*HEADER    HORMONE                                 31-AUG-07   2JUM              
*TITLE     THRA3-DKP-INSULIN                                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INSULIN A CHAIN;                                           
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES;                                                       
*COMPND   6 MOL_ID: 2;                                                           
*COMPND   7 MOLECULE: INSULIN B CHAIN;                                           
*COMPND   8 CHAIN: B;                                                            
*COMPND   9 ENGