   4.491  -3.744  -6.147
  244   1HB   ALA  14          HB1       ALA  14   3.195  -1.087  -5.584
  245   2HB   ALA  14          HB2       ALA  14   4.911  -1.481  -5.683
  246   3HB   ALA  14          HB3       ALA  14   3.971  -1.982  -4.278
  247    H    LEU  15           H        LEU  15   1.194  -2.491  -5.539
  248    HA   LEU  15           HA       LEU  15   0.536  -4.052  -3.291
  249   1HB   LEU  15          HB2       LEU  15  -1.060  -2.943  -5.583
  250   2HB   LEU  15          HB1       LEU  15  -1.844  -3.996  -4.407
  251    HG   LEU  15           HG       LEU  15  -0.243  -1.540  -3.645
  252   1HD1  LEU  15          HD11      LEU  15  -3.070  -1.895  -4.497
  253   2HD1  LEU  15          HD12      LEU  15  -2.033  -0.474  -4.608
  254   3HD1  LEU  15          HD13      LEU  15  -2.804  -0.886  -3.075
  255   1HD2  LEU  15          HD21      LEU  15  -0.582  -2.226  -1.521
  256   2HD2  LEU  15          HD22      LEU  15  -1.193  -3.748  -2.169
  257   3HD2  LEU  15          HD23      LEU  15  -2.308  -2.428  -1.814
  258    H    TYR  16           H        TYR  16  -0.291  -4.809  -6.657
  259    HA   TYR  16           HA       TYR  16  -1.223  -7.392  -6.424
  260   1HB   TYR  16          HB2       TYR  16  -0.643  -5.814  -8.481
  261   2HB   TYR  16          HB1       TYR  16   0.784  -6.825  -8.556
  262    HD1  TYR  16           HD1      TYR  16  -2.563  -7.992  -7.415
  263    HD2  TYR  16           HD2      TYR  16   0.319  -7.952 -10.606
  264    HE1  TYR  16           HE1      TYR  16  -3.852  -9.741  -8.598
  265    HE2  TYR  16           HE2      TYR  16  -0.973  -9.708 -11.790
  266    HH   TYR  16           HH       TYR  16  -3.374 -10.515 -11.826
  267    H    LEU  17           H        LEU  17   2.104  -6.318  -6.026
  268    HA   LEU  17           HA       LEU  17   3.044  -9.126  -5.962
  269   1HB   LEU  17          HB2       LEU  17   4.262  -7.016  -7.018
  270   2HB   LEU  17          HB1       LEU  17   4.851  -6.824  -5.364
  271    HG   LEU  17           HG       LEU  17   5.105  -9.316  -7.079
  272   1HD1  LEU  17          HD11      LEU  17   6.704  -6.983  -6.909
  273   2HD1  LEU  17          HD12      LEU  17   7.098  -8.497  -7.721
  274   3HD1  LEU  17          HD13      LEU  17   7.571  -8.249  -6.040
  275   1HD2  LEU  17          HD21      LEU  17   6.610  -9.981  -5.074
  276   2HD2  LEU  17          HD22      LEU  17   4.864 -10.096  -4.859
  277   3HD2  LEU  17          HD23      LEU  17   5.746  -8.724  -4.190
  278    H    VAL  18           H        VAL  18   3.295  -6.252  -3.809
  279    HA   VAL  18           HA       VAL  18   4.384  -7.461  -1.559
  280    HB   VAL  18           HB       VAL  18   2.410  -5.981  -0.344
  281   1HG1  VAL  18          HG11      VAL  18   5.171  -5.617  -1.211
  282   2HG1  VAL  18          HG12      VAL  18   4.403  -5.187   0.318
  283   3HG1  VAL  18          HG13      VAL  18   4.293  -4.094  -1.062
  284   1HG2  VAL  18          HG21      VAL  18   1.804  -5.538  -2.922
  285   2HG2  VAL  18          HG22      VAL  18   3.058  -4.314  -2.722
  286   3HG2  VAL  18          HG23      VAL  18   1.630  -4.291  -1.688
  287    H    CYS  19           H        CYS  19   1.097  -7.734  -2.707
  288    HA   CYS  19           HA       CYS  19   0.434  -9.522  -0.427
  289   1HB   CYS  19          HB2       CYS  19  -1.608  -9.199  -2.515
  290   2HB   CYS  19          HB1       CYS  19  -1.734  -8.957  -0.784
  291    H    GLY  20           H        GLY  20  -0.316  -9.645  -3.903
  292   1HA   GLY  20          HA2       GLY  20   0.030 -11.375  -5.470
  293   2HA   GLY  20          HA1       GLY  20   1.108 -12.147  -4.306
  294    H    GLU  21           H        GLU  21   0.356 -14.058  -3.509
  295    HA   GLU  21           HA       GLU  21  -2.194 -15.121  -4.105
  296   1HB   GLU  21          HB2       GLU  21  -0.407 -15.744  -1.731
  297   2HB   GLU  21          HB1       GLU  21  -1.745 -16.750  -2.285
  298   1HG   GLU  21          HG2       GLU  21   0.237 -16.000  -4.358
  299   2HG   GLU  21          HG1       GLU  21   0.818 -17.101  -3.109
  300    H    ARG  22           H        ARG  22  -1.124 -12.974  -1.584
  301    HA   ARG  22           HA       ARG  22  -3.585 -13.202  -0.029
  302   1HB   ARG  22          HB2       ARG  22  -1.387 -11.115   0.062
  303   2HB   ARG  22          HB1       ARG  22  -2.667 -11.311   1.259
  304   1HG   ARG  22          HG2       ARG  22  -0.616 -13.429   0.550
  305   2HG   ARG  22          HG1       ARG  22  -0.555 -12.402   1.982
  306   1HD   ARG  22          HD2       ARG  22  -1.788 -13.984   3.018
  307   2HD   ARG  22          HD1       ARG  22  -3.139 -13.444   2.021
  308    HE   ARG  22           HE       ARG  22  -2.263 -15.198   0.330
  309   1HH1  ARG  22          HH21      ARG  22  -0.005 -16.092   2.122
  310   2HH1  ARG  22          HH22      ARG  22  -0.688 -17.492   2.879
  311   1HH2  ARG  22          HH11      ARG  22  -3.951 -16.697   2.008
  312   2HH2  ARG  22          HH12      ARG  22  -2.923 -17.836   2.812
  313    H    GLY  23           H        GLY  23  -2.899 -11.911  -2.993
  314   1HA   GLY  23          HA2       GLY  23  -3.867 -10.213  -4.301
  315   2HA   GLY  23          HA1       GLY  23  -5.339 -10.672  -3.446
  316    H    PHE  24           H        PHE  24  -5.522  -8.188  -3.966
  317    HA   PHE  24           HA       PHE  24  -4.856  -6.782  -1.428
  318   1HB   PHE  24          HB2       PHE  24  -4.122  -4.781  -2.674
  319   2HB   PHE  24          HB1       PHE  24  -3.093  -6.149  -3.019
  320    HD1  PHE  24           HD1      PHE  24  -6.293  -4.695  -4.391
  321    HD2  PHE  24           HD2      PHE  24  -2.458  -6.457  -5.220
  322    HE1  PHE  24           HE1      PHE  24  -6.704  -4.443  -6.814
  323    HE2  PHE  24           HE2      PHE  24  -2.875  -6.196  -7.649
  324    HZ   PHE  24           HZ       PHE  24  -4.995  -5.193  -8.445
  325    H    PHE  25           H        PHE  25  -6.031  -4.374  -1.875
  326    HA   PHE  25           HA       PHE  25  -8.572  -4.796  -3.303
  327   1HB   PHE  25          HB2       PHE  25  -9.978  -4.904  -1.510
  328   2HB   PHE  25          HB1       PHE  25  -8.553  -5.528  -0.689
  329    HD1  PHE  25           HD1      PHE  25 -11.173  -3.439  -0.176
  330    HD2  PHE  25           HD2      PHE  25  -6.882  -3.323  -0.082
  331    HE1  PHE  25           HE1      PHE  25 -11.262  -1.533   1.406
  332    HE2  PHE  25           HE2      PHE  25  -6.967  -1.417   1.502
  333    HZ   PHE  25           HZ       PHE  25  -9.158  -0.519   2.247
  334    H    TYR  26           H        TYR  26  -6.250  -3.061  -3.561
  335    HA   TYR  26           HA       TYR  26  -6.704  -0.420  -2.645
  336   1HB   TYR  26          HB2       TYR  26  -4.638  -0.428  -3.592
  337   2HB   TYR  26          HB1       TYR  26  -5.039  -1.767  -4.658
  338    HD1  TYR  26           HD1      TYR  26  -4.350   1.716  -4.473
  339    HD2  TYR  26           HD2      TYR  26  -6.595  -1.196  -6.696
  340    HE1  TYR  26           HE1      TYR  26  -4.484   3.286  -6.388
  341    HE2  TYR  26           HE2      TYR  26  -6.726   0.371  -8.614
  342    HH   TYR  26           HH       TYR  26  -4.800   2.933  -9.029
  343    H    THR  27           H        THR  27  -8.081   1.175  -3.350
  344    HA   THR  27           HA       THR  27  -9.737   0.561  -5.764
  345    HB   THR  27           HB       THR  27 -11.279   0.202  -4.053
  346    HG1  THR  27           HG1      THR  27 -12.055   1.864  -5.362
  347   1HG2  THR  27          HG21      THR  27  -9.560   2.152  -2.582
  348   2HG2  THR  27          HG22      THR  27 -10.197   0.595  -2.052
  349   3HG2  THR  27          HG23      THR  27 -11.248   2.012  -2.087
  350    H    LYS  28           H        LYS  28  -7.470   2.613  -4.570
  351    HA   LYS  28           HA       LYS  28  -6.991   4.911  -4.869
  352   1HB   LYS  28          HB2       LYS  28  -7.253   5.596  -7.262
  353   2HB   LYS  28          HB1       LYS  28  -6.475   4.027  -7.079
  354   1HG   LYS  28          HG2       LYS  28  -8.557   2.875  -7.573
  355   2HG   LYS  28          HG1       LYS  28  -9.436   4.405  -7.602
  356   1HD   LYS  28          HD2       LYS  28  -7.631   5.043  -9.428
  357   2HD   LYS  28          HD1       LYS  28  -7.505   3.294  -9.605
  358   1HE   LYS  28          HE2       LYS  28 -10.269   4.332  -9.488
  359   2HE   LYS  28          HE1       LYS  28  -9.348   4.824 -10.910
  360   1HZ   LYS  28          HZ1       LYS  28 -10.436   2.754 -11.356
  361   2HZ   LYS  28          HZ2       LYS  28  -9.787   2.049  -9.952
  362   3HZ   LYS  28          HZ3       LYS  28  -8.768   2.469 -11.244
  363    HA   PRO  29           HA       PRO  29 -11.458   6.135  -4.322
  364   1HB   PRO  29          HB2       PRO  29 -11.312   6.600  -1.615
  365   2HB   PRO  29          HB1       PRO  29 -11.763   5.037  -2.318
  366   1HG   PRO  29          HG2       PRO  29  -9.197   5.844  -1.028
  367   2HG   PRO  29          HG1       PRO  29  -9.931   4.236  -1.157
  368   1HD   PRO  29          HD2       PRO  29  -7.805   5.216  -2.744
  369   2HD   PRO  29          HD1       PRO  29  -8.773   3.763  -3.074
  370    H    THR  30           H        THR  30 -11.856   8.292  -4.702
  371    HA   THR  30           HA       THR  30  -9.931  10.279  -3.561
  372    HB   THR  30           HB       THR  30 -11.352  10.590  -6.213
  373    HG1  THR  30           HG1      THR  30  -8.689   9.737  -5.757
  374   1HG2  THR  30          HG21      THR  30  -9.522  12.253  -6.565
  375   2HG2  THR  30          HG22      THR  30  -8.978  11.952  -4.914
  376   3HG2  THR  30          HG23      THR  30 -10.567  12.660  -5.204
  Start of MODEL   10
    1   1H    GLY   1           HT1      GLY   1  -5.664   9.263   0.687
    2   2H    GLY   1           HT2      GLY   1  -7.293   9.311   0.209
    3   3H    GLY   1           HT3      GLY   1  -6.083   9.889  -0.834
    4   1HA   GLY   1          HA1       GLY   1  -6.462   7.087  -0.104
    5   2HA   GLY   1          HA2       GLY   1  -6.797   7.778  -1.720
    6    H    ILE   2           H        ILE   2  -5.710   5.293  -0.890
    7    HA   ILE   2           HA       ILE   2  -3.104   5.213   0.245
    8    HB   ILE   2           HB       ILE   2  -4.896   3.311  -0.593
    9   1HG1  ILE   2          HG12      ILE   2  -2.278   2.134  -0.377
   10   2HG1  ILE   2          HG11      ILE   2  -2.461   3.446   0.793
   11   1HG2  ILE   2          HG21      ILE   2  -3.888   3.732  -2.969
   12   2HG2  ILE   2          HG22      ILE   2  -4.109   2.072  -2.415
   13   3HG2  ILE   2          HG23      ILE   2  -2.511   2.815  -2.355
   14   1HD1  ILE   2          HD11      ILE   2  -4.882   2.282   1.043
   15   2HD1  ILE   2          HD12      ILE   2  -3.491   1.814   2.023
   16   3HD1  ILE   2          HD13      ILE   2  -3.923   0.870   0.597
   17    H    VAL   3           H        VAL   3  -4.189   5.970  -2.997
   18    HA   VAL   3           HA       VAL   3  -1.777   5.580  -4.422
   19    HB   VAL   3           HB       VAL   3  -3.720   7.849  -4.880
   20   1HG1  VAL   3          HG11      VAL   3  -1.911   8.154  -6.337
   21   2HG1  VAL   3          HG12      VAL   3  -3.000   7.162  -7.309
   22   3HG1  VAL   3          HG13      VAL   3  -1.622   6.421  -6.495
   23   1HG2  VAL   3          HG21      VAL   3  -4.182   5.546  -6.540
   24   2HG2  VAL   3          HG22      VAL   3  -5.297   6.338  -5.427
   25   3HG2  VAL   3          HG23      VAL   3  -4.236   5.054  -4.848
   26    H    GLU   4           H        GLU   4  -2.924   8.811  -3.465
   27    HA   GLU   4           HA       GLU   4  -0.347   9.962  -3.673
   28   1HB   GLU   4          HB2       GLU   4  -2.292  11.107  -1.709
   29   2HB   GLU   4          HB1       GLU   4  -1.324  11.920  -2.932
   30   1HG   GLU   4          HG2       GLU   4  -2.812  10.717  -4.660
   31   2HG   GLU   4          HG1       GLU   4  -3.896  10.398  -3.306
   32    H    GLN   5           H        GLN   5  -1.871   8.159  -1.110
   33    HA   GLN   5           HA       GLN   5  -0.313   8.999   1.106
   34   1HB   GLN   5          HB2       GLN   5  -2.171   7.492   1.462
   35   2HB   GLN   5          HB1       GLN   5  -1.444   6.273   0.412
   36   1HG   GLN   5          HG2       GLN   5   0.158   5.674   1.979
   37   2HG   GLN   5          HG1       GLN   5   0.126   7.252   2.767
   38   1HE2  GLN   5          HE21      GLN   5  -0.166   5.989   4.842
   39   2HE2  GLN   5          HE22      GLN   5  -1.716   5.434   5.252
   40    H    CYS   6           H        CYS   6   0.298   6.300  -1.167
   41    HA   CYS   6           HA       CYS   6   3.115   6.252  -0.220
   42   1HB   CYS   6          HB2       CYS   6   1.514   4.309  -1.906
   43   2HB   CYS   6          HB1       CYS   6   3.236   4.130  -1.568
   44    H    CYS   7           H        CYS   7   1.339   7.782  -2.568
   45    HA   CYS   7           HA       CYS   7   3.488   7.557  -4.614
   46   1HB   CYS   7          HB2       CYS   7   1.178   7.369  -5.474
   47   2HB   CYS   7          HB1       CYS   7   0.764   8.912  -4.742
   48    H    THR   8           H        THR   8   1.502  10.448  -3.952
   49    HA   THR   8           HA       THR   8   3.539  12.336  -4.267
   50    HB   THR   8           HB       THR   8   2.234  13.718  -2.523
   51    HG1  THR   8           HG1      THR   8   1.201  12.324  -1.286
   52   1HG2  THR   8          HG21      THR   8   0.885  14.372  -4.224
   53   2HG2  THR   8          HG22      THR   8   0.196  12.760  -4.416
   54   3HG2  THR   8          HG23      THR   8   1.744  13.151  -5.165
   55    H    SER   9           H        SER   9   2.668  10.424  -1.460
   56    HA   SER   9           HA       SER   9   5.200  11.244  -0.106
   57   1HB   SER   9          HB2       SER   9   2.536  10.821   0.879
   58   2HB   SER   9          HB1       SER   9   3.566   9.559   1.545
   59    HG   SER   9           HG       SER   9   3.842  11.242   2.899
   60    H    ILE  10           H        ILE  10   6.183   9.168   1.076
   61    HA   ILE  10           HA       ILE  10   5.824   6.870  -0.810
   62    HB   ILE  10           HB       ILE  10   8.388   7.822   0.511
   63   1HG1  ILE  10          HG12      ILE  10   9.165   8.144  -1.795
   64   2HG1  ILE  10          HG11      ILE  10   7.617   7.578  -2.414
   65   1HG2  ILE  10          HG21      ILE  10   7.528   5.241  -0.458
   66   2HG2  ILE  10          HG22      ILE  10   9.048   5.680   0.308
   67   3HG2  ILE  10          HG23      ILE  10   8.861   5.841  -1.438
   68   1HD1  ILE  10          HD11      ILE  10   7.465   9.825  -0.496
   69   2HD1  ILE  10          HD12      ILE  10   6.584   9.563  -2.003
   70   3HD1  ILE  10          HD13      ILE  10   8.227  10.196  -2.041
   71    H    CYS  11           H        CYS  11   5.907   4.751   0.144
   72    HA   CYS  11           HA       CYS  11   6.029   4.730   3.132
   73   1HB   CYS  11          HB2       CYS  11   4.020   3.381   3.285
   74   2HB   CYS  11          HB1       CYS  11   3.642   4.846   2.383
   75    H    SER  12           H        SER  12   5.793   2.224   3.810
   76    HA   SER  12           HA       SER  12   7.814   0.784   2.141
   77   1HB   SER  12          HB2       SER  12   7.893  -0.590   4.428
   78   2HB   SER  12          HB1       SER  12   8.814   0.894   4.218
   79    HG   SER  12           HG       SER  12   6.289   0.551   5.459
   80    H    LEU  13           H        LEU  13   7.542  -1.758   2.743
   81    HA   LEU  13           HA       LEU  13   5.061  -2.531   1.498
   82   1HB   LEU  13          HB2       LEU  13   6.927  -4.352   3.034
   83   2HB   LEU  13          HB1       LEU  13   5.844  -4.784   1.710
   84    HG   LEU  13           HG       LEU  13   8.368  -3.125   1.576
   85   1HD1  LEU  13          HD11      LEU  13   9.172  -4.828   0.168
   86   2HD1  LEU  13          HD12      LEU  13   7.551  -5.423  -0.190
   87   3HD1  LEU  13          HD13      LEU  13   8.269  -5.721   1.392
   88   1HD2  LEU  13          HD21      LEU  13   6.050  -3.322  -0.351
   89   2HD2  LEU  13          HD22      LEU  13   7.683  -2.983  -0.926
   90   3HD2  LEU  13          HD23      LEU  13   6.900  -1.878   0.204
   91    H    TYR  14           H        TYR  14   6.226  -2.547   4.860
   92    HA   TYR  14           HA       TYR  14   4.214  -4.040   6.090
   93   1HB   TYR  14          HB2       TYR  14   6.078  -3.021   7.350
   94   2HB   TYR  14          HB1       TYR  14   5.385  -1.421   7.085
   95    HD1  TYR  14           HD1      TYR  14   4.670  -4.762   8.594
   96    HD2  TYR  14           HD2      TYR  14   3.684  -0.578   8.506
   97    HE1  TYR  14           HE1      TYR  14   3.211  -5.063  10.576
   98    HE2  TYR  14           HE2      TYR  14   2.223  -0.883  10.489
   99    HH   TYR  14           HH       TYR  14   2.207  -2.699  12.502
  100    H    GLN  15           H        GLN  15   4.088  -0.681   4.951
  101    HA   GLN  15           HA       GLN  15   1.366  -0.304   5.892
  102   1HB   GLN  15          HB2       GLN  15   2.844   1.295   3.786
  103   2HB   GLN  15          HB1       GLN  15   1.493   1.836   4.784
  104   1HG   GLN  15          HG2       GLN  15   3.053   1.210   6.786
  105   2HG   GLN  15          HG1       GLN  15   4.343   1.321   5.589
  106   1HE2  GLN  15          HE21      GLN  15   4.868   3.238   7.218
  107   2HE2  GLN  15          HE22      GLN  15   4.202   4.745   6.812
  108    H    LEU  16           H        LEU  16   2.805  -0.736   2.634
  109    HA   LEU  16           HA       LEU  16   0.317  -0.937   1.255
  110   1HB   LEU  16          HB2       LEU  16   3.100  -1.411   0.670
  111   2HB   LEU  16          HB1       LEU  16   2.102  -2.704  -0.007
  112    HG   LEU  16           HG       LEU  16   0.676  -1.104  -1.129
  113   1HD1  LEU  16          HD11      LEU  16   0.413   0.977  -0.320
  114   2HD1  LEU  16          HD12      LEU  16   2.108   1.339  -0.649
  115   3HD1  LEU  16          HD13      LEU  16   1.640   0.638   0.900
  116   1HD2  LEU  16          HD21      LEU  16   3.340   0.105  -1.657
  117   2HD2  LEU  16          HD22      LEU  16   2.149  -0.536  -2.790
  118   3HD2  LEU  16          HD23      LEU  16   3.182  -1.638  -1.879
  119    H    GLU  17           H        GLU  17   1.856  -2.978   3.524
  120    HA   GLU  17           HA       GLU  17   0.631  -5.491   2.700
  121   1HB   GLU  17          HB2       GLU  17   2.048  -4.549   5.200
  122   2HB   GLU  17          HB1       GLU  17   1.264  -6.125   5.133
  123   1HG   GLU  17          HG2       GLU  17   3.235  -5.272   3.014
  124   2HG   GLU  17          HG1       GLU  17   3.773  -6.014   4.522
  125    H    ASN  18           H        ASN  18  -0.056  -2.903   5.013
  126    HA   ASN  18           HA       ASN  18  -2.327  -4.122   6.242
  127   1HB   ASN  18          HB2       ASN  18  -1.960  -1.154   5.838
  128   2HB   ASN  18          HB1       ASN  18  -2.697  -1.994   7.197
  129   1HD2  ASN  18          HD21      ASN  18  -0.343  -4.036   6.988
  130   2HD2  ASN  18          HD22      ASN  18   0.931  -3.240   7.773
  131    H    TYR  19           H        TYR  19  -1.798  -2.779   3.148
  132    HA   TYR  19           HA       TYR  19  -4.667  -2.247   2.686
  133   1HB   TYR  19          HB2       TYR  19  -2.421  -2.065   0.669
  134   2HB   TYR  19          HB1       TYR  19  -3.985  -1.247   0.630
  135    HD1  TYR  19           HD1      TYR  19  -1.225   0.107   0.466
  136    HD2  TYR  19           HD2      TYR  19  -3.845  -0.729   3.770
  137    HE1  TYR  19           HE1      TYR  19  -0.255   2.015   1.721
  138    HE2  TYR  19           HE2      TYR  19  -2.874   1.179   5.023
  139    HH   TYR  19           HH       TYR  19  -1.501   3.558   3.962
  140    H    CYS  20           H        CYS  20  -2.364  -4.745   2.372
  141    HA   CYS  20           HA       CYS  20  -3.489  -6.150   0.125
  142   1HB   CYS  20          HB2       CYS  20  -1.881  -7.129   2.484
  143   2HB   CYS  20          HB1       CYS  20  -2.137  -8.021   1.018
  144    H    ASN  21           H        ASN  21  -4.802  -8.187   0.360
  145    HA   ASN  21           HA       ASN  21  -7.038  -7.850   2.089
  146   1HB   ASN  21          HB2       ASN  21  -6.523  -9.516   0.011
  147   2HB   ASN  21          HB1       ASN  21  -6.352 -10.640   1.354
  148   1HD2  ASN  21          HD21      ASN  21  -8.258 -10.023   3.138
  149   2HD2  ASN  21          HD22      ASN  21  -9.809  -9.998   2.447
  150   1H    PHE   1           HT1      PHE   1  10.907  -3.066   1.351
  151   2H    PHE   1           HT2      PHE   1  10.930  -4.116   0.016
  152   3H    PHE   1           HT3      PHE   1   9.652  -3.015   0.214
  153    HA   PHE   1           HA       PHE   1  12.361  -2.569  -0.779
  154   1HB   PHE   1          HB2       PHE   1   9.734  -1.158  -1.325
  155   2HB   PHE   1          HB1       PHE   1  11.198  -1.102  -2.305
  156    HD1  PHE   1           HD1      PHE   1   8.340  -2.005  -3.151
  157    HD2  PHE   1           HD2      PHE   1  11.830  -4.140  -1.838
  158    HE1  PHE   1           HE1      PHE   1   7.584  -4.007  -4.403
  159    HE2  PHE   1           HE2      PHE   1  11.074  -6.145  -3.090
  160    HZ   PHE   1           HZ       PHE   1   8.952  -6.078  -4.372
  161    H    VAL   2           H        VAL   2  12.832  -0.084  -0.969
  162    HA   VAL   2           HA       VAL   2  12.183   1.225   1.642
  163    HB   VAL   2           HB       VAL   2  14.496   0.426   1.706
  164   1HG1  VAL   2          HG11      VAL   2  14.981   2.118  -0.760
  165   2HG1  VAL   2          HG12      VAL   2  14.711   0.376  -0.826
  166   3HG1  VAL   2          HG13      VAL   2  16.114   1.019   0.028
  167   1HG2  VAL   2          HG21      VAL   2  15.280   3.149   1.222
  168   2HG2  VAL   2          HG22      VAL   2  15.010   2.345   2.769
  169   3HG2  VAL   2          HG23      VAL   2  13.670   3.141   1.944
  170    H    ASN   3           H        ASN   3  11.711   3.437   1.507
  171    HA   ASN   3           HA       ASN   3  10.847   5.330   0.389
  172   1HB   ASN   3          HB2       ASN   3  13.372   4.886  -1.239
  173   2HB   ASN   3          HB1       ASN   3  12.477   6.399  -1.106
  174   1HD2  ASN   3          HD21      ASN   3  15.004   6.749  -0.312
  175   2HD2  ASN   3          HD22      ASN   3  15.172   6.726   1.377
  176    H    GLN   4           H        GLN   4   9.470   3.183  -0.456
  177    HA   GLN   4           HA       GLN   4   9.699   2.788  -3.333
  178   1HB   GLN   4          HB2       GLN   4   8.621   1.328  -1.266
  179   2HB   GLN   4          HB1       GLN   4   7.178   1.991  -2.021
  180   1HG   GLN   4          HG2       GLN   4   9.076  -0.048  -3.029
  181   2HG   GLN   4          HG1       GLN   4   7.359   0.144  -3.353
  182   1HE2  GLN   4          HE21      GLN   4   9.865  -0.190  -5.175
  183   2HE2  GLN   4          HE22      GLN   4   9.676   1.043  -6.327
  184    H    HIS   5           H        HIS   5   8.983   4.277  -4.750
  185    HA   HIS   5           HA       HIS   5   6.823   6.170  -3.976
  186   1HB   HIS   5          HB2       HIS   5   8.418   6.120  -6.555
  187   2HB   HIS   5          HB1       HIS   5   7.519   7.477  -5.877
  188    HD2  HIS   5           HD2      HIS   5  10.875   5.513  -5.211
  189    HE1  HIS   5           HE1      HIS   5  10.952   9.123  -3.014
  190    HE2  HIS   5           HE2      HIS   5  12.308   7.075  -3.704
  191    H    LEU   6           H        LEU   6   4.871   5.102  -4.269
  192    HA   LEU   6           HA       LEU   6   4.479   3.626  -6.838
  193   1HB   LEU   6          HB2       LEU   6   3.245   3.423  -4.122
  194   2HB   LEU   6          HB1       LEU   6   2.370   2.868  -5.536
  195    HG   LEU   6           HG       LEU   6   3.804   1.097  -5.900
  196   1HD1  LEU   6          HD11      LEU   6   6.191   1.101  -5.176
  197   2HD1  LEU   6          HD12      LEU   6   5.961   2.720  -4.515
  198   3HD1  LEU   6          HD13      LEU   6   5.814   2.446  -6.251
  199   1HD2  LEU   6          HD21      LEU   6   4.616   1.455  -3.034
  200   2HD2  LEU   6          HD22      LEU   6   4.085  -0.007  -3.866
  201   3HD2  LEU   6          HD23      LEU   6   2.911   1.234  -3.427
  202    H    CYS   7           H        CYS   7   2.757   4.158  -8.173
  203    HA   CYS   7           HA       CYS   7   0.797   6.162  -7.307
  204   1HB   CYS   7          HB2       CYS   7   2.590   6.740  -9.675
  205   2HB   CYS   7          HB1       CYS   7   1.315   7.775  -9.045
  206    H    GLY   8           H        GLY   8  -1.110   5.876  -8.446
  207   1HA   GLY   8          HA2       GLY   8  -2.623   4.624  -9.759
  208   2HA   GLY   8          HA1       GLY   8  -1.574   5.183 -11.059
  209    H    SER   9           H        SER   9  -0.700   3.599 -12.275
  210    HA   SER   9           HA       SER   9  -1.092   0.837 -11.751
  211   1HB   SER   9          HB2       SER   9   1.079   0.923 -13.471
  212   2HB   SER   9          HB1       SER   9  -0.616   0.939 -13.949
  213    HG   SER   9           HG       SER   9  -0.112   2.825 -14.740
  214    H    ASP  10           H        ASP  10   2.056   2.601 -11.676
  215    HA   ASP  10           HA       ASP  10   3.673   0.581 -10.677
  216   1HB   ASP  10          HB2       ASP  10   3.647   3.487  -9.799
  217   2HB   ASP  10          HB1       ASP  10   4.965   2.359  -9.485
  218    H    LEU  11           H        LEU  11   1.200   2.388  -8.982
  219    HA   LEU  11           HA       LEU  11   1.871   1.391  -6.340
  220   1HB   LEU  11          HB2       LEU  11   0.564   3.472  -6.716
  221   2HB   LEU  11          HB1       LEU  11  -0.735   2.510  -7.417
  222    HG   LEU  11           HG       LEU  11  -1.051   1.336  -5.285
  223   1HD1  LEU  11          HD11      LEU  11   1.095   3.195  -4.230
  224   2HD1  LEU  11          HD12      LEU  11   1.326   1.471  -4.526
  225   3HD1  LEU  11          HD13      LEU  11   0.186   2.010  -3.294
  226   1HD2  LEU  11          HD21      LEU  11  -2.432   3.044  -4.843
  227   2HD2  LEU  11          HD22      LEU  11  -1.392   4.150  -5.741
  228   3HD2  LEU  11          HD23      LEU  11  -1.101   3.860  -4.025
  229    H    THR  12           H        THR  12  -0.356   0.422  -8.923
  230    HA   THR  12           HA       THR  12  -1.514  -1.764  -7.407
  231    HB   THR  12           HB       THR  12  -1.339  -1.303 -10.398
  232    HG1  THR  12           HG1      THR  12  -3.277  -0.363 -10.179
  233   1HG2  THR  12          HG21      THR  12  -3.488  -2.872 -10.105
  234   2HG2  THR  12          HG22      THR  12  -2.552  -3.445  -8.725
  235   3HG2  THR  12          HG23      THR  12  -1.872  -3.535 -10.350
  236    H    GLU  13           H        GLU  13   1.045  -1.478  -9.869
  237    HA   GLU  13           HA       GLU  13   1.771  -4.156 -10.158
  238   1HB   GLU  13          HB2       GLU  13   3.025  -1.583 -10.569
  239   2HB   GLU  13          HB1       GLU  13   4.205  -2.734  -9.943
  240   1HG   GLU  13          HG2       GLU  13   2.662  -4.145 -11.850
  241   2HG   GLU  13          HG1       GLU  13   3.054  -2.589 -12.583
  242    H    ALA  14           H        ALA  14   3.332  -1.924  -7.812
  243    HA   ALA  14           HA       ALA  14   4.644  -3.945  -6.319
  244   1HB   ALA  14          HB1       ALA  14   5.017  -2.298  -4.670
  245   2HB   ALA  14          HB2       ALA  14   3.493  -1.480  -5.015
  246   3HB   ALA  14          HB3       ALA  14   4.839  -1.353  -6.147
  247    H    LEU  15           H        LEU  15   1.548  -2.309  -5.554
  248    HA   LEU  15           HA       LEU  15   0.736  -3.845  -3.370
  249   1HB   LEU  15          HB2       LEU  15  -0.714  -2.474  -5.597
  250   2HB   LEU  15          HB1       LEU  15  -1.637  -3.569  -4.573
  251    HG   LEU  15           HG       LEU  15   0.090  -1.315  -3.517
  252   1HD1  LEU  15          HD11      LEU  15  -1.786  -0.401  -4.788
  253   2HD1  LEU  15          HD12      LEU  15  -2.099  -0.200  -3.063
  254   3HD1  LEU  15          HD13      LEU  15  -2.907  -1.483  -3.963
  255   1HD2  LEU  15          HD21      LEU  15  -1.584  -3.472  -2.328
  256   2HD2  LEU  15          HD22      LEU  15  -1.703  -1.879  -1.579
  257   3HD2  LEU  15          HD23      LEU  15  -0.140  -2.690  -1.687
  258    H    TYR  16           H        TYR  16   0.223  -4.552  -6.812
  259    HA   TYR  16           HA       TYR  16  -1.116  -7.010  -6.598
  260   1HB   TYR  16          HB2       TYR  16  -0.170  -5.527  -8.657
  261   2HB   TYR  16          HB1       TYR  16   1.010  -6.830  -8.657
  262    HD1  TYR  16           HD1      TYR  16  -2.436  -5.886  -9.306
  263    HD2  TYR  16           HD2      TYR  16   0.275  -9.194  -8.915
  264    HE1  TYR  16           HE1      TYR  16  -4.083  -7.361 -10.427
  265    HE2  TYR  16           HE2      TYR  16  -1.371 -10.674 -10.037
  266    HH   TYR  16           HH       TYR  16  -3.300 -10.751 -11.175
  267    H    LEU  17           H        LEU  17   2.356  -6.322  -6.350
  268    HA   LEU  17           HA       LEU  17   3.005  -9.172  -6.154
  269   1HB   LEU  17          HB2       LEU  17   4.439  -7.159  -7.105
  270   2HB   LEU  17          HB1       LEU  17   4.962  -7.037  -5.423
  271    HG   LEU  17           HG       LEU  17   5.074  -9.542  -7.132
  272   1HD1  LEU  17          HD11      LEU  17   6.862  -8.263  -7.894
  273   2HD1  LEU  17          HD12      LEU  17   7.608  -9.128  -6.551
  274   3HD1  LEU  17          HD13      LEU  17   7.081  -7.458  -6.341
  275   1HD2  LEU  17          HD21      LEU  17   4.885 -10.449  -5.022
  276   2HD2  LEU  17          HD22      LEU  17   5.473  -8.989  -4.228
  277   3HD2  LEU  17          HD23      LEU  17   6.612 -10.093  -4.996
  278    H    VAL  18           H        VAL  18   3.455  -6.378  -3.923
  279    HA   VAL  18           HA       VAL  18   4.326  -7.671  -1.659
  280    HB   VAL  18           HB       VAL  18   2.368  -6.125  -0.513
  281   1HG1  VAL  18          HG11      VAL  18   5.166  -5.715  -1.400
  282   2HG1  VAL  18          HG12      VAL  18   4.462  -5.611   0.214
  283   3HG1  VAL  18          HG13      VAL  18   4.265  -4.277  -0.922
  284   1HG2  VAL  18          HG21      VAL  18   1.798  -5.616  -3.046
  285   2HG2  VAL  18          HG22      VAL  18   3.182  -4.530  -2.916
  286   3HG2  VAL  18          HG23      VAL  18   1.792  -4.318  -1.852
  287    H    CYS  19           H        CYS  19   0.991  -7.513  -2.741
  288    HA   CYS  19           HA       CYS  19   0.307  -9.606  -0.742
  289   1HB   CYS  19          HB2       CYS  19  -1.885  -8.471  -2.342
  290   2HB   CYS  19          HB1       CYS  19  -1.756  -8.665  -0.610
  291    H    GLY  20           H        GLY  20  -0.851  -8.766  -4.003
  292   1HA   GLY  20          HA2       GLY  20  -1.358 -10.155  -5.835
  293   2HA   GLY  20          HA1       GLY  20   0.085 -11.058  -5.362
  294    H    GLU  21           H        GLU  21  -0.172 -13.016  -4.282
  295    HA   GLU  21           HA       GLU  21  -2.638 -14.390  -4.454
  296   1HB   GLU  21          HB2       GLU  21  -0.348 -14.835  -2.507
  297   2HB   GLU  21          HB1       GLU  21  -1.643 -15.991  -2.819
  298   1HG   GLU  21          HG2       GLU  21  -0.750 -15.370  -5.364
  299   2HG   GLU  21          HG1       GLU  21   0.740 -15.381  -4.418
  300    H    ARG  22           H        ARG  22  -1.322 -12.269  -1.988
  301    HA   ARG  22           HA       ARG  22  -3.224 -12.835   0.062
  302   1HB   ARG  22          HB2       ARG  22  -1.351 -10.614  -0.580
  303   2HB   ARG  22          HB1       ARG  22  -2.618 -10.302   0.601
  304   1HG   ARG  22          HG2       ARG  22  -0.650 -11.103   1.775
  305   2HG   ARG  22          HG1       ARG  22  -1.897 -12.345   1.845
  306   1HD   ARG  22          HD2       ARG  22  -0.298 -13.752   1.081
  307   2HD   ARG  22          HD1       ARG  22  -0.545 -12.980  -0.478
  308    HE   ARG  22           HE       ARG  22   1.409 -11.582  -0.038
  309   1HH1  ARG  22          HH21      ARG  22   1.526 -14.667   1.098
  310   2HH1  ARG  22          HH22      ARG  22   2.744 -14.402   2.300
  311   1HH2  ARG  22          HH11      ARG  22   2.635 -10.946   2.030
  312   2HH2  ARG  22          HH12      ARG  22   3.372 -12.295   2.827
  313    H    GLY  23           H        GLY  23  -3.554 -11.376  -2.983
  314   1HA   GLY  23          HA2       GLY  23  -5.428 -10.404  -4.010
  315   2HA   GLY  23          HA1       GLY  23  -6.359 -10.888  -2.595
  316    H    PHE  24           H        PHE  24  -3.820  -8.462  -3.402
  317    HA   PHE  24           HA       PHE  24  -4.437  -6.657  -1.314
  318   1HB   PHE  24          HB2       PHE  24  -3.229  -5.031  -2.541
  319   2HB   PHE  24          HB1       PHE  24  -2.543  -6.560  -3.080
  320    HD1  PHE  24           HD1      PHE  24  -3.760  -3.486  -4.197
  321    HD2  PHE  24           HD2      PHE  24  -3.894  -7.680  -5.125
  322    HE1  PHE  24           HE1      PHE  24  -4.321  -2.946  -6.553
  323    HE2  PHE  24           HE2      PHE  24  -4.452  -7.140  -7.480
  324    HZ   PHE  24           HZ       PHE  24  -4.662  -4.776  -8.196
  325    H    PHE  25           H        PHE  25  -5.685  -4.476  -1.655
  326    HA   PHE  25           HA       PHE  25  -7.948  -4.902  -3.543
  327   1HB   PHE  25          HB2       PHE  25  -9.589  -4.796  -1.942
  328   2HB   PHE  25          HB1       PHE  25  -8.313  -5.545  -0.992
  329    HD1  PHE  25           HD1      PHE  25 -10.804  -3.562  -0.359
  330    HD2  PHE  25           HD2      PHE  25  -6.527  -3.185  -0.524
  331    HE1  PHE  25           HE1      PHE  25 -10.913  -1.668   1.237
  332    HE2  PHE  25           HE2      PHE  25  -6.634  -1.289   1.074
  333    HZ   PHE  25           HZ       PHE  25  -8.826  -0.531   1.955
  334    H    TYR  26           H        TYR  26  -5.943  -3.196  -4.195
  335    HA   TYR  26           HA       TYR  26  -5.900  -0.539  -3.426
  336   1HB   TYR  26          HB2       TYR  26  -4.508  -1.163  -5.237
  337   2HB   TYR  26          HB1       TYR  26  -5.857  -1.810  -6.161
  338    HD1  TYR  26           HD1      TYR  26  -5.952   1.429  -4.356
  339    HD2  TYR  26           HD2      TYR  26  -5.506  -0.532  -8.153
  340    HE1  TYR  26           HE1      TYR  26  -6.188   3.611  -5.515
  341    HE2  TYR  26           HE2      TYR  26  -5.747   1.644  -9.312
  342    HH   TYR  26           HH       TYR  26  -5.235   4.376  -8.204
  343    H    THR  27           H        THR  27  -7.642   0.663  -2.841
  344    HA   THR  27           HA       THR  27 -10.234   0.263  -4.176
  345    HB   THR  27           HB       THR  27 -10.130   0.508  -1.726
  346    HG1  THR  27           HG1      THR  27 -12.021   1.316  -2.072
  347   1HG2  THR  27          HG21      THR  27  -9.737   3.312  -1.485
  348   2HG2  THR  27          HG22      THR  27  -8.388   2.678  -2.427
  349   3HG2  THR  27          HG23      THR  27  -8.733   2.020  -0.828
  350    H    LYS  28           H        LYS  28  -9.719   1.164  -6.285
  351    HA   LYS  28           HA       LYS  28 -10.631   3.723  -6.768
  352   1HB   LYS  28          HB2       LYS  28  -8.036   3.867  -5.567
  353   2HB   LYS  28          HB1       LYS  28  -7.917   4.432  -7.232
  354   1HG   LYS  28          HG2       LYS  28  -9.467   6.150  -6.906
  355   2HG   LYS  28          HG1       LYS  28 -10.188   5.366  -5.501
  356   1HD   LYS  28          HD2       LYS  28  -8.787   6.448  -4.114
  357   2HD   LYS  28          HD1       LYS  28  -7.385   5.873  -5.018
  358   1HE   LYS  28          HE2       LYS  28  -7.075   7.954  -5.812
  359   2HE   LYS  28          HE1       LYS  28  -8.640   7.853  -6.620
  360   1HZ   LYS  28          HZ1       LYS  28  -9.688   8.589  -4.552
  361   2HZ   LYS  28          HZ2       LYS  28  -8.584   9.738  -5.141
  362   3HZ   LYS  28          HZ3       LYS  28  -8.163   8.747  -3.828
  363    HA   PRO  29           HA       PRO  29  -9.536   1.261 -10.476
  364   1HB   PRO  29          HB2       PRO  29 -12.119   1.147 -11.409
  365   2HB   PRO  29          HB1       PRO  29 -11.434  -0.040 -10.285
  366   1HG   PRO  29          HG2       PRO  29 -13.376   2.155  -9.740
  367   2HG   PRO  29          HG1       PRO  29 -13.142   0.624  -8.880
  368   1HD   PRO  29          HD2       PRO  29 -12.206   3.162  -8.040
  369   2HD   PRO  29          HD1       PRO  29 -11.716   1.593  -7.370
  370    H    THR  30           H        THR  30  -8.520   2.957 -11.623
  371    HA   THR  30           HA       THR  30  -9.632   5.485 -12.226
  372    HB   THR  30           HB       THR  30  -7.819   4.087 -14.177
  373    HG1  THR  30           HG1      THR  30  -7.327   4.775 -11.504
  374   1HG2  THR  30          HG21      THR  30  -7.995   6.886 -13.034
  375   2HG2  THR  30          HG22      THR  30  -8.454   6.384 -14.661
  376   3HG2  THR  30          HG23      THR  30  -6.760   6.349 -14.172
  Start of MODEL   11
    1   1H    GLY   1           HT1      GLY   1  -7.478   8.951  -0.766
    2   2H    GLY   1           HT2      GLY   1  -7.206   9.104  -2.435
    3   3H    GLY   1           HT3      GLY   1  -5.951   9.425  -1.336
    4   1HA   GLY   1          HA1       GLY   1  -6.405   6.939  -0.715
    5   2HA   GLY   1          HA2       GLY   1  -7.022   6.845  -2.392
    6    H    ILE   2           H        ILE   2  -5.271   5.188  -0.801
    7    HA   ILE   2           HA       ILE   2  -2.760   5.859  -0.015
    8    HB   ILE   2           HB       ILE   2  -3.690   3.621   0.072
    9   1HG1  ILE   2          HG12      ILE   2  -1.446   2.734  -1.389
   10   2HG1  ILE   2          HG11      ILE   2  -1.026   4.318  -0.717
   11   1HG2  ILE   2          HG21      ILE   2  -3.613   2.186  -1.955
   12   2HG2  ILE   2          HG22      ILE   2  -3.243   3.620  -2.915
   13   3HG2  ILE   2          HG23      ILE   2  -4.790   3.494  -2.077
   14   1HD1  ILE   2          HD11      ILE   2  -0.895   2.042   0.716
   15   2HD1  ILE   2          HD12      ILE   2  -2.559   2.523   1.024
   16   3HD1  ILE   2          HD13      ILE   2  -1.244   3.618   1.432
   17    H    VAL   3           H        VAL   3  -3.889   6.045  -3.332
   18    HA   VAL   3           HA       VAL   3  -1.583   5.714  -4.828
   19    HB   VAL   3           HB       VAL   3  -3.606   7.959  -5.033
   20   1HG1  VAL   3          HG11      VAL   3  -1.024   7.652  -6.299
   21   2HG1  VAL   3          HG12      VAL   3  -2.197   8.955  -6.487
   22   3HG1  VAL   3          HG13      VAL   3  -2.301   7.521  -7.509
   23   1HG2  VAL   3          HG21      VAL   3  -4.607   6.624  -6.732
   24   2HG2  VAL   3          HG22      VAL   3  -4.251   5.500  -5.421
   25   3HG2  VAL   3          HG23      VAL   3  -3.200   5.564  -6.836
   26    H    GLU   4           H        GLU   4  -2.460   8.992  -3.702
   27    HA   GLU   4           HA       GLU   4   0.244   9.890  -3.907
   28   1HB   GLU   4          HB2       GLU   4  -0.650  11.886  -2.647
   29   2HB   GLU   4          HB1       GLU   4  -1.547  11.495  -4.106
   30   1HG   GLU   4          HG2       GLU   4  -2.584  10.040  -1.816
   31   2HG   GLU   4          HG1       GLU   4  -2.597  11.779  -1.523
   32    H    GLN   5           H        GLN   5  -1.677   8.532  -1.273
   33    HA   GLN   5           HA       GLN   5  -0.068   9.250   0.927
   34   1HB   GLN   5          HB2       GLN   5  -2.231   7.773   0.841
   35   2HB   GLN   5          HB1       GLN   5  -1.103   6.434   0.619
   36   1HG   GLN   5          HG2       GLN   5  -0.940   6.401   2.876
   37   2HG   GLN   5          HG1       GLN   5   0.037   7.858   2.699
   38   1HE2  GLN   5          HE21      GLN   5  -0.808   8.690   4.772
   39   2HE2  GLN   5          HE22      GLN   5  -2.384   9.312   4.873
   40    H    CYS   6           H        CYS   6   0.401   6.884  -1.618
   41    HA   CYS   6           HA       CYS   6   3.059   6.196  -0.463
   42   1HB   CYS   6          HB2       CYS   6   1.388   4.797  -2.570
   43   2HB   CYS   6          HB1       CYS   6   3.021   4.319  -2.119
   44    H    CYS   7           H        CYS   7   1.464   7.807  -3.122
   45    HA   CYS   7           HA       CYS   7   3.955   7.834  -4.701
   46   1HB   CYS   7          HB2       CYS   7   1.756   7.609  -5.852
   47   2HB   CYS   7          HB1       CYS   7   1.313   9.212  -5.289
   48    H    THR   8           H        THR   8   1.848  10.694  -4.360
   49    HA   THR   8           HA       THR   8   3.830  12.630  -4.298
   50    HB   THR   8           HB       THR   8   1.768  13.123  -2.247
   51    HG1  THR   8           HG1      THR   8   0.113  13.134  -3.885
   52   1HG2  THR   8          HG21      THR   8   3.303  14.672  -3.807
   53   2HG2  THR   8          HG22      THR   8   1.722  15.199  -3.229
   54   3HG2  THR   8          HG23      THR   8   1.893  14.550  -4.859
   55    H    SER   9           H        SER   9   2.699  10.572  -1.715
   56    HA   SER   9           HA       SER   9   5.021  11.423  -0.035
   57   1HB   SER   9          HB2       SER   9   2.324  11.338   0.690
   58   2HB   SER   9          HB1       SER   9   2.958   9.811   1.295
   59    HG   SER   9           HG       SER   9   4.442  12.154   1.694
   60    H    ILE  10           H        ILE  10   5.302   9.152   1.516
   61    HA   ILE  10           HA       ILE  10   5.325   6.930  -0.472
   62    HB   ILE  10           HB       ILE  10   7.656   7.807   1.260
   63   1HG1  ILE  10          HG12      ILE  10   8.782   7.884  -1.007
   64   2HG1  ILE  10          HG11      ILE  10   7.192   7.659  -1.736
   65   1HG2  ILE  10          HG21      ILE  10   8.755   5.827   0.688
   66   2HG2  ILE  10          HG22      ILE  10   7.713   5.542  -0.697
   67   3HG2  ILE  10          HG23      ILE  10   7.108   5.250   0.925
   68   1HD1  ILE  10          HD11      ILE  10   7.124   9.770   0.252
   69   2HD1  ILE  10          HD12      ILE  10   6.684   9.831  -1.456
   70   3HD1  ILE  10          HD13      ILE  10   8.357  10.093  -0.969
   71    H    CYS  11           H        CYS  11   5.034   4.858   0.429
   72    HA   CYS  11           HA       CYS  11   4.429   4.904   3.373
   73   1HB   CYS  11          HB2       CYS  11   2.911   2.926   2.854
   74   2HB   CYS  11          HB1       CYS  11   2.363   4.483   2.241
   75    H    SER  12           H        SER  12   4.719   2.741   4.444
   76    HA   SER  12           HA       SER  12   7.296   1.585   3.567
   77   1HB   SER  12          HB2       SER  12   6.756   0.271   5.852
   78   2HB   SER  12          HB1       SER  12   7.462   1.885   5.844
   79    HG   SER  12           HG       SER  12   5.462   1.439   7.156
   80    H    LEU  13           H        LEU  13   7.453  -0.899   3.882
   81    HA   LEU  13           HA       LEU  13   5.589  -2.159   2.096
   82   1HB   LEU  13          HB2       LEU  13   7.918  -3.006   3.740
   83   2HB   LEU  13          HB1       LEU  13   6.771  -4.274   3.303
   84    HG   LEU  13           HG       LEU  13   8.691  -3.859   1.654
   85   1HD1  LEU  13          HD11      LEU  13   7.299  -4.950   0.266
   86   2HD1  LEU  13          HD12      LEU  13   6.456  -3.443  -0.091
   87   3HD1  LEU  13          HD13      LEU  13   5.932  -4.447   1.260
   88   1HD2  LEU  13          HD21      LEU  13   8.496  -1.346   1.826
   89   2HD2  LEU  13          HD22      LEU  13   6.978  -1.461   0.936
   90   3HD2  LEU  13          HD23      LEU  13   8.488  -1.955   0.171
   91    H    TYR  14           H        TYR  14   5.977  -2.270   5.643
   92    HA   TYR  14           HA       TYR  14   4.076  -4.219   6.279
   93   1HB   TYR  14          HB2       TYR  14   5.443  -3.133   7.992
   94   2HB   TYR  14          HB1       TYR  14   4.618  -1.600   7.712
   95    HD1  TYR  14           HD1      TYR  14   3.756  -5.187   8.430
   96    HD2  TYR  14           HD2      TYR  14   2.879  -1.043   9.153
   97    HE1  TYR  14           HE1      TYR  14   1.988  -5.843  10.043
   98    HE2  TYR  14           HE2      TYR  14   1.111  -1.698  10.765
   99    HH   TYR  14           HH       TYR  14  -0.070  -4.876  11.011
  100    H    GLN  15           H        GLN  15   3.537  -0.829   5.383
  101    HA   GLN  15           HA       GLN  15   0.693  -0.911   5.910
  102   1HB   GLN  15          HB2       GLN  15   2.185   0.929   4.005
  103   2HB   GLN  15          HB1       GLN  15   0.631   1.242   4.777
  104   1HG   GLN  15          HG2       GLN  15   2.731   0.573   6.705
  105   2HG   GLN  15          HG1       GLN  15   3.105   2.018   5.764
  106   1HE2  GLN  15          HE21      GLN  15   0.428   0.566   7.693
  107   2HE2  GLN  15          HE22      GLN  15  -0.198   2.055   8.216
  108    H    LEU  16           H        LEU  16   2.523  -0.950   2.791
  109    HA   LEU  16           HA       LEU  16   0.383  -1.412   1.064
  110   1HB   LEU  16          HB2       LEU  16   3.242  -2.192   1.088
  111   2HB   LEU  16          HB1       LEU  16   2.205  -3.150   0.029
  112    HG   LEU  16           HG       LEU  16   1.304  -0.646  -0.537
  113   1HD1  LEU  16          HD11      LEU  16   4.254  -0.425   0.125
  114   2HD1  LEU  16          HD12      LEU  16   2.934   0.486   0.859
  115   3HD1  LEU  16          HD13      LEU  16   3.364   0.762  -0.828
  116   1HD2  LEU  16          HD21      LEU  16   3.391  -2.432  -1.719
  117   2HD2  LEU  16          HD22      LEU  16   3.183  -0.826  -2.415
  118   3HD2  LEU  16          HD23      LEU  16   1.825  -1.951  -2.373
  119    H    GLU  17           H        GLU  17   1.789  -3.492   3.459
  120    HA   GLU  17           HA       GLU  17   0.402  -5.932   2.623
  121   1HB   GLU  17          HB2       GLU  17   1.679  -5.166   5.274
  122   2HB   GLU  17          HB1       GLU  17   1.086  -6.774   4.870
  123   1HG   GLU  17          HG2       GLU  17   3.449  -5.296   3.719
  124   2HG   GLU  17          HG1       GLU  17   3.401  -6.900   4.447
  125    H    ASN  18           H        ASN  18   0.027  -3.407   5.053
  126    HA   ASN  18           HA       ASN  18  -2.277  -4.394   6.343
  127   1HB   ASN  18          HB2       ASN  18  -2.068  -2.493   7.552
  128   2HB   ASN  18          HB1       ASN  18  -0.623  -2.213   6.603
  129   1HD2  ASN  18          HD21      ASN  18  -1.595  -1.454   4.165
  130   2HD2  ASN  18          HD22      ASN  18  -2.499  -0.043   4.335
  131    H    TYR  19           H        TYR  19  -1.917  -3.042   3.167
  132    HA   TYR  19           HA       TYR  19  -4.875  -2.804   2.980
  133   1HB   TYR  19          HB2       TYR  19  -2.704  -1.735   1.158
  134   2HB   TYR  19          HB1       TYR  19  -4.433  -1.616   0.821
  135    HD1  TYR  19           HD1      TYR  19  -2.267   0.617   1.411
  136    HD2  TYR  19           HD2      TYR  19  -5.313  -1.302   3.749
  137    HE1  TYR  19           HE1      TYR  19  -2.386   2.593   2.894
  138    HE2  TYR  19           HE2      TYR  19  -5.431   0.655   5.227
  139    HH   TYR  19           HH       TYR  19  -4.258   2.572   5.859
  140    H    CYS  20           H        CYS  20  -2.308  -4.874   2.202
  141    HA   CYS  20           HA       CYS  20  -3.186  -6.003  -0.256
  142   1HB   CYS  20          HB2       CYS  20  -1.707  -7.074   2.141
  143   2HB   CYS  20          HB1       CYS  20  -2.089  -8.109   0.796
  144    H    ASN  21           H        ASN  21  -4.209  -8.416  -0.164
  145    HA   ASN  21           HA       ASN  21  -6.796  -8.094   1.130
  146   1HB   ASN  21          HB2       ASN  21  -6.009  -9.505  -1.039
  147   2HB   ASN  21          HB1       ASN  21  -5.995 -10.789   0.171
  148   1HD2  ASN  21          HD21      ASN  21  -7.957 -11.884   0.068
  149   2HD2  ASN  21          HD22      ASN  21  -9.477 -11.146  -0.096
  150   1H    PHE   1           HT1      PHE   1  11.632  -2.702   1.451
  151   2H    PHE   1           HT2      PHE   1  10.210  -2.773   0.523
  152   3H    PHE   1           HT3      PHE   1  10.671  -1.316   1.267
  153    HA   PHE   1           HA       PHE   1  12.588  -2.517  -0.571
  154   1HB   PHE   1          HB2       PHE   1  10.026  -1.153  -1.455
  155   2HB   PHE   1          HB1       PHE   1  11.406  -1.476  -2.506
  156    HD1  PHE   1           HD1      PHE   1   8.279  -2.651  -1.837
  157    HD2  PHE   1           HD2      PHE   1  12.330  -4.080  -1.948
  158    HE1  PHE   1           HE1      PHE   1   7.455  -4.960  -2.212
  159    HE2  PHE   1           HE2      PHE   1  11.506  -6.390  -2.323
  160    HZ   PHE   1           HZ       PHE   1   9.068  -6.830  -2.456
  161    H    VAL   2           H        VAL   2  13.075  -0.391  -2.103
  162    HA   VAL   2           HA       VAL   2  14.072   1.583  -0.191
  163    HB   VAL   2           HB       VAL   2  15.204   0.685  -2.373
  164   1HG1  VAL   2          HG11      VAL   2  14.455   1.385  -4.387
  165   2HG1  VAL   2          HG12      VAL   2  14.177   3.028  -3.812
  166   3HG1  VAL   2          HG13      VAL   2  12.958   1.783  -3.544
  167   1HG2  VAL   2          HG21      VAL   2  15.913   3.314  -2.741
  168   2HG2  VAL   2          HG22      VAL   2  16.576   2.264  -1.488
  169   3HG2  VAL   2          HG23      VAL   2  15.237   3.349  -1.112
  170    H    ASN   3           H        ASN   3  13.708   3.824  -2.213
  171    HA   ASN   3           HA       ASN   3  11.608   5.228  -1.141
  172   1HB   ASN   3          HB2       ASN   3  11.598   6.586  -3.100
  173   2HB   ASN   3          HB1       ASN   3  13.244   5.970  -2.964
  174   1HD2  ASN   3          HD21      ASN   3  14.057   4.925  -4.792
  175   2HD2  ASN   3          HD22      ASN   3  13.111   4.344  -6.076
  176    H    GLN   4           H        GLN   4   9.434   4.992  -1.073
  177    HA   GLN   4           HA       GLN   4   8.206   2.987  -2.916
  178   1HB   GLN   4          HB2       GLN   4   8.213   2.895  -0.213
  179   2HB   GLN   4          HB1       GLN   4   6.755   3.855  -0.466
  180   1HG   GLN   4          HG2       GLN   4   6.028   1.582  -0.455
  181   2HG   GLN   4          HG1       GLN   4   6.044   2.062  -2.153
  182   1HE2  GLN   4          HE21      GLN   4   6.467  -0.106  -2.947
  183   2HE2  GLN   4          HE22      GLN   4   7.957  -0.880  -2.691
  184    H    HIS   5           H        HIS   5   8.296   5.135  -4.307
  185    HA   HIS   5           HA       HIS   5   5.980   6.894  -3.731
  186   1HB   HIS   5          HB2       HIS   5   7.953   7.104  -6.019
  187   2HB   HIS   5          HB1       HIS   5   6.850   8.354  -5.443
  188    HD2  HIS   5           HD2      HIS   5   9.514   6.223  -3.386
  189    HE1  HIS   5           HE1      HIS   5  10.073  10.342  -2.614
  190    HE2  HIS   5           HE2      HIS   5  10.876   7.989  -2.043
  191    H    LEU   6           H        LEU   6   4.331   5.326  -4.209
  192    HA   LEU   6           HA       LEU   6   4.232   4.457  -7.065
  193   1HB   LEU   6          HB2       LEU   6   3.233   3.242  -4.520
  194   2HB   LEU   6          HB1       LEU   6   2.536   2.801  -6.070
  195    HG   LEU   6           HG       LEU   6   4.447   1.689  -6.756
  196   1HD1  LEU   6          HD11      LEU   6   6.015   3.545  -4.939
  197   2HD1  LEU   6          HD12      LEU   6   5.945   3.613  -6.701
  198   3HD1  LEU   6          HD13      LEU   6   6.731   2.253  -5.902
  199   1HD2  LEU   6          HD21      LEU   6   4.964   1.679  -3.775
  200   2HD2  LEU   6          HD22      LEU   6   5.308   0.391  -4.930
  201   3HD2  LEU   6          HD23      LEU   6   3.639   0.787  -4.520
  202    H    CYS   7           H        CYS   7   2.582   5.142  -8.308
  203    HA   CYS   7           HA       CYS   7   0.104   6.051  -6.973
  204   1HB   CYS   7          HB2       CYS   7   0.373   7.779  -9.177
  205   2HB   CYS   7          HB1       CYS   7   0.480   8.217  -7.477
  206    H    GLY   8           H        GLY   8  -1.758   6.019  -8.471
  207   1HA   GLY   8          HA2       GLY   8  -3.046   4.814 -10.024
  208   2HA   GLY   8          HA1       GLY   8  -1.767   5.261 -11.152
  209    H    SER   9           H        SER   9  -1.573   3.343 -12.278
  210    HA   SER   9           HA       SER   9  -1.760   0.724 -11.283
  211   1HB   SER   9          HB2       SER   9   0.319   1.113 -13.339
  212   2HB   SER   9          HB1       SER   9  -1.117   0.096 -13.371
  213    HG   SER   9           HG       SER   9  -1.181   1.903 -14.836
  214    H    ASP  10           H        ASP  10   1.162   2.779 -11.520
  215    HA   ASP  10           HA       ASP  10   3.133   1.001 -10.718
  216   1HB   ASP  10          HB2       ASP  10   2.735   3.840  -9.719
  217   2HB   ASP  10          HB1       ASP  10   4.234   2.923  -9.570
  218    H    LEU  11           H        LEU  11   0.577   2.406  -8.751
  219    HA   LEU  11           HA       LEU  11   1.623   1.337  -6.255
  220   1HB   LEU  11          HB2       LEU  11   0.049   3.347  -6.523
  221   2HB   LEU  11          HB1       LEU  11  -1.229   2.168  -6.806
  222    HG   LEU  11           HG       LEU  11  -0.940   1.210  -4.614
  223   1HD1  LEU  11          HD11      LEU  11   1.438   3.066  -4.371
  224   2HD1  LEU  11          HD12      LEU  11   1.509   1.306  -4.476
  225   3HD1  LEU  11          HD13      LEU  11   0.794   2.079  -3.065
  226   1HD2  LEU  11          HD21      LEU  11  -1.499   3.071  -3.215
  227   2HD2  LEU  11          HD22      LEU  11  -2.134   3.436  -4.820
  228   3HD2  LEU  11          HD23      LEU  11  -0.641   4.196  -4.267
  229    H    THR  12           H        THR  12  -0.954   0.404  -8.536
  230    HA   THR  12           HA       THR  12  -1.760  -1.952  -7.119
  231    HB   THR  12           HB       THR  12  -1.734  -1.469 -10.115
  232    HG1  THR  12           HG1      THR  12  -4.049  -1.044  -9.512
  233   1HG2  THR  12          HG21      THR  12  -3.881  -3.103  -9.044
  234   2HG2  THR  12          HG22      THR  12  -2.302  -3.794  -8.669
  235   3HG2  THR  12          HG23      THR  12  -2.745  -3.464 -10.345
  236    H    GLU  13           H        GLU  13   0.629  -1.406  -9.700
  237    HA   GLU  13           HA       GLU  13   1.576  -3.992 -10.110
  238   1HB   GLU  13          HB2       GLU  13   2.516  -1.329 -10.563
  239   2HB   GLU  13          HB1       GLU  13   3.854  -2.273  -9.910
  240   1HG   GLU  13          HG2       GLU  13   3.268  -4.069 -11.615
  241   2HG   GLU  13          HG1       GLU  13   2.179  -2.894 -12.354
  242    H    ALA  14           H        ALA  14   2.987  -1.692  -7.746
  243    HA   ALA  14           HA       ALA  14   4.575  -3.635  -6.398
  244   1HB   ALA  14          HB1       ALA  14   3.870  -0.868  -6.038
  245   2HB   ALA  14          HB2       ALA  14   5.250  -1.743  -5.376
  246   3HB   ALA  14          HB3       ALA  14   3.724  -1.704  -4.492
  247    H    LEU  15           H        LEU  15   1.406  -2.261  -5.432
  248    HA   LEU  15           HA       LEU  15   0.845  -3.884  -3.225
  249   1HB   LEU  15          HB2       LEU  15  -0.825  -2.612  -5.352
  250   2HB   LEU  15          HB1       LEU  15  -1.599  -3.829  -4.343
  251    HG   LEU  15           HG       LEU  15  -0.040  -1.506  -3.196
  252   1HD1  LEU  15          HD11      LEU  15  -2.153  -0.975  -4.659
  253   2HD1  LEU  15          HD12      LEU  15  -2.003  -0.234  -3.065
  254   3HD1  LEU  15          HD13      LEU  15  -3.045  -1.638  -3.289
  255   1HD2  LEU  15          HD21      LEU  15  -0.740  -2.273  -1.148
  256   2HD2  LEU  15          HD22      LEU  15  -0.814  -3.813  -2.004
  257   3HD2  LEU  15          HD23      LEU  15  -2.279  -2.857  -1.780
  258    H    TYR  16           H        TYR  16   0.166  -4.595  -6.639
  259    HA   TYR  16           HA       TYR  16  -0.918  -7.161  -6.366
  260   1HB   TYR  16          HB2       TYR  16  -0.213  -5.593  -8.466
  261   2HB   TYR  16          HB1       TYR  16   1.066  -6.799  -8.542
  262    HD1  TYR  16           HD1      TYR  16  -1.978  -6.051  -9.877
  263    HD2  TYR  16           HD2      TYR  16   0.001  -9.298  -7.881
  264    HE1  TYR  16           HE1      TYR  16  -3.572  -7.647 -10.907
  265    HE2  TYR  16           HE2      TYR  16  -1.591 -10.899  -8.909
  266    HH   TYR  16           HH       TYR  16  -3.095 -11.078 -10.750
  267    H    LEU  17           H        LEU  17   2.513  -6.201  -6.530
  268    HA   LEU  17           HA       LEU  17   3.518  -8.884  -6.364
  269   1HB   LEU  17          HB2       LEU  17   4.682  -6.757  -7.211
  270   2HB   LEU  17          HB1       LEU  17   5.010  -6.415  -5.512
  271    HG   LEU  17           HG       LEU  17   6.837  -7.667  -6.635
  272   1HD1  LEU  17          HD11      LEU  17   7.305  -8.908  -4.744
  273   2HD1  LEU  17          HD12      LEU  17   5.686  -9.606  -4.688
  274   3HD1  LEU  17          HD13      LEU  17   5.954  -7.956  -4.126
  275   1HD2  LEU  17          HD21      LEU  17   4.924  -9.029  -7.924
  276   2HD2  LEU  17          HD22      LEU  17   5.207 -10.150  -6.593
  277   3HD2  LEU  17          HD23      LEU  17   6.535  -9.700  -7.663
  278    H    VAL  18           H        VAL  18   3.680  -6.249  -3.913
  279    HA   VAL  18           HA       VAL  18   4.609  -7.657  -1.744
  280    HB   VAL  18           HB       VAL  18   2.539  -6.312  -0.517
  281   1HG1  VAL  18          HG11      VAL  18   4.182  -4.542  -0.154
  282   2HG1  VAL  18          HG12      VAL  18   5.156  -5.154  -1.492
  283   3HG1  VAL  18          HG13      VAL  18   4.948  -6.126  -0.034
  284   1HG2  VAL  18          HG21      VAL  18   1.818  -4.519  -1.745
  285   2HG2  VAL  18          HG22      VAL  18   2.142  -5.605  -3.092
  286   3HG2  VAL  18          HG23      VAL  18   3.334  -4.390  -2.637
  287    H    CYS  19           H        CYS  19   1.247  -7.604  -2.789
  288    HA   CYS  19           HA       CYS  19   0.634  -9.777  -0.871
  289   1HB   CYS  19          HB2       CYS  19  -1.492  -9.009  -2.749
  290   2HB   CYS  19          HB1       CYS  19  -1.526  -9.101  -1.001
  291    H    GLY  20           H        GLY  20  -0.247  -9.239  -4.279
  292   1HA   GLY  20          HA2       GLY  20  -0.269 -10.730  -6.099
  293   2HA   GLY  20          HA1       GLY  20   1.080 -11.553  -5.309
  294    H    GLU  21           H        GLU  21   0.658 -13.395  -4.051
  295    HA   GLU  21           HA       GLU  21  -1.773 -14.816  -4.600
  296   1HB   GLU  21          HB2       GLU  21   0.179 -15.280  -2.320
  297   2HB   GLU  21          HB1       GLU  21  -0.978 -16.448  -2.957
  298   1HG   GLU  21          HG2       GLU  21   0.190 -16.163  -5.214
  299   2HG   GLU  21          HG1       GLU  21   1.464 -15.318  -4.334
  300    H    ARG  22           H        ARG  22  -0.673 -12.776  -1.956
  301    HA   ARG  22           HA       ARG  22  -3.096 -13.212  -0.384
  302   1HB   ARG  22          HB2       ARG  22  -0.903 -11.127  -0.160
  303   2HB   ARG  22          HB1       ARG  22  -2.207 -11.344   1.009
  304   1HG   ARG  22          HG2       ARG  22  -0.115 -13.408   0.261
  305   2HG   ARG  22          HG1       ARG  22  -0.207 -12.522   1.784
  306   1HD   ARG  22          HD2       ARG  22  -1.546 -14.145   2.586
  307   2HD   ARG  22          HD1       ARG  22  -2.760 -13.666   1.400
  308    HE   ARG  22           HE       ARG  22  -1.833 -15.376  -0.121
  309   1HH1  ARG  22          HH21      ARG  22   0.832 -15.454   1.476
  310   2HH1  ARG  22          HH22      ARG  22   0.718 -17.033   2.179
  311   1HH2  ARG  22          HH11      ARG  22  -2.664 -17.379   1.502
  312   2HH2  ARG  22          HH12      ARG  22  -1.261 -18.122   2.192
  313    H    GLY  23           H        GLY  23  -2.460 -11.643  -3.225
  314   1HA   GLY  23          HA2       GLY  23  -3.489  -9.891  -4.399
  315   2HA   GLY  23          HA1       GLY  23  -4.942 -10.462  -3.587
  316    H    PHE  24           H        PHE  24  -4.998  -7.882  -4.077
  317    HA   PHE  24           HA       PHE  24  -4.530  -6.623  -1.410
  318   1HB   PHE  24          HB2       PHE  24  -3.913  -4.500  -2.615
  319   2HB   PHE  24          HB1       PHE  24  -2.736  -5.778  -2.821
  320    HD1  PHE  24           HD1      PHE  24  -4.504  -3.310  -4.512
  321    HD2  PHE  24           HD2      PHE  24  -3.309  -7.418  -4.908
  322    HE1  PHE  24           HE1      PHE  24  -4.758  -3.143  -6.969
  323    HE2  PHE  24           HE2      PHE  24  -3.561  -7.252  -7.366
  324    HZ   PHE  24           HZ       PHE  24  -4.285  -5.117  -8.402
  325    H    PHE  25           H        PHE  25  -5.832  -4.275  -1.670
  326    HA   PHE  25           HA       PHE  25  -8.336  -4.868  -3.168
  327   1HB   PHE  25          HB2       PHE  25  -9.716  -4.794  -1.343
  328   2HB   PHE  25          HB1       PHE  25  -8.267  -5.375  -0.530
  329    HD1  PHE  25           HD1      PHE  25 -10.830  -3.389   0.158
  330    HD2  PHE  25           HD2      PHE  25  -6.583  -2.989  -0.363
  331    HE1  PHE  25           HE1      PHE  25 -10.844  -1.367   1.597
  332    HE2  PHE  25           HE2      PHE  25  -6.596  -0.966   1.076
  333    HZ   PHE  25           HZ       PHE  25  -8.728  -0.155   2.055
  334    H    TYR  26           H        TYR  26  -6.202  -3.031  -3.820
  335    HA   TYR  26           HA       TYR  26  -6.499  -0.365  -3.118
  336   1HB   TYR  26          HB2       TYR  26  -4.855  -1.075  -4.776
  337   2HB   TYR  26          HB1       TYR  26  -6.130  -1.501  -5.904
  338    HD1  TYR  26           HD1      TYR  26  -4.804   1.391  -3.944
  339    HD2  TYR  26           HD2      TYR  26  -6.914   0.076  -7.447
  340    HE1  TYR  26           HE1      TYR  26  -4.785   3.709  -4.823
  341    HE2  TYR  26           HE2      TYR  26  -6.900   2.395  -8.328
  342    HH   TYR  26           HH       TYR  26  -6.155   4.473  -8.025
  343    H    THR  27           H        THR  27  -8.309   0.787  -2.868
  344    HA   THR  27           HA       THR  27 -10.794  -0.011  -4.150
  345    HB   THR  27           HB       THR  27 -11.042   0.836  -1.958
  346    HG1  THR  27           HG1      THR  27 -12.613   2.112  -2.477
  347   1HG2  THR  27          HG21      THR  27  -9.323   2.081  -1.192
  348   2HG2  THR  27          HG22      THR  27 -10.154   3.464  -1.904
  349   3HG2  THR  27          HG23      THR  27  -8.897   2.627  -2.814
  350    H    LYS  28           H        LYS  28 -10.422   0.291  -6.376
  351    HA   LYS  28           HA       LYS  28  -9.410   2.331  -7.872
  352   1HB   LYS  28          HB2       LYS  28 -11.488   0.400  -8.243
  353   2HB   LYS  28          HB1       LYS  28 -12.010   1.932  -8.947
  354   1HG   LYS  28          HG2       LYS  28  -9.718   2.049 -10.063
  355   2HG   LYS  28          HG1       LYS  28  -9.496   0.369  -9.569
  356   1HD   LYS  28          HD2       LYS  28 -10.639  -0.270 -11.397
  357   2HD   LYS  28          HD1       LYS  28 -12.072   0.513 -10.727
  358   1HE   LYS  28          HE2       LYS  28 -11.394   2.648 -11.754
  359   2HE   LYS  28          HE1       LYS  28  -9.953   1.876 -12.419
  360   1HZ   LYS  28          HZ1       LYS  28 -12.410   0.496 -13.017
  361   2HZ   LYS  28          HZ2       LYS  28 -11.123   0.922 -14.042
  362   3HZ   LYS  28          HZ3       LYS  28 -12.332   2.057 -13.674
  363    HA   PRO  29           HA       PRO  29 -11.759   5.699  -5.936
  364   1HB   PRO  29          HB2       PRO  29  -9.760   7.552  -6.294
  365   2HB   PRO  29          HB1       PRO  29  -9.841   6.452  -4.908
  366   1HG   PRO  29          HG2       PRO  29  -8.042   6.349  -7.282
  367   2HG   PRO  29          HG1       PRO  29  -7.783   5.715  -5.649
  368   1HD   PRO  29          HD2       PRO  29  -8.525   4.194  -7.920
  369   2HD   PRO  29          HD1       PRO  29  -8.580   3.646  -6.231
  370    H    THR  30           H        THR  30 -11.978   8.099  -6.884
  371    HA   THR  30           HA       THR  30 -11.775   8.161  -9.832
  372    HB   THR  30           HB       THR  30 -14.430   8.521  -8.411
  373    HG1  THR  30           HG1      THR  30 -13.184   6.370  -9.648
  374   1HG2  THR  30          HG21      THR  30 -15.053   8.265 -11.002
  375   2HG2  THR  30          HG22      THR  30 -13.436   8.946 -11.190
  376   3HG2  THR  30          HG23      THR  30 -14.667   9.831 -10.288
  Start of MODEL   12
    1   1H    GLY   1           HT1      GLY   1  -6.952   8.015   0.907
    2   2H    GLY   1           HT2      GLY   1  -6.846   6.455   0.242
    3   3H    GLY   1           HT3      GLY   1  -7.943   7.582  -0.401
    4   1HA   GLY   1          HA1       GLY   1  -6.013   7.509  -1.813
    5   2HA   GLY   1          HA2       GLY   1  -6.033   9.109  -1.011
    6    H    ILE   2           H        ILE   2  -5.348   5.530  -0.505
    7    HA   ILE   2           HA       ILE   2  -2.700   5.581   0.275
    8    HB   ILE   2           HB       ILE   2  -4.432   3.586  -0.987
    9   1HG1  ILE   2          HG12      ILE   2  -2.079   3.099   0.812
   10   2HG1  ILE   2          HG11      ILE   2  -3.546   3.867   1.428
   11   1HG2  ILE   2          HG21      ILE   2  -2.747   3.429  -2.720
   12   2HG2  ILE   2          HG22      ILE   2  -2.529   2.066  -1.624
   13   3HG2  ILE   2          HG23      ILE   2  -1.451   3.458  -1.525
   14   1HD1  ILE   2          HD11      ILE   2  -4.447   1.704  -0.111
   15   2HD1  ILE   2          HD12      ILE   2  -4.434   1.815   1.647
   16   3HD1  ILE   2          HD13      ILE   2  -3.075   1.078   0.800
   17    H    VAL   3           H        VAL   3  -3.844   5.658  -3.118
   18    HA   VAL   3           HA       VAL   3  -1.444   5.541  -4.486
   19    HB   VAL   3           HB       VAL   3  -3.664   7.537  -4.993
   20   1HG1  VAL   3          HG11      VAL   3  -1.361   6.583  -6.724
   21   2HG1  VAL   3          HG12      VAL   3  -1.587   8.213  -6.093
   22   3HG1  VAL   3          HG13      VAL   3  -2.702   7.572  -7.301
   23   1HG2  VAL   3          HG21      VAL   3  -3.113   4.714  -5.931
   24   2HG2  VAL   3          HG22      VAL   3  -4.183   5.798  -6.816
   25   3HG2  VAL   3          HG23      VAL   3  -4.570   5.335  -5.159
   26    H    GLU   4           H        GLU   4  -2.780   8.773  -3.807
   27    HA   GLU   4           HA       GLU   4  -0.257  10.024  -3.979
   28   1HB   GLU   4          HB2       GLU   4  -1.379  11.947  -2.932
   29   2HB   GLU   4          HB1       GLU   4  -2.410  11.230  -4.161
   30   1HG   GLU   4          HG2       GLU   4  -3.592   9.952  -2.389
   31   2HG   GLU   4          HG1       GLU   4  -2.596  10.753  -1.174
   32    H    GLN   5           H        GLN   5  -1.996   8.603  -1.251
   33    HA   GLN   5           HA       GLN   5  -0.427   9.576   0.880
   34   1HB   GLN   5          HB2       GLN   5  -2.493   7.890   0.788
   35   2HB   GLN   5          HB1       GLN   5  -1.204   6.688   0.887
   36   1HG   GLN   5          HG2       GLN   5  -1.816   7.173   3.146
   37   2HG   GLN   5          HG1       GLN   5  -0.295   8.023   2.865
   38   1HE2  GLN   5          HE21      GLN   5  -3.215   8.500   4.308
   39   2HE2  GLN   5          HE22      GLN   5  -3.385  10.174   4.085
   40    H    CYS   6           H        CYS   6   0.201   6.928  -1.393
   41    HA   CYS   6           HA       CYS   6   2.870   6.526  -0.136
   42   1HB   CYS   6          HB2       CYS   6   1.247   4.909  -2.102
   43   2HB   CYS   6          HB1       CYS   6   2.965   4.618  -1.856
   44    H    CYS   7           H        CYS   7   1.296   7.784  -2.992
   45    HA   CYS   7           HA       CYS   7   3.818   7.881  -4.473
   46   1HB   CYS   7          HB2       CYS   7   1.779   7.506  -5.753
   47   2HB   CYS   7          HB1       CYS   7   1.075   8.995  -5.141
   48    H    THR   8           H        THR   8   1.488  10.570  -3.989
   49    HA   THR   8           HA       THR   8   3.285  12.689  -4.135
   50    HB   THR   8           HB       THR   8   1.141  12.595  -1.998
   51    HG1  THR   8           HG1      THR   8   0.934  12.471  -4.754
   52   1HG2  THR   8          HG21      THR   8   2.075  14.820  -3.829
   53   2HG2  THR   8          HG22      THR   8   2.649  14.585  -2.178
   54   3HG2  THR   8          HG23      THR   8   0.953  14.966  -2.476
   55    H    SER   9           H        SER   9   2.594  10.533  -1.471
   56    HA   SER   9           HA       SER   9   4.959  11.603   0.009
   57   1HB   SER   9          HB2       SER   9   2.367  11.169   0.944
   58   2HB   SER   9          HB1       SER   9   3.225   9.716   1.447
   59    HG   SER   9           HG       SER   9   4.717  11.000   2.504
   60    H    ILE  10           H        ILE  10   4.951   9.012   1.565
   61    HA   ILE  10           HA       ILE  10   5.422   6.990  -0.517
   62    HB   ILE  10           HB       ILE  10   7.676   8.158   1.140
   63   1HG1  ILE  10          HG12      ILE  10   8.729   7.941  -1.243
   64   2HG1  ILE  10          HG11      ILE  10   7.055   7.846  -1.787
   65   1HG2  ILE  10          HG21      ILE  10   8.055   5.867   1.388
   66   2HG2  ILE  10          HG22      ILE  10   8.924   6.225  -0.103
   67   3HG2  ILE  10          HG23      ILE  10   7.328   5.483  -0.170
   68   1HD1  ILE  10          HD11      ILE  10   8.572  10.169  -0.967
   69   2HD1  ILE  10          HD12      ILE  10   7.132   9.989   0.034
   70   3HD1  ILE  10          HD13      ILE  10   6.979  10.096  -1.719
   71    H    CYS  11           H        CYS  11   5.716   4.829   0.433
   72    HA   CYS  11           HA       CYS  11   5.180   4.782   3.380
   73   1HB   CYS  11          HB2       CYS  11   3.611   2.800   2.898
   74   2HB   CYS  11          HB1       CYS  11   3.008   4.417   2.544
   75    H    SER  12           H        SER  12   5.063   2.110   3.858
   76    HA   SER  12           HA       SER  12   7.661   1.096   2.767
   77   1HB   SER  12          HB2       SER  12   7.702  -0.089   5.117
   78   2HB   SER  12          HB1       SER  12   8.217   1.589   4.972
   79    HG   SER  12           HG       SER  12   6.231   2.244   5.717
   80    H    LEU  13           H        LEU  13   7.858  -1.343   3.111
   81    HA   LEU  13           HA       LEU  13   5.833  -2.724   1.711
   82   1HB   LEU  13          HB2       LEU  13   8.238  -3.451   3.264
   83   2HB   LEU  13          HB1       LEU  13   7.016  -4.719   3.170
   84    HG   LEU  13           HG       LEU  13   8.586  -4.906   1.292
   85   1HD1  LEU  13          HD11      LEU  13   5.926  -5.118   1.126
   86   2HD1  LEU  13          HD12      LEU  13   6.957  -5.322  -0.290
   87   3HD1  LEU  13          HD13      LEU  13   6.141  -3.784  -0.006
   88   1HD2  LEU  13          HD21      LEU  13   8.121  -2.850  -0.415
   89   2HD2  LEU  13          HD22      LEU  13   9.473  -2.877   0.716
   90   3HD2  LEU  13          HD23      LEU  13   7.996  -2.004   1.126
   91    H    TYR  14           H        TYR  14   6.105  -2.027   5.135
   92    HA   TYR  14           HA       TYR  14   4.299  -4.046   6.073
   93   1HB   TYR  14          HB2       TYR  14   5.839  -2.745   7.540
   94   2HB   TYR  14          HB1       TYR  14   4.844  -1.314   7.270
   95    HD1  TYR  14           HD1      TYR  14   4.139  -4.938   8.036
   96    HD2  TYR  14           HD2      TYR  14   3.480  -0.821   9.084
   97    HE1  TYR  14           HE1      TYR  14   2.617  -5.643   9.866
   98    HE2  TYR  14           HE2      TYR  14   1.959  -1.528  10.910
   99    HH   TYR  14           HH       TYR  14   1.492  -4.958  11.689
  100    H    GLN  15           H        GLN  15   3.723  -0.576   5.343
  101    HA   GLN  15           HA       GLN  15   0.904  -0.708   5.829
  102   1HB   GLN  15          HB2       GLN  15   2.241   1.167   3.862
  103   2HB   GLN  15          HB1       GLN  15   0.795   1.459   4.826
  104   1HG   GLN  15          HG2       GLN  15   2.383   1.059   6.866
  105   2HG   GLN  15          HG1       GLN  15   3.669   1.398   5.708
  106   1HE2  GLN  15          HE21      GLN  15   3.849   3.575   4.871
  107   2HE2  GLN  15          HE22      GLN  15   2.952   4.865   5.514
  108    H    LEU  16           H        LEU  16   2.557  -0.527   2.625
  109    HA   LEU  16           HA       LEU  16   0.356  -1.022   0.999
  110   1HB   LEU  16          HB2       LEU  16   3.206  -1.315   0.751
  111   2HB   LEU  16          HB1       LEU  16   2.387  -2.658  -0.056
  112    HG   LEU  16           HG       LEU  16   0.869  -0.980  -1.153
  113   1HD1  LEU  16          HD11      LEU  16   2.620   0.826   0.451
  114   2HD1  LEU  16          HD12      LEU  16   0.911   0.986   0.048
  115   3HD1  LEU  16          HD13      LEU  16   2.141   1.374  -1.156
  116   1HD2  LEU  16          HD21      LEU  16   3.587  -1.625  -1.703
  117   2HD2  LEU  16          HD22      LEU  16   3.320   0.055  -2.173
  118   3HD2  LEU  16          HD23      LEU  16   2.309  -1.223  -2.849
  119    H    GLU  17           H        GLU  17   2.142  -3.300   3.005
  120    HA   GLU  17           HA       GLU  17   0.718  -5.650   2.029
  121   1HB   GLU  17          HB2       GLU  17   2.748  -6.281   2.952
  122   2HB   GLU  17          HB1       GLU  17   2.704  -5.010   4.168
  123   1HG   GLU  17          HG2       GLU  17   2.436  -7.121   5.303
  124   2HG   GLU  17          HG1       GLU  17   0.879  -6.297   5.340
  125    H    ASN  18           H        ASN  18   0.413  -3.317   4.614
  126    HA   ASN  18           HA       ASN  18  -1.610  -4.656   6.113
  127   1HB   ASN  18          HB2       ASN  18  -1.224  -2.934   7.513
  128   2HB   ASN  18          HB1       ASN  18  -0.095  -2.307   6.324
  129   1HD2  ASN  18          HD21      ASN  18  -1.708  -1.467   4.300
  130   2HD2  ASN  18          HD22      ASN  18  -2.805  -0.304   4.833
  131    H    TYR  19           H        TYR  19  -1.724  -3.148   3.056
  132    HA   TYR  19           HA       TYR  19  -4.637  -2.647   3.289
  133   1HB   TYR  19          HB2       TYR  19  -2.643  -1.975   1.112
  134   2HB   TYR  19          HB1       TYR  19  -4.369  -1.611   1.018
  135    HD1  TYR  19           HD1      TYR  19  -1.206  -0.417   2.080
  136    HD2  TYR  19           HD2      TYR  19  -5.380  -0.349   3.087
  137    HE1  TYR  19           HE1      TYR  19  -0.835   1.612   3.442
  138    HE2  TYR  19           HE2      TYR  19  -5.021   1.683   4.454
  139    HH   TYR  19           HH       TYR  19  -1.815   3.252   4.617
  140    H    CYS  20           H        CYS  20  -2.427  -4.950   2.110
  141    HA   CYS  20           HA       CYS  20  -3.741  -6.055  -0.104
  142   1HB   CYS  20          HB2       CYS  20  -2.242  -7.395   2.144
  143   2HB   CYS  20          HB1       CYS  20  -2.618  -8.144   0.625
  144    H    ASN  21           H        ASN  21  -4.726  -8.524   0.325
  145    HA   ASN  21           HA       ASN  21  -7.297  -8.042   1.540
  146   1HB   ASN  21          HB2       ASN  21  -6.880  -9.702  -0.303
  147   2HB   ASN  21          HB1       ASN  21  -6.056 -10.726   0.874
  148   1HD2  ASN  21          HD21      ASN  21  -9.170  -9.771  -0.330
  149   2HD2  ASN  21          HD22      ASN  21 -10.103 -10.658   0.777
  150   1H    PHE   1           HT1      PHE   1   5.674  -0.151  -2.106
  151   2H    PHE   1           HT2      PHE   1   6.833   0.798  -2.907
  152   3H    PHE   1           HT3      PHE   1   6.359   1.189  -1.324
  153    HA   PHE   1           HA       PHE   1   7.212  -1.409  -1.154
  154   1HB   PHE   1          HB2       PHE   1   8.387  -0.157  -3.435
  155   2HB   PHE   1          HB1       PHE   1   9.635  -0.287  -2.197
  156    HD1  PHE   1           HD1      PHE   1   7.312  -2.152  -4.366
  157    HD2  PHE   1           HD2      PHE   1  10.352  -2.466  -1.344
  158    HE1  PHE   1           HE1      PHE   1   7.521  -4.582  -4.826
  159    HE2  PHE   1           HE2      PHE   1  10.562  -4.895  -1.805
  160    HZ   PHE   1           HZ       PHE   1   9.145  -5.953  -3.547
  161    H    VAL   2           H        VAL   2   9.968  -0.770  -0.441
  162    HA   VAL   2           HA       VAL   2   9.428   0.622   2.075
  163    HB   VAL   2           HB       VAL   2  11.937   0.250   2.407
  164   1HG1  VAL   2          HG11      VAL   2  10.988  -1.512   3.460
  165   2HG1  VAL   2          HG12      VAL   2  11.374  -2.442   2.013
  166   3HG1  VAL   2          HG13      VAL   2   9.778  -1.715   2.196
  167   1HG2  VAL   2          HG21      VAL   2  12.131  -1.765   0.343
  168   2HG2  VAL   2          HG22      VAL   2  13.200  -0.398   0.655
  169   3HG2  VAL   2          HG23      VAL   2  11.788  -0.195  -0.384
  170    H    ASN   3           H        ASN   3   9.241   2.831   1.965
  171    HA   ASN   3           HA       ASN   3   9.770   5.065   1.432
  172   1HB   ASN   3          HB2       ASN   3  12.292   3.638   1.761
  173   2HB   ASN   3          HB1       ASN   3  12.444   4.951   0.594
  174   1HD2  ASN   3          HD21      ASN   3  12.063   7.154   1.359
  175   2HD2  ASN   3          HD22      ASN   3  12.014   7.515   3.016
  176    H    GLN   4           H        GLN   4   8.399   4.025  -0.524
  177    HA   GLN   4           HA       GLN   4   9.880   4.831  -2.980
  178   1HB   GLN   4          HB2       GLN   4   9.456   2.256  -2.569
  179   2HB   GLN   4          HB1       GLN   4   7.828   2.652  -3.118
  180   1HG   GLN   4          HG2       GLN   4   9.016   2.045  -5.089
  181   2HG   GLN   4          HG1       GLN   4   8.946   3.807  -5.116
  182   1HE2  GLN   4          HE21      GLN   4  10.936   4.266  -6.167
  183   2HE2  GLN   4          HE22      GLN   4  12.448   3.801  -5.552
  184    H    HIS   5           H        HIS   5   8.576   5.705  -4.634
  185    HA   HIS   5           HA       HIS   5   6.039   6.938  -3.686
  186   1HB   HIS   5          HB2       HIS   5   7.153   7.631  -6.360
  187   2HB   HIS   5          HB1       HIS   5   6.524   8.700  -5.114
  188    HD2  HIS   5           HD2      HIS   5   9.811   8.158  -6.667
  189    HE1  HIS   5           HE1      HIS   5  10.744   8.889  -2.608
  190    HE2  HIS   5           HE2      HIS   5  11.696   8.741  -4.971
  191    H    LEU   6           H        LEU   6   4.282   5.634  -4.193
  192    HA   LEU   6           HA       LEU   6   4.360   4.225  -6.833
  193   1HB   LEU   6          HB2       LEU   6   3.154   3.498  -4.194
  194   2HB   LEU   6          HB1       LEU   6   2.544   2.814  -5.690
  195    HG   LEU   6           HG       LEU   6   4.535   1.657  -6.125
  196   1HD1  LEU   6          HD11      LEU   6   5.826   3.712  -4.320
  197   2HD1  LEU   6          HD12      LEU   6   6.152   3.406  -6.026
  198   3HD1  LEU   6          HD13      LEU   6   6.663   2.239  -4.809
  199   1HD2  LEU   6          HD21      LEU   6   4.735   1.790  -3.121
  200   2HD2  LEU   6          HD22      LEU   6   4.975   0.398  -4.178
  201   3HD2  LEU   6          HD23      LEU   6   3.350   1.028  -3.905
  202    H    CYS   7           H        CYS   7   3.029   5.124  -8.315
  203    HA   CYS   7           HA       CYS   7   0.360   5.986  -7.345
  204   1HB   CYS   7          HB2       CYS   7   1.099   7.624  -9.599
  205   2HB   CYS   7          HB1       CYS   7   0.621   8.131  -7.983
  206    H    GLY   8           H        GLY   8  -1.259   6.035  -9.146
  207   1HA   GLY   8          HA2       GLY   8  -2.354   4.833 -10.843
  208   2HA   GLY   8          HA1       GLY   8  -0.892   5.169 -11.766
  209    H    SER   9           H        SER   9  -0.791   3.170 -12.805
  210    HA   SER   9           HA       SER   9  -1.192   0.624 -11.683
  211   1HB   SER   9          HB2       SER   9   0.335  -0.196 -13.496
  212   2HB   SER   9          HB1       SER   9  -0.913   0.902 -14.077
  213    HG   SER   9           HG       SER   9   1.840   1.273 -13.808
  214    H    ASP  10           H        ASP  10   1.783   2.596 -11.726
  215    HA   ASP  10           HA       ASP  10   3.640   0.783 -10.724
  216   1HB   ASP  10          HB2       ASP  10   3.213   3.688  -9.966
  217   2HB   ASP  10          HB1       ASP  10   4.622   2.755  -9.460
  218    H    LEU  11           H        LEU  11   1.054   2.442  -8.968
  219    HA   LEU  11           HA       LEU  11   1.814   1.383  -6.382
  220   1HB   LEU  11          HB2       LEU  11   0.372   3.426  -6.741
  221   2HB   LEU  11          HB1       LEU  11  -0.919   2.346  -7.265
  222    HG   LEU  11           HG       LEU  11  -0.881   1.212  -5.082
  223   1HD1  LEU  11          HD11      LEU  11   1.228   3.276  -4.400
  224   2HD1  LEU  11          HD12      LEU  11   1.509   1.541  -4.559
  225   3HD1  LEU  11          HD13      LEU  11   0.490   2.156  -3.257
  226   1HD2  LEU  11          HD21      LEU  11  -1.465   4.020  -5.507
  227   2HD2  LEU  11          HD22      LEU  11  -1.087   3.688  -3.817
  228   3HD2  LEU  11          HD23      LEU  11  -2.394   2.813  -4.618
  229    H    THR  12           H        THR  12  -0.618   0.451  -8.828
  230    HA   THR  12           HA       THR  12  -1.629  -1.798  -7.389
  231    HB   THR  12           HB       THR  12  -1.320  -1.456 -10.391
  232    HG1  THR  12           HG1      THR  12  -3.717  -1.154  -8.993
  233   1HG2  THR  12          HG21      THR  12  -2.820  -3.418  -8.663
  234   2HG2  THR  12          HG22      THR  12  -1.735  -3.749 -10.014
  235   3HG2  THR  12          HG23      THR  12  -3.336  -3.070 -10.313
  236    H    GLU  13           H        GLU  13   1.122  -1.399  -9.590
  237    HA   GLU  13           HA       GLU  13   1.966  -4.050  -9.879
  238   1HB   GLU  13          HB2       GLU  13   3.053  -1.532 -10.379
  239   2HB   GLU  13          HB1       GLU  13   4.197  -2.269  -9.259
  240   1HG   GLU  13          HG2       GLU  13   4.007  -4.365 -10.783
  241   2HG   GLU  13          HG1       GLU  13   3.325  -3.252 -11.970
  242    H    ALA  14           H        ALA  14   3.506  -1.903  -7.472
  243    HA   ALA  14           HA       ALA  14   4.622  -3.883  -5.860
  244   1HB   ALA  14          HB1       ALA  14   4.672  -2.269  -4.073
  245   2HB   ALA  14          HB2       ALA  14   3.313  -1.381  -4.762
  246   3HB   ALA  14          HB3       ALA  14   4.877  -1.374  -5.578
  247    H    LEU  15           H        LEU  15   1.425  -2.358  -5.379
  248    HA   LEU  15           HA       LEU  15   0.467  -3.925  -3.267
  249   1HB   LEU  15          HB2       LEU  15  -0.765  -2.499  -5.570
  250   2HB   LEU  15          HB1       LEU  15  -1.781  -3.680  -4.749
  251    HG   LEU  15           HG       LEU  15  -0.312  -1.384  -3.418
  252   1HD1  LEU  15          HD11      LEU  15  -2.965  -1.668  -4.631
  253   2HD1  LEU  15          HD12      LEU  15  -2.109  -0.209  -4.134
  254   3HD1  LEU  15          HD13      LEU  15  -3.033  -1.134  -2.952
  255   1HD2  LEU  15          HD21      LEU  15  -1.914  -3.714  -2.405
  256   2HD2  LEU  15          HD22      LEU  15  -1.971  -2.183  -1.530
  257   3HD2  LEU  15          HD23      LEU  15  -0.433  -3.015  -1.753
  258    H    TYR  16           H        TYR  16   0.159  -4.600  -6.741
  259    HA   TYR  16           HA       TYR  16  -1.106  -7.101  -6.602
  260   1HB   TYR  16          HB2       TYR  16  -0.205  -5.556  -8.607
  261   2HB   TYR  16          HB1       TYR  16   1.076  -6.760  -8.596
  262    HD1  TYR  16           HD1      TYR  16  -2.322  -6.031  -9.516
  263    HD2  TYR  16           HD2      TYR  16   0.433  -9.232  -8.737
  264    HE1  TYR  16           HE1      TYR  16  -3.822  -7.605 -10.708
  265    HE2  TYR  16           HE2      TYR  16  -1.068 -10.812  -9.928
  266    HH   TYR  16           HH       TYR  16  -2.900 -10.538 -11.815
  267    H    LEU  17           H        LEU  17   2.295  -6.274  -6.116
  268    HA   LEU  17           HA       LEU  17   3.066  -9.110  -6.006
  269   1HB   LEU  17          HB2       LEU  17   4.444  -6.869  -6.700
  270   2HB   LEU  17          HB1       LEU  17   4.965  -7.074  -5.024
  271    HG   LEU  17           HG       LEU  17   5.111  -9.143  -7.239
  272   1HD1  LEU  17          HD11      LEU  17   7.279  -7.820  -5.584
  273   2HD1  LEU  17          HD12      LEU  17   6.876  -7.389  -7.247
  274   3HD1  LEU  17          HD13      LEU  17   7.522  -8.988  -6.881
  275   1HD2  LEU  17          HD21      LEU  17   4.500 -10.224  -5.134
  276   2HD2  LEU  17          HD22      LEU  17   5.776  -9.351  -4.285
  277   3HD2  LEU  17          HD23      LEU  17   6.192 -10.566  -5.494
  278    H    VAL  18           H        VAL  18   3.241  -6.368  -3.681
  279    HA   VAL  18           HA       VAL  18   4.035  -7.725  -1.409
  280    HB   VAL  18           HB       VAL  18   1.992  -6.257  -0.317
  281   1HG1  VAL  18          HG11      VAL  18   3.646  -4.646   0.178
  282   2HG1  VAL  18          HG12      VAL  18   4.530  -4.978  -1.312
  283   3HG1  VAL  18          HG13      VAL  18   4.527  -6.162  -0.005
  284   1HG2  VAL  18          HG21      VAL  18   2.838  -4.473  -2.541
  285   2HG2  VAL  18          HG22      VAL  18   1.316  -4.521  -1.650
  286   3HG2  VAL  18          HG23      VAL  18   1.627  -5.694  -2.929
  287    H    CYS  19           H        CYS  19   0.825  -7.672  -2.804
  288    HA   CYS  19           HA       CYS  19  -0.025  -9.790  -0.880
  289   1HB   CYS  19          HB2       CYS  19  -2.043  -8.733  -2.740
  290   2HB   CYS  19          HB1       CYS  19  -2.116  -8.910  -0.998
  291    H    GLY  20           H        GLY  20  -0.799  -8.984  -4.261
  292   1HA   GLY  20          HA2       GLY  20  -0.896 -10.350  -6.177
  293   2HA   GLY  20          HA1       GLY  20   0.324 -11.364  -5.397
  294    H    GLU  21           H        GLU  21  -0.347 -13.393  -4.871
  295    HA   GLU  21           HA       GLU  21  -2.987 -14.320  -5.297
  296   1HB   GLU  21          HB2       GLU  21  -0.935 -15.411  -3.338
  297   2HB   GLU  21          HB1       GLU  21  -2.343 -16.285  -3.944
  298   1HG   GLU  21          HG2       GLU  21  -0.485 -15.102  -5.959
  299   2HG   GLU  21          HG1       GLU  21   0.061 -16.537  -5.090
  300    H    ARG  22           H        ARG  22  -1.592 -12.526  -2.712
  301    HA   ARG  22           HA       ARG  22  -3.657 -13.147  -0.756
  302   1HB   ARG  22          HB2       ARG  22  -1.759 -10.787  -0.809
  303   2HB   ARG  22          HB1       ARG  22  -2.623 -11.423   0.592
  304   1HG   ARG  22          HG2       ARG  22  -0.617 -13.028  -1.016
  305   2HG   ARG  22          HG1       ARG  22  -0.214 -12.153   0.462
  306   1HD   ARG  22          HD2       ARG  22  -0.957 -13.885   1.685
  307   2HD   ARG  22          HD1       ARG  22  -2.562 -13.688   0.981
  308    HE   ARG  22           HE       ARG  22  -1.642 -15.163  -0.928
  309   1HH1  ARG  22          HH21      ARG  22   0.838 -15.105   1.178
  310   2HH1  ARG  22          HH22      ARG  22   0.816 -16.785   1.600
  311   1HH2  ARG  22          HH11      ARG  22  -2.247 -17.401   0.103
  312   2HH2  ARG  22          HH12      ARG  22  -0.926 -18.083   0.992
  313    H    GLY  23           H        GLY  23  -3.557 -11.332  -3.579
  314   1HA   GLY  23          HA2       GLY  23  -5.017  -9.754  -4.502
  315   2HA   GLY  23          HA1       GLY  23  -6.202 -10.365  -3.351
  316    H    PHE  24           H        PHE  24  -5.056  -7.572  -4.332
  317    HA   PHE  24           HA       PHE  24  -4.779  -6.372  -1.599
  318   1HB   PHE  24          HB2       PHE  24  -3.970  -4.346  -2.890
  319   2HB   PHE  24          HB1       PHE  24  -2.931  -5.752  -3.038
  320    HD1  PHE  24           HD1      PHE  24  -5.069  -3.414  -4.795
  321    HD2  PHE  24           HD2      PHE  24  -3.045  -7.191  -5.110
  322    HE1  PHE  24           HE1      PHE  24  -5.311  -3.336  -7.259
  323    HE2  PHE  24           HE2      PHE  24  -3.283  -7.110  -7.577
  324    HZ   PHE  24           HZ       PHE  24  -4.417  -5.185  -8.653
  325    H    PHE  25           H        PHE  25  -6.303  -4.679  -1.032
  326    HA   PHE  25           HA       PHE  25  -8.654  -4.622  -2.850
  327   1HB   PHE  25          HB2       PHE  25 -10.017  -4.342  -1.022
  328   2HB   PHE  25          HB1       PHE  25  -8.685  -5.198  -0.257
  329    HD1  PHE  25           HD1      PHE  25 -10.859  -3.024   0.730
  330    HD2  PHE  25           HD2      PHE  25  -6.652  -2.971  -0.147
  331    HE1  PHE  25           HE1      PHE  25 -10.564  -1.123   2.293
  332    HE2  PHE  25           HE2      PHE  25  -6.356  -1.068   1.420
  333    HZ   PHE  25           HZ       PHE  25  -8.306  -0.144   2.639
  334    H    TYR  26           H        TYR  26  -6.610  -3.161  -3.813
  335    HA   TYR  26           HA       TYR  26  -6.423  -0.433  -3.058
  336   1HB   TYR  26          HB2       TYR  26  -4.820  -1.204  -4.602
  337   2HB   TYR  26          HB1       TYR  26  -6.037  -1.920  -5.648
  338    HD1  TYR  26           HD1      TYR  26  -5.147   1.445  -4.228
  339    HD2  TYR  26           HD2      TYR  26  -6.552  -0.802  -7.612
  340    HE1  TYR  26           HE1      TYR  26  -5.173   3.514  -5.596
  341    HE2  TYR  26           HE2      TYR  26  -6.583   1.268  -8.978
  342    HH   TYR  26           HH       TYR  26  -5.342   4.331  -7.689
  343    H    THR  27           H        THR  27  -8.131   0.896  -2.828
  344    HA   THR  27           HA       THR  27 -10.438   0.601  -4.692
  345    HB   THR  27           HB       THR  27 -11.040   0.455  -2.344
  346    HG1  THR  27           HG1      THR  27 -12.252   1.850  -3.904
  347   1HG2  THR  27          HG21      THR  27  -9.105   2.665  -2.164
  348   2HG2  THR  27          HG22      THR  27  -9.568   1.474  -0.950
  349   3HG2  THR  27          HG23      THR  27 -10.562   2.909  -1.201
  350    H    LYS  28           H        LYS  28  -9.454   1.803  -6.440
  351    HA   LYS  28           HA       LYS  28 -10.010   4.621  -6.367
  352   1HB   LYS  28          HB2       LYS  28  -7.380   3.820  -5.475
  353   2HB   LYS  28          HB1       LYS  28  -7.253   4.764  -6.959
  354   1HG   LYS  28          HG2       LYS  28  -9.204   5.838  -5.037
  355   2HG   LYS  28          HG1       LYS  28  -7.544   5.840  -4.441
  356   1HD   LYS  28          HD2       LYS  28  -6.946   6.845  -6.764
  357   2HD   LYS  28          HD1       LYS  28  -8.669   7.209  -6.878
  358   1HE   LYS  28          HE2       LYS  28  -7.419   7.947  -4.305
  359   2HE   LYS  28          HE1       LYS  28  -6.837   8.858  -5.698
  360   1HZ   LYS  28          HZ1       LYS  28  -8.704  10.007  -4.888
  361   2HZ   LYS  28          HZ2       LYS  28  -9.626   8.588  -4.735
  362   3HZ   LYS  28          HZ3       LYS  28  -9.243   9.195  -6.275
  363    HA   PRO  29           HA       PRO  29  -9.500   2.531 -10.487
  364   1HB   PRO  29          HB2       PRO  29 -12.169   2.464 -11.128
  365   2HB   PRO  29          HB1       PRO  29 -11.335   1.154 -10.274
  366   1HG   PRO  29          HG2       PRO  29 -13.247   3.173  -9.200
  367   2HG   PRO  29          HG1       PRO  29 -12.871   1.550  -8.596
  368   1HD   PRO  29          HD2       PRO  29 -11.898   4.001  -7.537
  369   2HD   PRO  29          HD1       PRO  29 -11.316   2.373  -7.128
  370    H    THR  30           H        THR  30 -12.376   4.640 -10.168
  371    HA   THR  30           HA       THR  30 -11.641   6.183 -12.506
  372    HB   THR  30           HB       THR  30 -13.550   7.345 -10.549
  373    HG1  THR  30           HG1      THR  30 -14.942   5.724 -10.649
  374   1HG2  THR  30          HG21      THR  30 -14.783   6.909 -12.996
  375   2HG2  THR  30          HG22      THR  30 -13.097   7.181 -13.434
  376   3HG2  THR  30          HG23      THR  30 -13.972   8.396 -12.504
  Start of MODEL   13
    1   1H    GLY   1           HT1      GLY   1  -7.773   8.093  -1.903
    2   2H    GLY   1           HT2      GLY   1  -7.667   6.866  -0.733
    3   3H    GLY   1           HT3      GLY   1  -6.818   6.721  -2.197
    4   1HA   GLY   1          HA1       GLY   1  -5.549   8.731  -1.457
    5   2HA   GLY   1          HA2       GLY   1  -6.319   8.583   0.151
    6    H    ILE   2           H        ILE   2  -5.346   5.680  -0.382
    7    HA   ILE   2           HA       ILE   2  -2.687   5.658   0.267
    8    HB   ILE   2           HB       ILE   2  -4.517   3.740  -0.869
    9   1HG1  ILE   2          HG12      ILE   2  -1.897   3.132   0.465
   10   2HG1  ILE   2          HG11      ILE   2  -3.226   3.867   1.369
   11   1HG2  ILE   2          HG21      ILE   2  -3.228   3.601  -2.867
   12   2HG2  ILE   2          HG22      ILE   2  -2.717   2.244  -1.864
   13   3HG2  ILE   2          HG23      ILE   2  -1.707   3.685  -1.978
   14   1HD1  ILE   2          HD11      ILE   2  -4.130   1.832   1.587
   15   2HD1  ILE   2          HD12      ILE   2  -2.910   1.126   0.526
   16   3HD1  ILE   2          HD13      ILE   2  -4.384   1.813  -0.156
   17    H    VAL   3           H        VAL   3  -3.790   5.444  -3.134
   18    HA   VAL   3           HA       VAL   3  -1.450   5.508  -4.529
   19    HB   VAL   3           HB       VAL   3  -3.891   7.228  -5.022
   20   1HG1  VAL   3          HG11      VAL   3  -2.559   6.765  -7.443
   21   2HG1  VAL   3          HG12      VAL   3  -1.283   7.222  -6.315
   22   3HG1  VAL   3          HG13      VAL   3  -2.655   8.298  -6.578
   23   1HG2  VAL   3          HG21      VAL   3  -4.664   5.466  -6.330
   24   2HG2  VAL   3          HG22      VAL   3  -3.825   4.588  -5.051
   25   3HG2  VAL   3          HG23      VAL   3  -3.043   4.832  -6.613
   26    H    GLU   4           H        GLU   4  -3.010   8.525  -3.389
   27    HA   GLU   4           HA       GLU   4  -0.611  10.049  -3.937
   28   1HB   GLU   4          HB2       GLU   4  -3.143  10.815  -3.761
   29   2HB   GLU   4          HB1       GLU   4  -2.733  11.036  -2.061
   30   1HG   GLU   4          HG2       GLU   4  -1.393  12.826  -2.483
   31   2HG   GLU   4          HG1       GLU   4  -0.744  12.114  -3.960
   32    H    GLN   5           H        GLN   5  -2.067   8.575  -1.069
   33    HA   GLN   5           HA       GLN   5  -0.340   9.743   0.878
   34   1HB   GLN   5          HB2       GLN   5  -2.380   8.413   1.431
   35   2HB   GLN   5          HB1       GLN   5  -1.537   6.955   0.907
   36   1HG   GLN   5          HG2       GLN   5  -0.162   6.915   2.747
   37   2HG   GLN   5          HG1       GLN   5  -0.128   8.674   2.889
   38   1HE2  GLN   5          HE21      GLN   5  -0.767   6.612   5.007
   39   2HE2  GLN   5          HE22      GLN   5  -2.312   7.029   5.577
   40    H    CYS   6           H        CYS   6   0.099   7.064  -1.365
   41    HA   CYS   6           HA       CYS   6   2.792   6.571  -0.188
   42   1HB   CYS   6          HB2       CYS   6   1.004   4.904  -1.962
   43   2HB   CYS   6          HB1       CYS   6   2.723   4.563  -1.785
   44    H    CYS   7           H        CYS   7   1.146   7.702  -3.084
   45    HA   CYS   7           HA       CYS   7   3.526   7.509  -4.735
   46   1HB   CYS   7          HB2       CYS   7   1.300   7.563  -5.796
   47   2HB   CYS   7          HB1       CYS   7   1.005   9.163  -5.138
   48    H    THR   8           H        THR   8   1.798  10.587  -4.215
   49    HA   THR   8           HA       THR   8   3.999  12.284  -4.415
   50    HB   THR   8           HB       THR   8   2.765  13.871  -2.961
   51    HG1  THR   8           HG1      THR   8   0.678  12.946  -2.191
   52   1HG2  THR   8          HG21      THR   8   1.897  13.934  -5.123
   53   2HG2  THR   8          HG22      THR   8   0.458  13.555  -4.175
   54   3HG2  THR   8          HG23      THR   8   1.306  12.274  -5.042
   55    H    SER   9           H        SER   9   2.662  11.154  -1.299
   56    HA   SER   9           HA       SER   9   5.263  11.561   0.011
   57   1HB   SER   9          HB2       SER   9   3.014  11.849   1.190
   58   2HB   SER   9          HB1       SER   9   2.818  10.103   1.080
   59    HG   SER   9           HG       SER   9   4.722  11.616   2.510
   60    H    ILE  10           H        ILE  10   5.590   9.194   1.484
   61    HA   ILE  10           HA       ILE  10   5.475   7.039  -0.572
   62    HB   ILE  10           HB       ILE  10   7.968   7.894   0.925
   63   1HG1  ILE  10          HG12      ILE  10   8.868   7.950  -1.441
   64   2HG1  ILE  10          HG11      ILE  10   7.210   7.757  -2.003
   65   1HG2  ILE  10          HG21      ILE  10   7.155   5.373  -0.437
   66   2HG2  ILE  10          HG22      ILE  10   8.220   5.604   0.946
   67   3HG2  ILE  10          HG23      ILE  10   8.802   5.944  -0.683
   68   1HD1  ILE  10          HD11      ILE  10   6.812   9.951  -1.719
   69   2HD1  ILE  10          HD12      ILE  10   8.513  10.165  -1.307
   70   3HD1  ILE  10          HD13      ILE  10   7.329   9.859  -0.035
   71    H    CYS  11           H        CYS  11   5.551   4.874   0.337
   72    HA   CYS  11           HA       CYS  11   5.301   4.848   3.327
   73   1HB   CYS  11          HB2       CYS  11   3.579   2.989   3.015
   74   2HB   CYS  11          HB1       CYS  11   3.040   4.615   2.614
   75    H    SER  12           H        SER  12   5.180   2.281   3.939
   76    HA   SER  12           HA       SER  12   7.595   1.095   2.621
   77   1HB   SER  12          HB2       SER  12   7.953  -0.065   4.807
   78   2HB   SER  12          HB1       SER  12   8.018   1.689   4.952
   79    HG   SER  12           HG       SER  12   6.698   0.795   6.567
   80    H    LEU  13           H        LEU  13   7.587  -1.424   3.029
   81    HA   LEU  13           HA       LEU  13   5.338  -2.497   1.634
   82   1HB   LEU  13          HB2       LEU  13   7.139  -4.152   3.401
   83   2HB   LEU  13          HB1       LEU  13   6.353  -4.621   1.896
   84    HG   LEU  13           HG       LEU  13   8.679  -2.714   2.242
   85   1HD1  LEU  13          HD11      LEU  13   8.676  -5.414   1.969
   86   2HD1  LEU  13          HD12      LEU  13   9.955  -4.379   1.332
   87   3HD1  LEU  13          HD13      LEU  13   8.657  -4.932   0.273
   88   1HD2  LEU  13          HD21      LEU  13   6.584  -2.603   0.308
   89   2HD2  LEU  13          HD22      LEU  13   8.017  -3.231  -0.499
   90   3HD2  LEU  13          HD23      LEU  13   8.083  -1.677   0.331
   91    H    TYR  14           H        TYR  14   6.181  -2.501   5.091
   92    HA   TYR  14           HA       TYR  14   4.263  -4.169   6.161
   93   1HB   TYR  14          HB2       TYR  14   5.905  -2.726   7.445
   94   2HB   TYR  14          HB1       TYR  14   4.793  -1.377   7.222
   95    HD1  TYR  14           HD1      TYR  14   4.245  -5.008   8.025
   96    HD2  TYR  14           HD2      TYR  14   3.715  -0.919   9.242
   97    HE1  TYR  14           HE1      TYR  14   2.941  -5.763  10.001
   98    HE2  TYR  14           HE2      TYR  14   2.411  -1.675  11.214
   99    HH   TYR  14           HH       TYR  14   2.462  -4.207  12.585
  100    H    GLN  15           H        GLN  15   3.758  -0.793   5.152
  101    HA   GLN  15           HA       GLN  15   0.930  -0.842   5.722
  102   1HB   GLN  15          HB2       GLN  15   2.332   1.001   3.767
  103   2HB   GLN  15          HB1       GLN  15   0.895   1.346   4.726
  104   1HG   GLN  15          HG2       GLN  15   2.807   0.617   6.619
  105   2HG   GLN  15          HG1       GLN  15   3.704   1.597   5.458
  106   1HE2  GLN  15          HE21      GLN  15   0.275   1.842   6.541
  107   2HE2  GLN  15          HE22      GLN  15   0.403   3.450   7.072
  108    H    LEU  16           H        LEU  16   2.644  -0.752   2.548
  109    HA   LEU  16           HA       LEU  16   0.410  -1.265   0.931
  110   1HB   LEU  16          HB2       LEU  16   3.285  -1.502   0.692
  111   2HB   LEU  16          HB1       LEU  16   2.488  -2.847  -0.131
  112    HG   LEU  16           HG       LEU  16   0.880  -0.944  -1.009
  113   1HD1  LEU  16          HD11      LEU  16   3.069   0.500   0.284
  114   2HD1  LEU  16          HD12      LEU  16   1.515   1.103  -0.290
  115   3HD1  LEU  16          HD13      LEU  16   2.872   0.956  -1.408
  116   1HD2  LEU  16          HD21      LEU  16   1.985  -1.145  -3.006
  117   2HD2  LEU  16          HD22      LEU  16   2.815  -2.425  -2.118
  118   3HD2  LEU  16          HD23      LEU  16   3.564  -0.835  -2.283
  119    H    GLU  17           H        GLU  17   2.091  -3.299   3.176
  120    HA   GLU  17           HA       GLU  17   0.910  -5.830   2.270
  121   1HB   GLU  17          HB2       GLU  17   2.314  -4.993   4.834
  122   2HB   GLU  17          HB1       GLU  17   1.699  -6.621   4.562
  123   1HG   GLU  17          HG2       GLU  17   3.654  -5.269   2.691
  124   2HG   GLU  17          HG1       GLU  17   4.160  -6.288   4.039
  125    H    ASN  18           H        ASN  18   0.429  -3.414   4.756
  126    HA   ASN  18           HA       ASN  18  -1.824  -4.592   6.036
  127   1HB   ASN  18          HB2       ASN  18  -1.417  -2.886   7.449
  128   2HB   ASN  18          HB1       ASN  18  -0.185  -2.320   6.337
  129   1HD2  ASN  18          HD21      ASN  18  -1.487  -1.337   4.231
  130   2HD2  ASN  18          HD22      ASN  18  -2.602  -0.159   4.675
  131    H    TYR  19           H        TYR  19  -1.487  -2.952   3.017
  132    HA   TYR  19           HA       TYR  19  -4.400  -2.433   2.909
  133   1HB   TYR  19          HB2       TYR  19  -2.116  -1.646   1.098
  134   2HB   TYR  19          HB1       TYR  19  -3.811  -1.343   0.702
  135    HD1  TYR  19           HD1      TYR  19  -1.032   0.181   2.002
  136    HD2  TYR  19           HD2      TYR  19  -5.160  -0.494   2.960
  137    HE1  TYR  19           HE1      TYR  19  -0.995   2.143   3.500
  138    HE2  TYR  19           HE2      TYR  19  -5.139   1.462   4.467
  139    HH   TYR  19           HH       TYR  19  -3.461   3.789   4.440
  140    H    CYS  20           H        CYS  20  -2.682  -5.062   2.525
  141    HA   CYS  20           HA       CYS  20  -3.595  -5.889  -0.145
  142   1HB   CYS  20          HB2       CYS  20  -1.931  -7.066   2.042
  143   2HB   CYS  20          HB1       CYS  20  -2.520  -8.079   0.765
  144    H    ASN  21           H        ASN  21  -4.444  -8.435   0.135
  145    HA   ASN  21           HA       ASN  21  -6.846  -8.154   1.888
  146   1HB   ASN  21          HB2       ASN  21  -7.132  -8.475  -0.626
  147   2HB   ASN  21          HB1       ASN  21  -6.490 -10.098  -0.398
  148   1HD2  ASN  21          HD21      ASN  21  -8.698  -8.267   1.766
  149   2HD2  ASN  21          HD22      ASN  21  -9.961  -9.396   1.684
  150   1H    PHE   1           HT1      PHE   1  11.398  -2.720  -0.073
  151   2H    PHE   1           HT2      PHE   1  11.206  -2.992  -1.740
  152   3H    PHE   1           HT3      PHE   1   9.846  -2.721  -0.758
  153    HA   PHE   1           HA       PHE   1  11.958  -0.773  -1.494
  154   1HB   PHE   1          HB2       PHE   1   9.233   0.112  -1.817
  155   2HB   PHE   1          HB1       PHE   1  10.489  -0.051  -3.042
  156    HD1  PHE   1           HD1      PHE   1   7.397  -1.361  -1.778
  157    HD2  PHE   1           HD2      PHE   1  10.917  -2.412  -4.008
  158    HE1  PHE   1           HE1      PHE   1   6.215  -3.327  -2.717
  159    HE2  PHE   1           HE2      PHE   1   9.735  -4.379  -4.947
  160    HZ   PHE   1           HZ       PHE   1   7.381  -4.837  -4.302
  161    H    VAL   2           H        VAL   2  12.561   0.268   0.345
  162    HA   VAL   2           HA       VAL   2  10.721   0.573   2.603
  163    HB   VAL   2           HB       VAL   2  13.217   0.238   2.837
  164   1HG1  VAL   2          HG11      VAL   2  14.727   1.976   2.301
  165   2HG1  VAL   2          HG12      VAL   2  13.436   3.164   2.131
  166   3HG1  VAL   2          HG13      VAL   2  13.648   1.910   0.908
  167   1HG2  VAL   2          HG21      VAL   2  12.626   2.881   4.090
  168   2HG2  VAL   2          HG22      VAL   2  13.242   1.403   4.826
  169   3HG2  VAL   2          HG23      VAL   2  11.524   1.554   4.459
  170    H    ASN   3           H        ASN   3  11.832   2.490  -0.105
  171    HA   ASN   3           HA       ASN   3   9.952   4.654   0.731
  172   1HB   ASN   3          HB2       ASN   3  12.814   4.956  -0.213
  173   2HB   ASN   3          HB1       ASN   3  11.649   6.281  -0.263
  174   1HD2  ASN   3          HD21      ASN   3  14.089   6.098   1.444
  175   2HD2  ASN   3          HD22      ASN   3  13.541   6.194   3.048
  176    H    GLN   4           H        GLN   4   8.455   3.827  -0.829
  177    HA   GLN   4           HA       GLN   4   9.348   4.266  -3.643
  178   1HB   GLN   4          HB2       GLN   4   8.723   1.831  -2.719
  179   2HB   GLN   4          HB1       GLN   4   7.095   2.391  -3.111
  180   1HG   GLN   4          HG2       GLN   4   8.172   1.231  -5.032
  181   2HG   GLN   4          HG1       GLN   4   7.796   2.913  -5.401
  182   1HE2  GLN   4          HE21      GLN   4  10.427   0.632  -4.825
  183   2HE2  GLN   4          HE22      GLN   4  11.681   1.689  -5.262
  184    H    HIS   5           H        HIS   5   8.100   5.535  -4.876
  185    HA   HIS   5           HA       HIS   5   5.739   6.848  -3.635
  186   1HB   HIS   5          HB2       HIS   5   6.843   7.615  -6.324
  187   2HB   HIS   5          HB1       HIS   5   6.164   8.655  -5.075
  188    HD2  HIS   5           HD2      HIS   5   9.590   7.020  -6.036
  189    HE1  HIS   5           HE1      HIS   5  10.208   9.564  -2.715
  190    HE2  HIS   5           HE2      HIS   5  11.359   8.124  -4.480
  191    H    LEU   6           H        LEU   6   4.349   4.952  -3.965
  192    HA   LEU   6           HA       LEU   6   3.947   3.952  -6.688
  193   1HB   LEU   6          HB2       LEU   6   2.647   3.353  -4.058
  194   2HB   LEU   6          HB1       LEU   6   2.091   2.676  -5.574
  195    HG   LEU   6           HG       LEU   6   3.897   1.266  -5.756
  196   1HD1  LEU   6          HD11      LEU   6   5.503   3.196  -5.928
  197   2HD1  LEU   6          HD12      LEU   6   6.160   1.801  -5.073
  198   3HD1  LEU   6          HD13      LEU   6   5.602   3.206  -4.165
  199   1HD2  LEU   6          HD21      LEU   6   4.134   0.218  -3.734
  200   2HD2  LEU   6          HD22      LEU   6   2.869   1.353  -3.264
  201   3HD2  LEU   6          HD23      LEU   6   4.555   1.710  -2.895
  202    H    CYS   7           H        CYS   7   2.499   4.666  -8.110
  203    HA   CYS   7           HA       CYS   7   0.073   6.008  -7.065
  204   1HB   CYS   7          HB2       CYS   7   0.930   7.152  -9.610
  205   2HB   CYS   7          HB1       CYS   7   0.413   7.970  -8.143
  206    H    GLY   8           H        GLY   8  -1.742   5.210  -8.071
  207   1HA   GLY   8          HA2       GLY   8  -2.967   3.710  -9.416
  208   2HA   GLY   8          HA1       GLY   8  -2.159   4.570 -10.724
  209    H    SER   9           H        SER   9  -1.088   3.248 -12.084
  210    HA   SER   9           HA       SER   9  -0.769   0.512 -11.897
  211   1HB   SER   9          HB2       SER   9   1.507   1.151 -13.259
  212   2HB   SER   9          HB1       SER   9  -0.100   1.125 -13.977
  213    HG   SER   9           HG       SER   9   1.554   3.210 -13.522
  214    H    ASP  10           H        ASP  10   2.000   2.718 -11.255
  215    HA   ASP  10           HA       ASP  10   3.773   0.883 -10.172
  216   1HB   ASP  10          HB2       ASP  10   3.263   3.767  -9.755
  217   2HB   ASP  10          HB1       ASP  10   4.134   2.976  -8.441
  218    H    LEU  11           H        LEU  11   1.000   2.384  -8.568
  219    HA   LEU  11           HA       LEU  11   1.462   1.161  -5.997
  220   1HB   LEU  11          HB2       LEU  11  -0.092   3.154  -6.640
  221   2HB   LEU  11          HB1       LEU  11  -1.253   1.904  -7.077
  222    HG   LEU  11           HG       LEU  11  -1.157   0.987  -4.797
  223   1HD1  LEU  11          HD11      LEU  11   1.169   1.563  -4.248
  224   2HD1  LEU  11          HD12      LEU  11   0.075   2.248  -3.049
  225   3HD1  LEU  11          HD13      LEU  11   0.764   3.278  -4.301
  226   1HD2  LEU  11          HD21      LEU  11  -1.524   3.692  -3.929
  227   2HD2  LEU  11          HD22      LEU  11  -2.751   2.471  -4.276
  228   3HD2  LEU  11          HD23      LEU  11  -2.159   3.523  -5.564
  229    H    THR  12           H        THR  12  -0.698   0.320  -8.720
  230    HA   THR  12           HA       THR  12  -1.636  -2.135  -7.614
  231    HB   THR  12           HB       THR  12  -1.133  -1.329 -10.492
  232    HG1  THR  12           HG1      THR  12  -3.116  -0.594 -10.408
  233   1HG2  THR  12          HG21      THR  12  -1.977  -3.879  -9.279
  234   2HG2  THR  12          HG22      THR  12  -1.300  -3.560 -10.875
  235   3HG2  THR  12          HG23      THR  12  -3.019  -3.301 -10.579
  236    H    GLU  13           H        GLU  13   1.065  -1.518  -9.879
  237    HA   GLU  13           HA       GLU  13   2.170  -4.051 -10.069
  238   1HB   GLU  13          HB2       GLU  13   3.185  -1.304 -10.191
  239   2HB   GLU  13          HB1       GLU  13   4.414  -2.476  -9.717
  240   1HG   GLU  13          HG2       GLU  13   3.307  -3.878 -11.705
  241   2HG   GLU  13          HG1       GLU  13   2.886  -2.263 -12.275
  242    H    ALA  14           H        ALA  14   2.719  -1.713  -7.420
  243    HA   ALA  14           HA       ALA  14   4.310  -3.589  -5.871
  244   1HB   ALA  14          HB1       ALA  14   4.299  -1.018  -5.679
  245   2HB   ALA  14          HB2       ALA  14   4.293  -1.922  -4.165
  246   3HB   ALA  14          HB3       ALA  14   2.799  -1.209  -4.771
  247    H    LEU  15           H        LEU  15   1.064  -2.204  -5.334
  248    HA   LEU  15           HA       LEU  15   0.138  -3.850  -3.276
  249   1HB   LEU  15          HB2       LEU  15  -1.026  -2.265  -5.437
  250   2HB   LEU  15          HB1       LEU  15  -2.016  -3.660  -5.069
  251    HG   LEU  15           HG       LEU  15  -1.220  -1.377  -3.254
  252   1HD1  LEU  15          HD11      LEU  15  -3.558  -1.064  -2.993
  253   2HD1  LEU  15          HD12      LEU  15  -3.926  -2.676  -3.604
  254   3HD1  LEU  15          HD13      LEU  15  -3.353  -1.427  -4.707
  255   1HD2  LEU  15          HD21      LEU  15  -2.597  -2.846  -1.528
  256   2HD2  LEU  15          HD22      LEU  15  -0.856  -3.066  -1.701
  257   3HD2  LEU  15          HD23      LEU  15  -1.971  -4.180  -2.497
  258    H    TYR  16           H        TYR  16   0.152  -4.523  -6.756
  259    HA   TYR  16           HA       TYR  16  -1.084  -7.079  -6.700
  260   1HB   TYR  16          HB2       TYR  16  -0.243  -5.469  -8.666
  261   2HB   TYR  16          HB1       TYR  16   1.132  -6.567  -8.632
  262    HD1  TYR  16           HD1      TYR  16  -2.240  -6.062  -9.720
  263    HD2  TYR  16           HD2      TYR  16   0.649  -9.093  -8.754
  264    HE1  TYR  16           HE1      TYR  16  -3.566  -7.730 -10.993
  265    HE2  TYR  16           HE2      TYR  16  -0.676 -10.762 -10.029
  266    HH   TYR  16           HH       TYR  16  -2.900 -10.040 -12.231
  267    H    LEU  17           H        LEU  17   2.296  -6.129  -6.147
  268    HA   LEU  17           HA       LEU  17   3.085  -8.968  -5.989
  269   1HB   LEU  17          HB2       LEU  17   4.486  -6.946  -6.945
  270   2HB   LEU  17          HB1       LEU  17   4.937  -6.738  -5.250
  271    HG   LEU  17           HG       LEU  17   5.236  -9.281  -6.883
  272   1HD1  LEU  17          HD11      LEU  17   7.532  -8.864  -6.940
  273   2HD1  LEU  17          HD12      LEU  17   7.467  -7.768  -5.560
  274   3HD1  LEU  17          HD13      LEU  17   6.869  -7.240  -7.133
  275   1HD2  LEU  17          HD21      LEU  17   4.793 -10.028  -4.699
  276   2HD2  LEU  17          HD22      LEU  17   5.605  -8.647  -3.962
  277   3HD2  LEU  17          HD23      LEU  17   6.553  -9.924  -4.725
  278    H    VAL  18           H        VAL  18   3.088  -6.131  -3.768
  279    HA   VAL  18           HA       VAL  18   4.081  -7.309  -1.477
  280    HB   VAL  18           HB       VAL  18   1.922  -6.032  -0.378
  281   1HG1  VAL  18          HG11      VAL  18   3.900  -4.115  -1.272
  282   2HG1  VAL  18          HG12      VAL  18   4.660  -5.611  -0.730
  283   3HG1  VAL  18          HG13      VAL  18   3.587  -4.724   0.352
  284   1HG2  VAL  18          HG21      VAL  18   1.386  -5.605  -2.966
  285   2HG2  VAL  18          HG22      VAL  18   2.537  -4.290  -2.723
  286   3HG2  VAL  18          HG23      VAL  18   1.076  -4.376  -1.739
  287    H    CYS  19           H        CYS  19   0.779  -7.610  -2.676
  288    HA   CYS  19           HA       CYS  19   0.223  -9.678  -0.623
  289   1HB   CYS  19          HB2       CYS  19  -1.776  -9.331  -2.755
  290   2HB   CYS  19          HB1       CYS  19  -1.979  -9.298  -1.013
  291    H    GLY  20           H        GLY  20  -0.419  -9.580  -4.120
  292   1HA   GLY  20          HA2       GLY  20   0.410 -11.120  -5.770
  293   2HA   GLY  20          HA1       GLY  20   1.031 -12.140  -4.468
  294    H    GLU  21           H        GLU  21  -0.039 -14.081  -4.667
  295    HA   GLU  21           HA       GLU  21  -2.611 -14.459  -5.768
  296   1HB   GLU  21          HB2       GLU  21  -1.453 -16.102  -3.496
  297   2HB   GLU  21          HB1       GLU  21  -2.602 -16.634  -4.725
  298   1HG   GLU  21          HG2       GLU  21  -0.186 -15.510  -5.912
  299   2HG   GLU  21          HG1       GLU  21   0.175 -16.878  -4.859
  300    H    ARG  22           H        ARG  22  -1.643 -13.143  -2.736
  301    HA   ARG  22           HA       ARG  22  -4.110 -13.600  -1.299
  302   1HB   ARG  22          HB2       ARG  22  -1.800 -11.689  -0.961
  303   2HB   ARG  22          HB1       ARG  22  -3.231 -11.582   0.065
  304   1HG   ARG  22          HG2       ARG  22  -2.742 -13.523   1.175
  305   2HG   ARG  22          HG1       ARG  22  -2.050 -14.289  -0.256
  306   1HD   ARG  22          HD2       ARG  22  -0.513 -11.967   0.672
  307   2HD   ARG  22          HD1       ARG  22  -0.592 -13.271   1.856
  308    HE   ARG  22           HE       ARG  22   0.941 -13.327  -0.571
  309   1HH1  ARG  22          HH21      ARG  22   1.585 -15.062   1.731
  310   2HH1  ARG  22          HH22      ARG  22   1.122 -16.635   1.172
  311   1HH2  ARG  22          HH11      ARG  22  -0.823 -15.430  -1.432
  312   2HH2  ARG  22          HH12      ARG  22  -0.239 -16.843  -0.618
  313    H    GLY  23           H        GLY  23  -3.310 -11.621  -3.931
  314   1HA   GLY  23          HA2       GLY  23  -4.582  -9.977  -5.038
  315   2HA   GLY  23          HA1       GLY  23  -5.915 -10.374  -3.949
  316    H    PHE  24           H        PHE  24  -5.631  -7.733  -4.466
  317    HA   PHE  24           HA       PHE  24  -4.458  -6.687  -1.902
  318   1HB   PHE  24          HB2       PHE  24  -3.961  -4.607  -3.336
  319   2HB   PHE  24          HB1       PHE  24  -2.857  -5.957  -3.481
  320    HD1  PHE  24           HD1      PHE  24  -5.027  -3.719  -5.217
  321    HD2  PHE  24           HD2      PHE  24  -3.307  -7.653  -5.391
  322    HE1  PHE  24           HE1      PHE  24  -5.465  -3.800  -7.656
  323    HE2  PHE  24           HE2      PHE  24  -3.741  -7.733  -7.830
  324    HZ   PHE  24           HZ       PHE  24  -4.818  -5.806  -8.966
  325    H    PHE  25           H        PHE  25  -5.140  -4.068  -2.158
  326    HA   PHE  25           HA       PHE  25  -8.113  -4.152  -2.290
  327   1HB   PHE  25          HB2       PHE  25  -6.129  -2.824  -0.582
  328   2HB   PHE  25          HB1       PHE  25  -7.443  -1.771  -1.113
  329    HD1  PHE  25           HD1      PHE  25  -7.153  -5.381  -0.223
  330    HD2  PHE  25           HD2      PHE  25  -9.156  -1.647   0.428
  331    HE1  PHE  25           HE1      PHE  25  -8.641  -6.473   1.397
  332    HE2  PHE  25           HE2      PHE  25 -10.653  -2.727   2.055
  333    HZ   PHE  25           HZ       PHE  25 -10.416  -5.158   2.556
  334    H    TYR  26           H        TYR  26  -6.006  -1.335  -2.418
  335    HA   TYR  26           HA       TYR  26  -5.798   0.350  -4.036
  336   1HB   TYR  26          HB2       TYR  26  -5.409  -1.683  -5.565
  337   2HB   TYR  26          HB1       TYR  26  -7.116  -1.570  -5.972
  338    HD1  TYR  26           HD1      TYR  26  -6.149   1.698  -5.264
  339    HD2  TYR  26           HD2      TYR  26  -5.666  -1.330  -8.278
  340    HE1  TYR  26           HE1      TYR  26  -5.628   3.449  -6.943
  341    HE2  TYR  26           HE2      TYR  26  -5.146   0.423  -9.954
  342    HH   TYR  26           HH       TYR  26  -5.718   2.961 -10.193
  343    H    THR  27           H        THR  27  -7.509   1.342  -2.679
  344    HA   THR  27           HA       THR  27 -10.300   0.972  -3.416
  345    HB   THR  27           HB       THR  27 -10.523   3.092  -1.917
  346    HG1  THR  27           HG1      THR  27  -8.743   3.653  -0.821
  347   1HG2  THR  27          HG21      THR  27 -10.220   1.702   0.114
  348   2HG2  THR  27          HG22      THR  27  -9.354   0.506  -0.850
  349   3HG2  THR  27          HG23      THR  27 -11.062   0.821  -1.162
  350    H    LYS  28           H        LYS  28 -10.365   1.536  -5.668
  351    HA   LYS  28           HA       LYS  28  -9.959   4.453  -6.205
  352   1HB   LYS  28          HB2       LYS  28  -8.392   3.060  -7.499
  353   2HB   LYS  28          HB1       LYS  28  -9.744   2.122  -8.137
  354   1HG   LYS  28          HG2       LYS  28 -10.268   3.711  -9.665
  355   2HG   LYS  28          HG1       LYS  28 -10.089   5.014  -8.489
  356   1HD   LYS  28          HD2       LYS  28  -7.605   4.816  -8.718
  357   2HD   LYS  28          HD1       LYS  28  -7.853   3.625  -9.995
  358   1HE   LYS  28          HE2       LYS  28  -9.365   5.464 -11.074
  359   2HE   LYS  28          HE1       LYS  28  -8.496   6.566 -10.005
  360   1HZ   LYS  28          HZ1       LYS  28  -7.189   4.678 -11.888
  361   2HZ   LYS  28          HZ2       LYS  28  -6.427   5.873 -10.950
  362   3HZ   LYS  28          HZ3       LYS  28  -7.467   6.318 -12.218
  363    HA   PRO  29           HA       PRO  29 -14.423   3.682  -6.703
  364   1HB   PRO  29          HB2       PRO  29 -15.150   6.118  -5.658
  365   2HB   PRO  29          HB1       PRO  29 -14.855   4.678  -4.668
  366   1HG   PRO  29          HG2       PRO  29 -13.134   7.086  -5.038
  367   2HG   PRO  29          HG1       PRO  29 -13.232   5.978  -3.660
  368   1HD   PRO  29          HD2       PRO  29 -11.213   5.974  -5.639
  369   2HD   PRO  29          HD1       PRO  29 -11.528   4.675  -4.469
  370    H    THR  30           H        THR  30 -16.064   5.168  -7.877
  371    HA   THR  30           HA       THR  30 -14.687   6.376 -10.195
  372    HB   THR  30           HB       THR  30 -16.535   4.878 -10.691
  373    HG1  THR  30           HG1      THR  30 -16.419   6.622 -12.066
  374   1HG2  THR  30          HG21      THR  30 -18.155   4.719  -9.132
  375   2HG2  THR  30          HG22      THR  30 -18.835   6.191  -9.826
  376   3HG2  THR  30          HG23      THR  30 -17.742   6.289  -8.445
  Start of MODEL   14
    1   1H    GLY   1           HT1      GLY   1  -6.572   5.879   0.219
    2   2H    GLY   1           HT2      GLY   1  -7.694   5.787  -1.052
    3   3H    GLY   1           HT3      GLY   1  -7.646   7.162  -0.056
    4   1HA   GLY   1          HA1       GLY   1  -6.028   6.608  -2.311
    5   2HA   GLY   1          HA2       GLY   1  -6.352   8.194  -1.551
    6    H    ILE   2           H        ILE   2  -5.098   4.851  -0.715
    7    HA   ILE   2           HA       ILE   2  -2.560   5.291   0.101
    8    HB   ILE   2           HB       ILE   2  -3.771   3.097  -0.193
    9   1HG1  ILE   2          HG12      ILE   2  -1.269   2.216  -1.148
   10   2HG1  ILE   2          HG11      ILE   2  -0.971   3.711  -0.251
   11   1HG2  ILE   2          HG21      ILE   2  -2.674   2.080  -2.492
   12   2HG2  ILE   2          HG22      ILE   2  -3.141   3.701  -2.995
   13   3HG2  ILE   2          HG23      ILE   2  -4.345   2.610  -2.320
   14   1HD1  ILE   2          HD11      ILE   2  -2.260   1.171   0.696
   15   2HD1  ILE   2          HD12      ILE   2  -2.612   2.705   1.494
   16   3HD1  ILE   2          HD13      ILE   2  -0.956   2.096   1.443
   17    H    VAL   3           H        VAL   3  -3.628   5.678  -3.231
   18    HA   VAL   3           HA       VAL   3  -1.173   5.527  -4.586
   19    HB   VAL   3           HB       VAL   3  -3.519   7.389  -5.008
   20   1HG1  VAL   3          HG11      VAL   3  -2.088   8.605  -6.290
   21   2HG1  VAL   3          HG12      VAL   3  -2.161   7.244  -7.407
   22   3HG1  VAL   3          HG13      VAL   3  -0.845   7.355  -6.238
   23   1HG2  VAL   3          HG21      VAL   3  -3.761   5.824  -7.020
   24   2HG2  VAL   3          HG22      VAL   3  -4.098   5.112  -5.443
   25   3HG2  VAL   3          HG23      VAL   3  -2.556   4.800  -6.241
   26    H    GLU   4           H        GLU   4  -2.606   8.615  -3.468
   27    HA   GLU   4           HA       GLU   4  -0.158  10.018  -3.718
   28   1HB   GLU   4          HB2       GLU   4  -1.289  11.796  -2.525
   29   2HB   GLU   4          HB1       GLU   4  -2.443  11.043  -3.614
   30   1HG   GLU   4          HG2       GLU   4  -3.282   9.655  -1.736
   31   2HG   GLU   4          HG1       GLU   4  -2.162  10.475  -0.647
   32    H    GLN   5           H        GLN   5  -1.696   8.460  -0.905
   33    HA   GLN   5           HA       GLN   5   0.007   9.281   1.137
   34   1HB   GLN   5          HB2       GLN   5  -1.930   7.672   1.356
   35   2HB   GLN   5          HB1       GLN   5  -0.864   6.406   0.744
   36   1HG   GLN   5          HG2       GLN   5   0.618   7.679   2.757
   37   2HG   GLN   5          HG1       GLN   5  -1.014   7.538   3.414
   38   1HE2  GLN   5          HE21      GLN   5  -1.912   5.140   2.329
   39   2HE2  GLN   5          HE22      GLN   5  -0.922   3.859   2.837
   40    H    CYS   6           H        CYS   6   0.598   6.613  -1.181
   41    HA   CYS   6           HA       CYS   6   3.399   6.465  -0.208
   42   1HB   CYS   6          HB2       CYS   6   1.934   4.738  -2.223
   43   2HB   CYS   6          HB1       CYS   6   3.577   4.469  -1.648
   44    H    CYS   7           H        CYS   7   1.556   7.866  -2.768
   45    HA   CYS   7           HA       CYS   7   3.954   8.001  -4.490
   46   1HB   CYS   7          HB2       CYS   7   1.762   7.521  -5.558
   47   2HB   CYS   7          HB1       CYS   7   1.173   9.093  -5.037
   48    H    THR   8           H        THR   8   1.558  10.620  -3.991
   49    HA   THR   8           HA       THR   8   3.288  12.787  -4.137
   50    HB   THR   8           HB       THR   8   1.772  13.916  -2.418
   51    HG1  THR   8           HG1      THR   8   0.138  12.736  -1.578
   52   1HG2  THR   8          HG21      THR   8   1.122  14.176  -4.671
   53   2HG2  THR   8          HG22      THR   8  -0.323  13.545  -3.882
   54   3HG2  THR   8          HG23      THR   8   0.702  12.472  -4.836
   55    H    SER   9           H        SER   9   2.710  10.620  -1.464
   56    HA   SER   9           HA       SER   9   5.129  11.689  -0.072
   57   1HB   SER   9          HB2       SER   9   2.558  11.394   0.975
   58   2HB   SER   9          HB1       SER   9   3.374   9.921   1.491
   59    HG   SER   9           HG       SER   9   4.164  12.615   1.920
   60    H    ILE  10           H        ILE  10   5.750   9.399   1.429
   61    HA   ILE  10           HA       ILE  10   5.716   7.231  -0.624
   62    HB   ILE  10           HB       ILE  10   8.143   8.295   0.838
   63   1HG1  ILE  10          HG12      ILE  10   9.046   8.275  -1.514
   64   2HG1  ILE  10          HG11      ILE  10   7.435   7.832  -2.076
   65   1HG2  ILE  10          HG21      ILE  10   9.205   6.299  -0.486
   66   2HG2  ILE  10          HG22      ILE  10   7.574   5.632  -0.427
   67   3HG2  ILE  10          HG23      ILE  10   8.434   5.987   1.068
   68   1HD1  ILE  10          HD11      ILE  10   7.361  10.126  -0.280
   69   2HD1  ILE  10          HD12      ILE  10   6.697   9.957  -1.906
   70   3HD1  ILE  10          HD13      ILE  10   8.384  10.425  -1.684
   71    H    CYS  11           H        CYS  11   5.911   5.081   0.241
   72    HA   CYS  11           HA       CYS  11   5.779   4.862   3.209
   73   1HB   CYS  11          HB2       CYS  11   3.772   3.536   3.175
   74   2HB   CYS  11          HB1       CYS  11   3.431   4.996   2.249
   75    H    SER  12           H        SER  12   5.485   2.249   3.605
   76    HA   SER  12           HA       SER  12   7.543   0.954   1.857
   77   1HB   SER  12          HB2       SER  12   8.607   0.054   3.714
   78   2HB   SER  12          HB1       SER  12   8.055   1.587   4.381
   79    HG   SER  12           HG       SER  12   6.856   0.487   5.698
   80    H    LEU  13           H        LEU  13   7.383  -1.627   2.577
   81    HA   LEU  13           HA       LEU  13   4.887  -2.501   1.438
   82   1HB   LEU  13          HB2       LEU  13   6.849  -4.177   3.025
   83   2HB   LEU  13          HB1       LEU  13   5.685  -4.748   1.832
   84    HG   LEU  13           HG       LEU  13   8.230  -3.200   1.392
   85   1HD1  LEU  13          HD11      LEU  13   8.890  -5.124   0.417
   86   2HD1  LEU  13          HD12      LEU  13   7.420  -5.209  -0.553
   87   3HD1  LEU  13          HD13      LEU  13   7.436  -5.863   1.085
   88   1HD2  LEU  13          HD21      LEU  13   6.488  -1.920   0.225
   89   2HD2  LEU  13          HD22      LEU  13   5.872  -3.400  -0.511
   90   3HD2  LEU  13          HD23      LEU  13   7.471  -2.799  -0.945
   91    H    TYR  14           H        TYR  14   6.162  -2.550   4.769
   92    HA   TYR  14           HA       TYR  14   4.172  -3.933   6.098
   93   1HB   TYR  14          HB2       TYR  14   6.170  -2.772   7.141
   94   2HB   TYR  14          HB1       TYR  14   5.253  -1.270   7.064
   95    HD1  TYR  14           HD1      TYR  14   4.092  -4.743   7.840
   96    HD2  TYR  14           HD2      TYR  14   4.707  -0.746   9.296
   97    HE1  TYR  14           HE1      TYR  14   2.942  -5.336   9.960
   98    HE2  TYR  14           HE2      TYR  14   3.555  -1.341  11.416
   99    HH   TYR  14           HH       TYR  14   1.934  -4.434  11.813
  100    H    GLN  15           H        GLN  15   3.981  -0.654   4.781
  101    HA   GLN  15           HA       GLN  15   1.338  -0.164   5.894
  102   1HB   GLN  15          HB2       GLN  15   2.637   1.274   3.569
  103   2HB   GLN  15          HB1       GLN  15   1.401   1.896   4.661
  104   1HG   GLN  15          HG2       GLN  15   3.458   1.078   6.359
  105   2HG   GLN  15          HG1       GLN  15   4.293   1.832   5.001
  106   1HE2  GLN  15          HE21      GLN  15   1.152   2.589   6.618
  107   2HE2  GLN  15          HE22      GLN  15   1.535   4.214   6.920
  108    H    LEU  16           H        LEU  16   2.595  -1.020   2.656
  109    HA   LEU  16           HA       LEU  16   0.041  -1.154   1.377
  110   1HB   LEU  16          HB2       LEU  16   2.716  -2.447   0.859
  111   2HB   LEU  16          HB1       LEU  16   1.316  -2.962  -0.067
  112    HG   LEU  16           HG       LEU  16   1.907  -1.278  -1.485
  113   1HD1  LEU  16          HD11      LEU  16   0.919   0.538   0.730
  114   2HD1  LEU  16          HD12      LEU  16  -0.126  -0.333  -0.392
  115   3HD1  LEU  16          HD13      LEU  16   0.969   0.911  -0.994
  116   1HD2  LEU  16          HD21      LEU  16   3.403   0.596  -0.795
  117   2HD2  LEU  16          HD22      LEU  16   4.082  -0.996  -0.449
  118   3HD2  LEU  16          HD23      LEU  16   3.373  -0.036   0.850
  119    H    GLU  17           H        GLU  17   1.448  -3.068   3.819
  120    HA   GLU  17           HA       GLU  17   0.081  -5.562   3.225
  121   1HB   GLU  17          HB2       GLU  17   1.518  -4.439   5.624
  122   2HB   GLU  17          HB1       GLU  17   0.591  -5.932   5.761
  123   1HG   GLU  17          HG2       GLU  17   2.769  -5.452   3.710
  124   2HG   GLU  17          HG1       GLU  17   3.002  -6.322   5.227
  125    H    ASN  18           H        ASN  18  -0.658  -2.641   5.050
  126    HA   ASN  18           HA       ASN  18  -2.974  -3.699   6.402
  127   1HB   ASN  18          HB2       ASN  18  -1.972  -0.917   5.789
  128   2HB   ASN  18          HB1       ASN  18  -3.487  -1.199   6.637
  129   1HD2  ASN  18          HD21      ASN  18  -0.179  -2.643   6.835
  130   2HD2  ASN  18          HD22      ASN  18  -0.067  -2.512   8.522
  131    H    TYR  19           H        TYR  19  -2.343  -2.595   3.202
  132    HA   TYR  19           HA       TYR  19  -5.259  -2.326   2.669
  133   1HB   TYR  19          HB2       TYR  19  -2.844  -1.470   1.051
  134   2HB   TYR  19          HB1       TYR  19  -4.522  -1.244   0.546
  135    HD1  TYR  19           HD1      TYR  19  -1.903  -0.200   2.908
  136    HD2  TYR  19           HD2      TYR  19  -6.010   0.301   1.751
  137    HE1  TYR  19           HE1      TYR  19  -2.052   1.830   4.323
  138    HE2  TYR  19           HE2      TYR  19  -6.163   2.329   3.171
  139    HH   TYR  19           HH       TYR  19  -3.565   3.254   5.341
  140    H    CYS  20           H        CYS  20  -2.629  -4.438   2.326
  141    HA   CYS  20           HA       CYS  20  -3.513  -5.809  -0.098
  142   1HB   CYS  20          HB2       CYS  20  -1.260  -5.836   1.635
  143   2HB   CYS  20          HB1       CYS  20  -1.890  -7.469   1.549
  144    H    ASN  21           H        ASN  21  -3.660  -8.433   0.455
  145    HA   ASN  21           HA       ASN  21  -6.267  -8.809   1.485
  146   1HB   ASN  21          HB2       ASN  21  -4.607 -10.419   0.150
  147   2HB   ASN  21          HB1       ASN  21  -4.293 -11.038   1.769
  148   1HD2  ASN  21          HD21      ASN  21  -6.775 -10.917   2.997
  149   2HD2  ASN  21          HD22      ASN  21  -7.899 -11.871   2.156
  150   1H    PHE   1           HT1      PHE   1   9.997  -3.435  -0.790
  151   2H    PHE   1           HT2      PHE   1  11.551  -3.815  -0.219
  152   3H    PHE   1           HT3      PHE   1  11.143  -4.113  -1.841
  153    HA   PHE   1           HA       PHE   1  12.556  -2.068  -1.340
  154   1HB   PHE   1          HB2       PHE   1  10.774  -0.721  -2.892
  155   2HB   PHE   1          HB1       PHE   1  11.862  -1.960  -3.515
  156    HD1  PHE   1           HD1      PHE   1   8.405  -1.256  -2.391
  157    HD2  PHE   1           HD2      PHE   1  11.052  -4.143  -4.159
  158    HE1  PHE   1           HE1      PHE   1   6.455  -2.645  -3.041
  159    HE2  PHE   1           HE2      PHE   1   9.102  -5.533  -4.810
  160    HZ   PHE   1           HZ       PHE   1   6.803  -4.784  -4.251
  161    H    VAL   2           H        VAL   2  12.673  -0.379   0.050
  162    HA   VAL   2           HA       VAL   2  10.154   0.501   1.385
  163    HB   VAL   2           HB       VAL   2  11.682   1.489   3.091
  164   1HG1  VAL   2          HG11      VAL   2  12.725  -0.854   3.726
  165   2HG1  VAL   2          HG12      VAL   2  11.747  -1.423   2.373
  166   3HG1  VAL   2          HG13      VAL   2  10.976  -0.630   3.747
  167   1HG2  VAL   2          HG21      VAL   2  13.884   0.041   1.595
  168   2HG2  VAL   2          HG22      VAL   2  14.052   1.110   2.988
  169   3HG2  VAL   2          HG23      VAL   2  13.587   1.772   1.420
  170    H    ASN   3           H        ASN   3  10.260   2.961   1.979
  171    HA   ASN   3           HA       ASN   3  10.039   5.107   1.013
  172   1HB   ASN   3          HB2       ASN   3  12.755   4.397   1.329
  173   2HB   ASN   3          HB1       ASN   3  12.639   5.176  -0.248
  174   1HD2  ASN   3          HD21      ASN   3  12.505   5.726   3.198
  175   2HD2  ASN   3          HD22      ASN   3  12.207   7.396   3.123
  176    H    GLN   4           H        GLN   4   8.530   3.963  -0.617
  177    HA   GLN   4           HA       GLN   4   9.718   4.245  -3.348
  178   1HB   GLN   4          HB2       GLN   4   9.144   1.868  -2.624
  179   2HB   GLN   4          HB1       GLN   4   7.453   2.370  -2.648
  180   1HG   GLN   4          HG2       GLN   4   8.100   1.332  -4.794
  181   2HG   GLN   4          HG1       GLN   4   7.673   3.029  -5.011
  182   1HE2  GLN   4          HE21      GLN   4  10.272   0.706  -5.263
  183   2HE2  GLN   4          HE22      GLN   4  11.454   1.791  -5.816
  184    H    HIS   5           H        HIS   5   8.477   5.284  -4.888
  185    HA   HIS   5           HA       HIS   5   6.132   6.815  -3.864
  186   1HB   HIS   5          HB2       HIS   5   7.584   7.266  -6.480
  187   2HB   HIS   5          HB1       HIS   5   6.627   8.420  -5.555
  188    HD2  HIS   5           HD2      HIS   5   9.996   6.406  -4.847
  189    HE1  HIS   5           HE1      HIS   5  10.228  10.256  -3.115
  190    HE2  HIS   5           HE2      HIS   5  11.486   8.075  -3.518
  191    H    LEU   6           H        LEU   6   4.507   5.153  -4.158
  192    HA   LEU   6           HA       LEU   6   4.174   4.132  -6.941
  193   1HB   LEU   6          HB2       LEU   6   3.072   3.191  -4.309
  194   2HB   LEU   6          HB1       LEU   6   2.515   2.583  -5.856
  195    HG   LEU   6           HG       LEU   6   4.169   1.046  -5.682
  196   1HD1  LEU   6          HD11      LEU   6   5.265   2.651  -7.238
  197   2HD1  LEU   6          HD12      LEU   6   6.425   1.726  -6.284
  198   3HD1  LEU   6          HD13      LEU   6   6.065   3.398  -5.858
  199   1HD2  LEU   6          HD21      LEU   6   4.256   1.598  -3.246
  200   2HD2  LEU   6          HD22      LEU   6   5.508   2.790  -3.597
  201   3HD2  LEU   6          HD23      LEU   6   5.812   1.078  -3.891
  202    H    CYS   7           H        CYS   7   2.587   4.883  -8.195
  203    HA   CYS   7           HA       CYS   7   0.141   5.892  -6.880
  204   1HB   CYS   7          HB2       CYS   7   0.577   7.552  -9.161
  205   2HB   CYS   7          HB1       CYS   7   0.444   8.038  -7.476
  206    H    GLY   8           H        GLY   8  -1.733   5.590  -8.170
  207   1HA   GLY   8          HA2       GLY   8  -3.033   4.454  -9.755
  208   2HA   GLY   8          HA1       GLY   8  -1.845   5.035 -10.920
  209    H    SER   9           H        SER   9  -1.280   3.312 -12.152
  210    HA   SER   9           HA       SER   9  -1.447   0.592 -11.414
  211   1HB   SER   9          HB2       SER   9   0.605   0.683 -13.286
  212   2HB   SER   9          HB1       SER   9  -1.116   0.546 -13.638
  213    HG   SER   9           HG       SER   9  -0.243   2.327 -14.715
  214    H    ASP  10           H        ASP  10   1.457   2.711 -11.388
  215    HA   ASP  10           HA       ASP  10   3.390   0.886 -10.572
  216   1HB   ASP  10          HB2       ASP  10   2.921   3.775 -10.055
  217   2HB   ASP  10          HB1       ASP  10   4.033   2.969  -8.948
  218    H    LEU  11           H        LEU  11   0.702   2.169  -8.722
  219    HA   LEU  11           HA       LEU  11   1.634   1.041  -6.200
  220   1HB   LEU  11          HB2       LEU  11  -0.019   3.027  -6.598
  221   2HB   LEU  11          HB1       LEU  11  -1.227   1.757  -6.784
  222    HG   LEU  11           HG       LEU  11  -0.667   0.876  -4.550
  223   1HD1  LEU  11          HD11      LEU  11   1.224   3.236  -4.451
  224   2HD1  LEU  11          HD12      LEU  11   1.706   1.539  -4.470
  225   3HD1  LEU  11          HD13      LEU  11   0.829   2.193  -3.089
  226   1HD2  LEU  11          HD21      LEU  11  -2.377   2.412  -4.341
  227   2HD2  LEU  11          HD22      LEU  11  -1.385   3.742  -4.934
  228   3HD2  LEU  11          HD23      LEU  11  -1.157   3.137  -3.294
  229    H    THR  12           H        THR  12  -1.134   0.241  -8.363
  230    HA   THR  12           HA       THR  12  -1.817  -2.216  -7.176
  231    HB   THR  12           HB       THR  12  -1.710  -1.598 -10.149
  232    HG1  THR  12           HG1      THR  12  -3.011  -0.270  -8.595
  233   1HG2  THR  12          HG21      THR  12  -2.657  -3.910  -8.565
  234   2HG2  THR  12          HG22      THR  12  -2.155  -3.832 -10.253
  235   3HG2  THR  12          HG23      THR  12  -3.781  -3.328  -9.792
  236    H    GLU  13           H        GLU  13   0.559  -1.586  -9.755
  237    HA   GLU  13           HA       GLU  13   1.635  -4.121 -10.123
  238   1HB   GLU  13          HB2       GLU  13   2.592  -1.362 -10.355
  239   2HB   GLU  13          HB1       GLU  13   3.890  -2.501 -10.012
  240   1HG   GLU  13          HG2       GLU  13   2.196  -3.727 -11.939
  241   2HG   GLU  13          HG1       GLU  13   2.501  -2.080 -12.490
  242    H    ALA  14           H        ALA  14   2.553  -1.764  -7.602
  243    HA   ALA  14           HA       ALA  14   4.363  -3.529  -6.241
  244   1HB   ALA  14          HB1       ALA  14   4.364  -1.084  -5.878
  245   2HB   ALA  14          HB2       ALA  14   4.132  -1.940  -4.354
  246   3HB   ALA  14          HB3       ALA  14   2.756  -1.188  -5.162
  247    H    LEU  15           H        LEU  15   1.051  -2.508  -5.343
  248    HA   LEU  15           HA       LEU  15   0.571  -4.311  -3.247
  249   1HB   LEU  15          HB2       LEU  15  -1.161  -3.042  -5.340
  250   2HB   LEU  15          HB1       LEU  15  -1.862  -4.304  -4.335
  251    HG   LEU  15           HG       LEU  15  -0.472  -1.823  -3.278
  252   1HD1  LEU  15          HD11      LEU  15  -2.633  -0.940  -2.814
  253   2HD1  LEU  15          HD12      LEU  15  -3.421  -2.478  -3.163
  254   3HD1  LEU  15          HD13      LEU  15  -2.724  -1.527  -4.475
  255   1HD2  LEU  15          HD21      LEU  15  -2.105  -2.891  -1.308
  256   2HD2  LEU  15          HD22      LEU  15  -0.355  -3.087  -1.399
  257   3HD2  LEU  15          HD23      LEU  15  -1.415  -4.326  -2.070
  258    H    TYR  16           H        TYR  16   0.112  -4.813  -6.715
  259    HA   TYR  16           HA       TYR  16  -0.835  -7.473  -6.672
  260   1HB   TYR  16          HB2       TYR  16  -0.227  -5.645  -8.607
  261   2HB   TYR  16          HB1       TYR  16   1.094  -6.791  -8.804
  262    HD1  TYR  16           HD1      TYR  16  -2.356  -6.112  -9.437
  263    HD2  TYR  16           HD2      TYR  16   0.505  -9.279  -8.989
  264    HE1  TYR  16           HE1      TYR  16  -3.894  -7.658 -10.610
  265    HE2  TYR  16           HE2      TYR  16  -1.027 -10.833 -10.161
  266    HH   TYR  16           HH       TYR  16  -4.320  -9.942 -10.929
  267    H    LEU  17           H        LEU  17   2.483  -6.220  -6.558
  268    HA   LEU  17           HA       LEU  17   3.568  -8.940  -6.635
  269   1HB   LEU  17          HB2       LEU  17   4.578  -6.601  -7.491
  270   2HB   LEU  17          HB1       LEU  17   5.305  -6.651  -5.881
  271    HG   LEU  17           HG       LEU  17   5.494  -8.790  -8.026
  272   1HD1  LEU  17          HD11      LEU  17   7.412  -6.792  -6.838
  273   2HD1  LEU  17          HD12      LEU  17   7.068  -7.110  -8.538
  274   3HD1  LEU  17          HD13      LEU  17   7.996  -8.274  -7.592
  275   1HD2  LEU  17          HD21      LEU  17   6.388  -8.744  -5.133
  276   2HD2  LEU  17          HD22      LEU  17   7.049  -9.869  -6.319
  277   3HD2  LEU  17          HD23      LEU  17   5.332  -9.921  -5.914
  278    H    VAL  18           H        VAL  18   3.623  -6.261  -4.204
  279    HA   VAL  18           HA       VAL  18   4.974  -7.453  -2.134
  280    HB   VAL  18           HB       VAL  18   2.803  -6.551  -0.713
  281   1HG1  VAL  18          HG11      VAL  18   4.232  -4.236  -1.371
  282   2HG1  VAL  18          HG12      VAL  18   5.393  -5.557  -1.517
  283   3HG1  VAL  18          HG13      VAL  18   4.521  -5.310  -0.003
  284   1HG2  VAL  18          HG21      VAL  18   1.584  -4.985  -1.840
  285   2HG2  VAL  18          HG22      VAL  18   1.995  -6.001  -3.222
  286   3HG2  VAL  18          HG23      VAL  18   2.927  -4.540  -2.892
  287    H    CYS  19           H        CYS  19   1.589  -8.049  -2.928
  288    HA   CYS  19           HA       CYS  19   1.706 -10.422  -1.134
  289   1HB   CYS  19          HB2       CYS  19  -0.758  -9.041  -2.183
  290   2HB   CYS  19          HB1       CYS  19  -0.672 -10.149  -0.843
  291    H    GLY  20           H        GLY  20   0.019  -9.483  -4.170
  292   1HA   GLY  20          HA2       GLY  20  -0.524 -10.817  -6.035
  293   2HA   GLY  20          HA1       GLY  20   1.028 -11.611  -5.741
  294    H    GLU  21           H        GLU  21   1.075 -13.495  -4.399
  295    HA   GLU  21           HA       GLU  21  -1.357 -15.086  -4.468
  296   1HB   GLU  21          HB2       GLU  21   1.208 -15.623  -2.934
  297   2HB   GLU  21          HB1       GLU  21  -0.024 -16.806  -3.375
  298   1HG   GLU  21          HG2       GLU  21   0.673 -16.926  -5.552
  299   2HG   GLU  21          HG1       GLU  21   1.123 -15.222  -5.610
  300    H    ARG  22           H        ARG  22   0.109 -12.860  -2.276
  301    HA   ARG  22           HA       ARG  22  -1.426 -13.816   0.032
  302   1HB   ARG  22          HB2       ARG  22   0.319 -11.369  -0.211
  303   2HB   ARG  22          HB1       ARG  22  -0.333 -12.031   1.282
  304   1HG   ARG  22          HG2       ARG  22   1.349 -13.730  -0.547
  305   2HG   ARG  22          HG1       ARG  22   2.107 -12.640   0.614
  306   1HD   ARG  22          HD2       ARG  22   1.926 -14.592   1.872
  307   2HD   ARG  22          HD1       ARG  22   0.436 -13.757   2.314
  308    HE   ARG  22           HE       ARG  22  -0.080 -15.382   0.027
  309   1HH1  ARG  22          HH21      ARG  22   1.710 -16.940   2.112
  310   2HH1  ARG  22          HH22      ARG  22   0.474 -17.854   2.909
  311   1HH2  ARG  22          HH11      ARG  22  -2.131 -15.983   1.597
  312   2HH2  ARG  22          HH12      ARG  22  -1.698 -17.314   2.618
  313    H    GLY  23           H        GLY  23  -2.534 -12.567  -2.556
  314   1HA   GLY  23          HA2       GLY  23  -4.402 -11.289  -3.112
  315   2HA   GLY  23          HA1       GLY  23  -4.870 -11.451  -1.425
  316    H    PHE  24           H        PHE  24  -5.553  -9.203  -2.618
  317    HA   PHE  24           HA       PHE  24  -4.617  -7.107  -1.016
  318   1HB   PHE  24          HB2       PHE  24  -2.959  -5.979  -2.178
  319   2HB   PHE  24          HB1       PHE  24  -2.538  -7.624  -2.634
  320    HD1  PHE  24           HD1      PHE  24  -4.293  -4.545  -3.737
  321    HD2  PHE  24           HD2      PHE  24  -2.768  -8.388  -4.915
  322    HE1  PHE  24           HE1      PHE  24  -4.668  -3.963  -6.117
  323    HE2  PHE  24           HE2      PHE  24  -3.143  -7.803  -7.298
  324    HZ   PHE  24           HZ       PHE  24  -4.096  -5.591  -7.899
  325    H    PHE  25           H        PHE  25  -5.860  -5.126  -1.583
  326    HA   PHE  25           HA       PHE  25  -7.449  -5.374  -4.061
  327   1HB   PHE  25          HB2       PHE  25  -9.584  -5.242  -3.007
  328   2HB   PHE  25          HB1       PHE  25  -8.701  -6.539  -2.210
  329    HD1  PHE  25           HD1      PHE  25 -10.631  -3.638  -1.705
  330    HD2  PHE  25           HD2      PHE  25  -7.279  -5.781  -0.084
  331    HE1  PHE  25           HE1      PHE  25 -10.970  -2.508   0.475
  332    HE2  PHE  25           HE2      PHE  25  -7.615  -4.648   2.099
  333    HZ   PHE  25           HZ       PHE  25  -9.457  -3.010   2.378
  334    H    TYR  26           H        TYR  26  -6.315  -3.530  -4.765
  335    HA   TYR  26           HA       TYR  26  -6.077  -1.046  -3.426
  336   1HB   TYR  26          HB2       TYR  26  -4.915  -1.490  -5.518
  337   2HB   TYR  26          HB1       TYR  26  -6.430  -1.728  -6.364
  338    HD1  TYR  26           HD1      TYR  26  -5.535   0.973  -3.935
  339    HD2  TYR  26           HD2      TYR  26  -6.421  -0.069  -8.006
  340    HE1  TYR  26           HE1      TYR  26  -5.567   3.376  -4.549
  341    HE2  TYR  26           HE2      TYR  26  -6.438   2.331  -8.622
  342    HH   TYR  26           HH       TYR  26  -6.170   4.412  -7.910
  343    H    THR  27           H        THR  27  -7.525   0.881  -3.621
  344    HA   THR  27           HA       THR  27 -10.299   0.108  -3.290
  345    HB   THR  27           HB       THR  27 -10.361   2.835  -3.394
  346    HG1  THR  27           HG1      THR  27  -8.273   3.228  -2.170
  347   1HG2  THR  27          HG21      THR  27  -9.783   0.826  -1.256
  348   2HG2  THR  27          HG22      THR  27 -11.177   1.888  -1.449
  349   3HG2  THR  27          HG23      THR  27  -9.650   2.537  -0.852
  350    H    LYS  28           H        LYS  28  -8.888   2.544  -5.541
  351    HA   LYS  28           HA       LYS  28 -11.028   1.706  -7.462
  352   1HB   LYS  28          HB2       LYS  28 -10.351   4.326  -6.387
  353   2HB   LYS  28          HB1       LYS  28 -10.305   4.311  -8.151
  354   1HG   LYS  28          HG2       LYS  28 -12.561   4.736  -7.794
  355   2HG   LYS  28          HG1       LYS  28 -12.574   2.975  -7.880
  356   1HD   LYS  28          HD2       LYS  28 -13.686   3.177  -5.889
  357   2HD   LYS  28          HD1       LYS  28 -12.048   3.293  -5.246
  358   1HE   LYS  28          HE2       LYS  28 -12.141   5.699  -5.230
  359   2HE   LYS  28          HE1       LYS  28 -13.659   5.700  -6.128
  360   1HZ   LYS  28          HZ1       LYS  28 -14.111   4.113  -3.931
  361   2HZ   LYS  28          HZ2       LYS  28 -14.678   5.696  -4.176
  362   3HZ   LYS  28          HZ3       LYS  28 -13.228   5.432  -3.331
  363    HA   PRO  29           HA       PRO  29  -7.101   0.940  -9.624
  364   1HB   PRO  29          HB2       PRO  29  -8.087  -1.224 -11.001
  365   2HB   PRO  29          HB1       PRO  29  -7.388  -1.328  -9.376
  366   1HG   PRO  29          HG2       PRO  29 -10.257  -1.447 -10.199
  367   2HG   PRO  29          HG1       PRO  29  -9.462  -2.170  -8.790
  368   1HD   PRO  29          HD2       PRO  29 -11.024   0.180  -8.763
  369   2HD   PRO  29          HD1       PRO  29  -9.918  -0.345  -7.474
  370    H    THR  30           H        THR  30  -7.069   2.650 -11.091
  371    HA   THR  30           HA       THR  30  -9.070   3.477 -12.858
  372    HB   THR  30           HB       THR  30  -6.246   3.482 -13.850
  373    HG1  THR  30           HG1      THR  30  -7.202   4.655 -11.474
  374   1HG2  THR  30          HG21      THR  30  -8.593   4.827 -14.476
  375   2HG2  THR  30          HG22      THR  30  -6.969   5.305 -14.968
  376   3HG2  THR  30          HG23      THR  30  -7.690   6.001 -13.517
  Start of MODEL   15
    1   1H    GLY   1           HT1      GLY   1  -6.522   7.616   0.861
    2   2H    GLY   1           HT2      GLY   1  -7.663   6.969  -0.219
    3   3H    GLY   1           HT3      GLY   1  -7.607   8.644   0.057
    4   1HA   GLY   1          HA1       GLY   1  -6.203   7.273  -1.875
    5   2HA   GLY   1          HA2       GLY   1  -6.131   9.032  -1.558
    6    H    ILE   2           H        ILE   2  -5.529   5.551  -0.533
    7    HA   ILE   2           HA       ILE   2  -2.923   5.541   0.328
    8    HB   ILE   2           HB       ILE   2  -4.689   3.566  -0.452
    9   1HG1  ILE   2          HG12      ILE   2  -1.971   2.584  -0.010
   10   2HG1  ILE   2          HG11      ILE   2  -2.483   3.815   1.151
   11   1HG2  ILE   2          HG21      ILE   2  -2.202   3.150  -2.118
   12   2HG2  ILE   2          HG22      ILE   2  -3.719   3.740  -2.797
   13   3HG2  ILE   2          HG23      ILE   2  -3.645   2.140  -2.061
   14   1HD1  ILE   2          HD11      ILE   2  -3.356   1.904   2.143
   15   2HD1  ILE   2          HD12      ILE   2  -3.678   1.125   0.593
   16   3HD1  ILE   2          HD13      ILE   2  -4.726   2.426   1.161
   17    H    VAL   3           H        VAL   3  -3.953   5.669  -3.070
   18    HA   VAL   3           HA       VAL   3  -1.533   5.422  -4.407
   19    HB   VAL   3           HB       VAL   3  -3.806   7.363  -4.895
   20   1HG1  VAL   3          HG11      VAL   3  -2.279   8.433  -6.213
   21   2HG1  VAL   3          HG12      VAL   3  -2.583   7.085  -7.310
   22   3HG1  VAL   3          HG13      VAL   3  -1.183   7.050  -6.238
   23   1HG2  VAL   3          HG21      VAL   3  -4.303   4.939  -5.080
   24   2HG2  VAL   3          HG22      VAL   3  -2.981   4.768  -6.236
   25   3HG2  VAL   3          HG23      VAL   3  -4.394   5.741  -6.649
   26    H    GLU   4           H        GLU   4  -2.802   8.688  -3.727
   27    HA   GLU   4           HA       GLU   4  -0.281   9.936  -3.920
   28   1HB   GLU   4          HB2       GLU   4  -1.378  11.882  -3.262
   29   2HB   GLU   4          HB1       GLU   4  -2.721  10.916  -3.851
   30   1HG   GLU   4          HG2       GLU   4  -3.138  10.155  -1.501
   31   2HG   GLU   4          HG1       GLU   4  -1.874  11.261  -0.960
   32    H    GLN   5           H        GLN   5  -1.966   8.556  -1.127
   33    HA   GLN   5           HA       GLN   5  -0.342   9.473   0.961
   34   1HB   GLN   5          HB2       GLN   5  -2.370   7.743   0.889
   35   2HB   GLN   5          HB1       GLN   5  -1.053   6.568   0.926
   36   1HG   GLN   5          HG2       GLN   5  -0.152   7.580   2.956
   37   2HG   GLN   5          HG1       GLN   5  -1.374   8.850   2.896
   38   1HE2  GLN   5          HE21      GLN   5  -2.829   8.406   4.562
   39   2HE2  GLN   5          HE22      GLN   5  -3.514   6.884   4.870
   40    H    CYS   6           H        CYS   6   0.279   6.847  -1.345
   41    HA   CYS   6           HA       CYS   6   3.020   6.586  -0.202
   42   1HB   CYS   6          HB2       CYS   6   1.433   4.777  -2.044
   43   2HB   CYS   6          HB1       CYS   6   3.127   4.518  -1.632
   44    H    CYS   7           H        CYS   7   1.301   7.973  -2.806
   45    HA   CYS   7           HA       CYS   7   3.659   7.872  -4.590
   46   1HB   CYS   7          HB2       CYS   7   1.412   7.572  -5.604
   47   2HB   CYS   7          HB1       CYS   7   0.952   9.171  -5.041
   48    H    THR   8           H        THR   8   1.499  10.688  -4.112
   49    HA   THR   8           HA       THR   8   3.496  12.648  -4.295
   50    HB   THR   8           HB       THR   8   2.017  14.140  -3.064
   51    HG1  THR   8           HG1      THR   8   0.504  11.879  -2.312
   52   1HG2  THR   8          HG21      THR   8   0.081  12.239  -4.341
   53   2HG2  THR   8          HG22      THR   8   1.310  13.019  -5.336
   54   3HG2  THR   8          HG23      THR   8   0.145  13.997  -4.443
   55    H    SER   9           H        SER   9   2.553  10.584  -1.674
   56    HA   SER   9           HA       SER   9   4.865  11.535  -0.040
   57   1HB   SER   9          HB2       SER   9   2.151  10.500   0.660
   58   2HB   SER   9          HB1       SER   9   3.486   9.963   1.674
   59    HG   SER   9           HG       SER   9   2.246  12.153   1.974
   60    H    ILE  10           H        ILE  10   5.375   9.245   1.415
   61    HA   ILE  10           HA       ILE  10   5.476   7.057  -0.604
   62    HB   ILE  10           HB       ILE  10   7.866   8.162   0.903
   63   1HG1  ILE  10          HG12      ILE  10   8.777   8.280  -1.459
   64   2HG1  ILE  10          HG11      ILE  10   7.149   7.929  -2.034
   65   1HG2  ILE  10          HG21      ILE  10   8.536   6.000   0.894
   66   2HG2  ILE  10          HG22      ILE  10   8.739   6.216  -0.843
   67   3HG2  ILE  10          HG23      ILE  10   7.251   5.520  -0.209
   68   1HD1  ILE  10          HD11      ILE  10   6.567  10.083  -1.795
   69   2HD1  ILE  10          HD12      ILE  10   8.228  10.451  -1.332
   70   3HD1  ILE  10          HD13      ILE  10   7.036  10.050  -0.095
   71    H    CYS  11           H        CYS  11   5.583   4.942   0.327
   72    HA   CYS  11           HA       CYS  11   5.489   4.879   3.316
   73   1HB   CYS  11          HB2       CYS  11   3.639   3.224   3.208
   74   2HB   CYS  11          HB1       CYS  11   3.166   4.791   2.561
   75    H    SER  12           H        SER  12   5.291   2.263   3.836
   76    HA   SER  12           HA       SER  12   7.555   1.024   2.308
   77   1HB   SER  12          HB2       SER  12   8.462   0.209   4.289
   78   2HB   SER  12          HB1       SER  12   7.828   1.764   4.821
   79    HG   SER  12           HG       SER  12   6.060   0.734   5.670
   80    H    LEU  13           H        LEU  13   7.389  -1.160   1.813
   81    HA   LEU  13           HA       LEU  13   5.014  -2.298   1.071
   82   1HB   LEU  13          HB2       LEU  13   6.145  -4.311   0.825
   83   2HB   LEU  13          HB1       LEU  13   7.497  -3.188   0.930
   84    HG   LEU  13           HG       LEU  13   6.367  -4.715   3.293
   85   1HD1  LEU  13          HD11      LEU  13   8.457  -6.054   3.099
   86   2HD1  LEU  13          HD12      LEU  13   8.815  -5.228   1.583
   87   3HD1  LEU  13          HD13      LEU  13   7.390  -6.260   1.710
   88   1HD2  LEU  13          HD21      LEU  13   9.092  -3.464   3.161
   89   2HD2  LEU  13          HD22      LEU  13   8.060  -3.743   4.563
   90   3HD2  LEU  13          HD23      LEU  13   7.706  -2.420   3.460
   91    H    TYR  14           H        TYR  14   6.155  -2.011   4.388
   92    HA   TYR  14           HA       TYR  14   4.496  -3.996   5.583
   93   1HB   TYR  14          HB2       TYR  14   6.281  -2.704   6.790
   94   2HB   TYR  14          HB1       TYR  14   5.233  -1.287   6.741
   95    HD1  TYR  14           HD1      TYR  14   4.408  -4.899   7.350
   96    HD2  TYR  14           HD2      TYR  14   4.516  -0.907   8.942
   97    HE1  TYR  14           HE1      TYR  14   3.235  -5.679   9.396
   98    HE2  TYR  14           HE2      TYR  14   3.345  -1.688  10.983
   99    HH   TYR  14           HH       TYR  14   2.868  -3.632  12.195
  100    H    GLN  15           H        GLN  15   3.910  -0.520   5.024
  101    HA   GLN  15           HA       GLN  15   1.165  -0.570   5.863
  102   1HB   GLN  15          HB2       GLN  15   2.467   1.291   3.849
  103   2HB   GLN  15          HB1       GLN  15   1.029   1.621   4.817
  104   1HG   GLN  15          HG2       GLN  15   2.727   0.990   6.801
  105   2HG   GLN  15          HG1       GLN  15   3.892   1.602   5.627
  106   1HE2  GLN  15          HE21      GLN  15   1.521   3.394   4.579
  107   2HE2  GLN  15          HE22      GLN  15   1.525   4.694   5.668
  108    H    LEU  16           H        LEU  16   2.678  -0.662   2.627
  109    HA   LEU  16           HA       LEU  16   0.334  -0.998   1.088
  110   1HB   LEU  16          HB2       LEU  16   3.159  -1.291   0.713
  111   2HB   LEU  16          HB1       LEU  16   2.343  -2.678  -0.007
  112    HG   LEU  16           HG       LEU  16   0.983  -1.287  -1.389
  113   1HD1  LEU  16          HD11      LEU  16   1.745   1.362  -0.877
  114   2HD1  LEU  16          HD12      LEU  16   1.488   0.660   0.720
  115   3HD1  LEU  16          HD13      LEU  16   0.194   0.627  -0.477
  116   1HD2  LEU  16          HD21      LEU  16   2.868  -1.188  -2.627
  117   2HD2  LEU  16          HD22      LEU  16   3.865  -0.779  -1.231
  118   3HD2  LEU  16          HD23      LEU  16   2.964   0.483  -2.071
  119    H    GLU  17           H        GLU  17   2.255  -3.332   2.934
  120    HA   GLU  17           HA       GLU  17   0.812  -5.677   2.083
  121   1HB   GLU  17          HB2       GLU  17   2.752  -6.350   3.125
  122   2HB   GLU  17          HB1       GLU  17   2.760  -4.973   4.222
  123   1HG   GLU  17          HG2       GLU  17   2.392  -7.020   5.499
  124   2HG   GLU  17          HG1       GLU  17   0.919  -6.050   5.523
  125    H    ASN  18           H        ASN  18   0.256  -3.144   4.408
  126    HA   ASN  18           HA       ASN  18  -1.870  -4.530   5.826
  127   1HB   ASN  18          HB2       ASN  18  -0.782  -1.724   5.768
  128   2HB   ASN  18          HB1       ASN  18  -2.299  -2.075   6.590
  129   1HD2  ASN  18          HD21      ASN  18   0.656  -4.091   6.331
  130   2HD2  ASN  18          HD22      ASN  18   0.916  -4.205   8.002
  131    H    TYR  19           H        TYR  19  -1.559  -2.985   2.824
  132    HA   TYR  19           HA       TYR  19  -4.459  -2.362   2.700
  133   1HB   TYR  19          HB2       TYR  19  -2.311  -1.738   0.658
  134   2HB   TYR  19          HB1       TYR  19  -3.946  -1.079   0.717
  135    HD1  TYR  19           HD1      TYR  19  -1.013   0.252   0.922
  136    HD2  TYR  19           HD2      TYR  19  -4.158  -0.669   3.701
  137    HE1  TYR  19           HE1      TYR  19  -0.221   2.067   2.418
  138    HE2  TYR  19           HE2      TYR  19  -3.371   1.150   5.194
  139    HH   TYR  19           HH       TYR  19  -0.670   2.360   5.349
  140    H    CYS  20           H        CYS  20  -2.542  -4.942   2.246
  141    HA   CYS  20           HA       CYS  20  -3.201  -5.872  -0.389
  142   1HB   CYS  20          HB2       CYS  20  -1.996  -6.937   2.070
  143   2HB   CYS  20          HB1       CYS  20  -2.743  -8.141   1.053
  144    H    ASN  21           H        ASN  21  -4.243  -8.399  -0.052
  145    HA   ASN  21           HA       ASN  21  -6.897  -7.966   1.243
  146   1HB   ASN  21          HB2       ASN  21  -6.482  -7.922  -1.498
  147   2HB   ASN  21          HB1       ASN  21  -6.997  -9.582  -1.197
  148   1HD2  ASN  21          HD21      ASN  21  -8.933  -9.537   0.619
  149   2HD2  ASN  21          HD22      ASN  21 -10.184  -8.456   0.237
  150   1H    PHE   1           HT1      PHE   1  10.864  -2.247   1.914
  151   2H    PHE   1           HT2      PHE   1  10.260  -2.785   0.423
  152   3H    PHE   1           HT3      PHE   1   9.219  -2.060   1.552
  153    HA   PHE   1           HA       PHE   1  11.424  -0.739   0.066
  154   1HB   PHE   1          HB2       PHE   1   8.557   0.136   0.054
  155   2HB   PHE   1          HB1       PHE   1   9.783   0.300  -1.202
  156    HD1  PHE   1           HD1      PHE   1   6.820  -1.316  -0.496
  157    HD2  PHE   1           HD2      PHE   1  10.794  -2.188  -1.882
  158    HE1  PHE   1           HE1      PHE   1   5.992  -3.389  -1.576
  159    HE2  PHE   1           HE2      PHE   1   9.965  -4.260  -2.962
  160    HZ   PHE   1           HZ       PHE   1   7.563  -4.861  -2.809
  161    H    VAL   2           H        VAL   2  12.261   1.025   1.095
  162    HA   VAL   2           HA       VAL   2  10.950   1.897   3.620
  163    HB   VAL   2           HB       VAL   2  13.327   1.307   3.778
  164   1HG1  VAL   2          HG11      VAL   2  14.301   3.611   2.244
  165   2HG1  VAL   2          HG12      VAL   2  13.501   2.401   1.243
  166   3HG1  VAL   2          HG13      VAL   2  14.871   1.943   2.250
  167   1HG2  VAL   2          HG21      VAL   2  12.548   3.076   5.256
  168   2HG2  VAL   2          HG22      VAL   2  12.751   4.279   3.983
  169   3HG2  VAL   2          HG23      VAL   2  14.164   3.494   4.687
  170    H    ASN   3           H        ASN   3  11.984   3.101   0.465
  171    HA   ASN   3           HA       ASN   3  10.302   5.504   0.937
  172   1HB   ASN   3          HB2       ASN   3  13.213   5.446   0.459
  173   2HB   ASN   3          HB1       ASN   3  12.322   6.539  -0.600
  174   1HD2  ASN   3          HD21      ASN   3  13.484   8.293   0.704
  175   2HD2  ASN   3          HD22      ASN   3  12.801   8.772   2.182
  176    H    GLN   4           H        GLN   4   8.942   3.962  -0.414
  177    HA   GLN   4           HA       GLN   4   9.733   4.087  -3.290
  178   1HB   GLN   4          HB2       GLN   4   9.187   1.850  -2.007
  179   2HB   GLN   4          HB1       GLN   4   7.516   2.339  -2.286
  180   1HG   GLN   4          HG2       GLN   4   8.329   0.910  -4.125
  181   2HG   GLN   4          HG1       GLN   4   7.976   2.538  -4.703
  182   1HE2  GLN   4          HE21      GLN   4   9.595   3.411  -5.978
  183   2HE2  GLN   4          HE22      GLN   4  11.239   2.998  -5.889
  184    H    HIS   5           H        HIS   5   8.571   5.340  -4.608
  185    HA   HIS   5           HA       HIS   5   6.114   6.657  -3.579
  186   1HB   HIS   5          HB2       HIS   5   7.653   7.186  -6.147
  187   2HB   HIS   5          HB1       HIS   5   6.446   8.233  -5.409
  188    HD2  HIS   5           HD2      HIS   5   9.745   6.625  -3.854
  189    HE1  HIS   5           HE1      HIS   5   9.609  10.756  -2.959
  190    HE2  HIS   5           HE2      HIS   5  10.937   8.598  -2.650
  191    H    LEU   6           H        LEU   6   4.339   5.350  -3.975
  192    HA   LEU   6           HA       LEU   6   4.178   4.019  -6.647
  193   1HB   LEU   6          HB2       LEU   6   3.151   3.285  -3.946
  194   2HB   LEU   6          HB1       LEU   6   2.319   2.723  -5.387
  195    HG   LEU   6           HG       LEU   6   4.060   1.337  -6.018
  196   1HD1  LEU   6          HD11      LEU   6   6.436   1.738  -5.353
  197   2HD1  LEU   6          HD12      LEU   6   5.921   3.202  -4.512
  198   3HD1  LEU   6          HD13      LEU   6   5.749   3.082  -6.264
  199   1HD2  LEU   6          HD21      LEU   6   4.295   1.692  -3.026
  200   2HD2  LEU   6          HD22      LEU   6   5.187   0.444  -3.894
  201   3HD2  LEU   6          HD23      LEU   6   3.423   0.438  -3.906
  202    H    CYS   7           H        CYS   7   2.662   4.669  -8.023
  203    HA   CYS   7           HA       CYS   7   0.247   5.986  -6.906
  204   1HB   CYS   7          HB2       CYS   7   1.102   7.021  -9.528
  205   2HB   CYS   7          HB1       CYS   7   0.460   7.890  -8.142
  206    H    GLY   8           H        GLY   8  -1.586   5.119  -7.771
  207   1HA   GLY   8          HA2       GLY   8  -2.853   3.555  -8.992
  208   2HA   GLY   8          HA1       GLY   8  -2.171   4.415 -10.369
  209    H    SER   9           H        SER   9  -1.216   3.069 -11.790
  210    HA   SER   9           HA       SER   9  -0.793   0.363 -11.580
  211   1HB   SER   9          HB2       SER   9   1.373   1.030 -13.102
  212   2HB   SER   9          HB1       SER   9  -0.278   0.949 -13.708
  213    HG   SER   9           HG       SER   9   1.312   3.050 -13.587
  214    H    ASP  10           H        ASP  10   1.993   2.615 -11.171
  215    HA   ASP  10           HA       ASP  10   3.818   0.779 -10.140
  216   1HB   ASP  10          HB2       ASP  10   3.384   3.700  -9.748
  217   2HB   ASP  10          HB1       ASP  10   4.408   2.897  -8.557
  218    H    LEU  11           H        LEU  11   1.047   2.227  -8.557
  219    HA   LEU  11           HA       LEU  11   1.701   1.157  -5.924
  220   1HB   LEU  11          HB2       LEU  11   0.192   3.172  -6.425
  221   2HB   LEU  11          HB1       LEU  11  -1.025   2.001  -6.924
  222    HG   LEU  11           HG       LEU  11  -0.928   0.946  -4.693
  223   1HD1  LEU  11          HD11      LEU  11   1.394   1.457  -4.122
  224   2HD1  LEU  11          HD12      LEU  11   0.323   2.133  -2.896
  225   3HD1  LEU  11          HD13      LEU  11   1.034   3.184  -4.122
  226   1HD2  LEU  11          HD21      LEU  11  -2.524   2.420  -4.145
  227   2HD2  LEU  11          HD22      LEU  11  -1.881   3.548  -5.338
  228   3HD2  LEU  11          HD23      LEU  11  -1.289   3.587  -3.678
  229    H    THR  12           H        THR  12  -0.550   0.298  -8.552
  230    HA   THR  12           HA       THR  12  -1.571  -2.079  -7.354
  231    HB   THR  12           HB       THR  12  -1.062  -1.414 -10.270
  232    HG1  THR  12           HG1      THR  12  -3.308  -1.021 -10.220
  233   1HG2  THR  12          HG21      THR  12  -1.259  -3.723 -10.359
  234   2HG2  THR  12          HG22      THR  12  -2.956  -3.249 -10.454
  235   3HG2  THR  12          HG23      THR  12  -2.277  -3.794  -8.920
  236    H    GLU  13           H        GLU  13   1.233  -1.511  -9.474
  237    HA   GLU  13           HA       GLU  13   2.219  -4.089  -9.758
  238   1HB   GLU  13          HB2       GLU  13   3.291  -1.408  -9.836
  239   2HB   GLU  13          HB1       GLU  13   4.474  -2.508  -9.134
  240   1HG   GLU  13          HG2       GLU  13   3.761  -4.079 -11.127
  241   2HG   GLU  13          HG1       GLU  13   3.220  -2.568 -11.862
  242    H    ALA  14           H        ALA  14   3.032  -1.898  -7.031
  243    HA   ALA  14           HA       ALA  14   4.327  -3.975  -5.508
  244   1HB   ALA  14          HB1       ALA  14   4.070  -2.362  -3.597
  245   2HB   ALA  14          HB2       ALA  14   3.108  -1.329  -4.655
  246   3HB   ALA  14          HB3       ALA  14   4.804  -1.634  -5.027
  247    H    LEU  15           H        LEU  15   1.204  -2.334  -4.962
  248    HA   LEU  15           HA       LEU  15   0.097  -3.967  -2.990
  249   1HB   LEU  15          HB2       LEU  15  -0.874  -2.210  -5.104
  250   2HB   LEU  15          HB1       LEU  15  -1.971  -3.554  -4.880
  251    HG   LEU  15           HG       LEU  15  -1.181  -1.393  -2.932
  252   1HD1  LEU  15          HD11      LEU  15  -3.216  -1.106  -4.276
  253   2HD1  LEU  15          HD12      LEU  15  -3.631  -1.328  -2.577
  254   3HD1  LEU  15          HD13      LEU  15  -3.824  -2.663  -3.711
  255   1HD2  LEU  15          HD21      LEU  15  -1.736  -4.218  -2.272
  256   2HD2  LEU  15          HD22      LEU  15  -2.746  -3.055  -1.412
  257   3HD2  LEU  15          HD23      LEU  15  -0.990  -2.956  -1.291
  258    H    TYR  16           H        TYR  16   0.172  -4.533  -6.482
  259    HA   TYR  16           HA       TYR  16  -1.168  -7.077  -6.439
  260   1HB   TYR  16          HB2       TYR  16  -0.587  -5.442  -8.416
  261   2HB   TYR  16          HB1       TYR  16   0.926  -6.339  -8.474
  262    HD1  TYR  16           HD1      TYR  16  -2.277  -6.155  -9.795
  263    HD2  TYR  16           HD2      TYR  16   0.537  -9.018  -8.270
  264    HE1  TYR  16           HE1      TYR  16  -3.422  -7.950 -11.067
  265    HE2  TYR  16           HE2      TYR  16  -0.605 -10.817  -9.543
  266    HH   TYR  16           HH       TYR  16  -3.669 -10.399 -10.977
  267    H    LEU  17           H        LEU  17   2.229  -6.081  -6.185
  268    HA   LEU  17           HA       LEU  17   3.257  -8.793  -6.194
  269   1HB   LEU  17          HB2       LEU  17   4.450  -6.639  -6.888
  270   2HB   LEU  17          HB1       LEU  17   4.662  -6.339  -5.164
  271    HG   LEU  17           HG       LEU  17   6.574  -7.531  -6.235
  272   1HD1  LEU  17          HD11      LEU  17   5.639  -7.842  -3.762
  273   2HD1  LEU  17          HD12      LEU  17   6.997  -8.803  -4.347
  274   3HD1  LEU  17          HD13      LEU  17   5.372  -9.489  -4.331
  275   1HD2  LEU  17          HD21      LEU  17   5.190 -10.111  -6.251
  276   2HD2  LEU  17          HD22      LEU  17   6.314  -9.437  -7.429
  277   3HD2  LEU  17          HD23      LEU  17   4.608  -8.993  -7.485
  278    H    VAL  18           H        VAL  18   2.963  -6.274  -3.640
  279    HA   VAL  18           HA       VAL  18   3.937  -7.730  -1.488
  280    HB   VAL  18           HB       VAL  18   1.782  -6.571  -0.275
  281   1HG1  VAL  18          HG11      VAL  18   3.279  -4.707   0.185
  282   2HG1  VAL  18          HG12      VAL  18   4.272  -5.125  -1.212
  283   3HG1  VAL  18          HG13      VAL  18   4.203  -6.209   0.178
  284   1HG2  VAL  18          HG21      VAL  18   0.972  -4.736  -1.426
  285   2HG2  VAL  18          HG22      VAL  18   1.234  -5.842  -2.775
  286   3HG2  VAL  18          HG23      VAL  18   2.422  -4.588  -2.419
  287    H    CYS  19           H        CYS  19   0.608  -7.835  -2.715
  288    HA   CYS  19           HA       CYS  19   0.077 -10.176  -0.967
  289   1HB   CYS  19          HB2       CYS  19  -1.969  -9.566  -2.987
  290   2HB   CYS  19          HB1       CYS  19  -2.126  -9.747  -1.250
  291    H    GLY  20           H        GLY  20  -0.686  -9.629  -4.397
  292   1HA   GLY  20          HA2       GLY  20   0.162 -10.947  -6.247
  293   2HA   GLY  20          HA1       GLY  20   0.694 -12.172  -5.090
  294    H    GLU  21           H        GLU  21  -0.617 -13.934  -4.872
  295    HA   GLU  21           HA       GLU  21  -3.145 -14.045  -6.307
  296   1HB   GLU  21          HB2       GLU  21  -1.815 -15.956  -4.361
  297   2HB   GLU  21          HB1       GLU  21  -3.337 -16.304  -5.181
  298   1HG   GLU  21          HG2       GLU  21  -1.521 -15.394  -7.166
  299   2HG   GLU  21          HG1       GLU  21  -0.663 -16.586  -6.191
  300    H    ARG  22           H        ARG  22  -2.103 -13.371  -3.048
  301    HA   ARG  22           HA       ARG  22  -4.530 -13.789  -1.654
  302   1HB   ARG  22          HB2       ARG  22  -2.039 -12.240  -1.251
  303   2HB   ARG  22          HB1       ARG  22  -3.439 -11.710  -0.319
  304   1HG   ARG  22          HG2       ARG  22  -1.983 -13.462   0.803
  305   2HG   ARG  22          HG1       ARG  22  -3.695 -13.854   0.694
  306   1HD   ARG  22          HD2       ARG  22  -2.999 -15.819  -0.191
  307   2HD   ARG  22          HD1       ARG  22  -2.701 -14.902  -1.660
  308    HE   ARG  22           HE       ARG  22  -0.359 -14.529  -0.357
  309   1HH1  ARG  22          HH21      ARG  22  -1.253 -17.016   1.237
  310   2HH1  ARG  22          HH22      ARG  22  -0.412 -18.260   0.374
  311   1HH2  ARG  22          HH11      ARG  22   0.275 -16.260  -2.372
  312   2HH2  ARG  22          HH12      ARG  22   0.456 -17.831  -1.667
  313    H    GLY  23           H        GLY  23  -3.780 -11.529  -4.081
  314   1HA   GLY  23          HA2       GLY  23  -5.117  -9.831  -5.005
  315   2HA   GLY  23          HA1       GLY  23  -6.397 -10.318  -3.893
  316    H    PHE  24           H        PHE  24  -5.491  -7.606  -4.564
  317    HA   PHE  24           HA       PHE  24  -4.573  -6.695  -1.842
  318   1HB   PHE  24          HB2       PHE  24  -3.900  -4.624  -3.180
  319   2HB   PHE  24          HB1       PHE  24  -2.900  -6.044  -3.414
  320    HD1  PHE  24           HD1      PHE  24  -5.156  -3.666  -4.958
  321    HD2  PHE  24           HD2      PHE  24  -3.270  -7.496  -5.441
  322    HE1  PHE  24           HE1      PHE  24  -5.650  -3.600  -7.386
  323    HE2  PHE  24           HE2      PHE  24  -3.766  -7.433  -7.870
  324    HZ   PHE  24           HZ       PHE  24  -4.955  -5.484  -8.844
  325    H    PHE  25           H        PHE  25  -5.189  -4.001  -2.229
  326    HA   PHE  25           HA       PHE  25  -8.162  -4.080  -2.417
  327   1HB   PHE  25          HB2       PHE  25  -6.254  -2.797  -0.586
  328   2HB   PHE  25          HB1       PHE  25  -7.545  -1.737  -1.151
  329    HD1  PHE  25           HD1      PHE  25  -7.008  -5.209   0.094
  330    HD2  PHE  25           HD2      PHE  25  -9.614  -1.808  -0.095
  331    HE1  PHE  25           HE1      PHE  25  -8.571  -6.338   1.622
  332    HE2  PHE  25           HE2      PHE  25 -11.187  -2.924   1.435
  333    HZ   PHE  25           HZ       PHE  25 -10.685  -5.204   2.309
  334    H    TYR  26           H        TYR  26  -5.927  -1.336  -2.437
  335    HA   TYR  26           HA       TYR  26  -5.688   0.407  -3.986
  336   1HB   TYR  26          HB2       TYR  26  -5.150  -1.563  -5.517
  337   2HB   TYR  26          HB1       TYR  26  -6.842  -1.533  -6.011
  338    HD1  TYR  26           HD1      TYR  26  -3.675   0.382  -5.972
  339    HD2  TYR  26           HD2      TYR  26  -7.706   0.197  -7.444
  340    HE1  TYR  26           HE1      TYR  26  -3.170   2.211  -7.571
  341    HE2  TYR  26           HE2      TYR  26  -7.203   2.024  -9.044
  342    HH   TYR  26           HH       TYR  26  -5.114   4.085  -8.887
  343    H    THR  27           H        THR  27  -7.829   0.584  -2.395
  344    HA   THR  27           HA       THR  27 -10.345   0.705  -3.857
  345    HB   THR  27           HB       THR  27 -10.260   0.231  -1.426
  346    HG1  THR  27           HG1      THR  27 -12.158   1.097  -2.065
  347   1HG2  THR  27          HG21      THR  27  -9.797   3.046  -0.695
  348   2HG2  THR  27          HG22      THR  27  -8.379   2.224  -1.345
  349   3HG2  THR  27          HG23      THR  27  -9.205   1.571   0.069
  350    H    LYS  28           H        LYS  28 -10.066   2.200  -5.560
  351    HA   LYS  28           HA       LYS  28  -9.811   5.041  -4.685
  352   1HB   LYS  28          HB2       LYS  28  -7.677   4.075  -5.743
  353   2HB   LYS  28          HB1       LYS  28  -8.592   4.003  -7.250
  354   1HG   LYS  28          HG2       LYS  28  -9.167   6.509  -6.682
  355   2HG   LYS  28          HG1       LYS  28  -7.718   6.407  -5.680
  356   1HD   LYS  28          HD2       LYS  28  -6.620   6.933  -7.602
  357   2HD   LYS  28          HD1       LYS  28  -6.852   5.229  -7.995
  358   1HE   LYS  28          HE2       LYS  28  -7.767   6.210  -9.885
  359   2HE   LYS  28          HE1       LYS  28  -9.203   6.093  -8.867
  360   1HZ   LYS  28          HZ1       LYS  28  -7.472   8.467  -9.274
  361   2HZ   LYS  28          HZ2       LYS  28  -8.670   8.378  -8.074
  362   3HZ   LYS  28          HZ3       LYS  28  -9.100   8.290  -9.715
  363    HA   PRO  29           HA       PRO  29 -13.403   4.184  -7.549
  364   1HB   PRO  29          HB2       PRO  29 -15.391   4.667  -5.714
  365   2HB   PRO  29          HB1       PRO  29 -14.698   3.061  -6.005
  366   1HG   PRO  29          HG2       PRO  29 -14.259   4.906  -3.702
  367   2HG   PRO  29          HG1       PRO  29 -14.141   3.140  -3.763
  368   1HD   PRO  29          HD2       PRO  29 -11.963   4.946  -3.802
  369   2HD   PRO  29          HD1       PRO  29 -11.892   3.216  -4.199
  370    H    THR  30           H        THR  30 -15.489   5.859  -7.562
  371    HA   THR  30           HA       THR  30 -14.568   8.584  -6.841
  372    HB   THR  30           HB       THR  30 -15.693   8.353  -9.571
  373    HG1  THR  30           HG1      THR  30 -14.124   7.219 -10.376
  374   1HG2  THR  30          HG21      THR  30 -13.565   9.899  -9.838
  375   2HG2  THR  30          HG22      THR  30 -13.649   9.957  -8.078
  376   3HG2  THR  30          HG23      THR  30 -15.017  10.510  -9.046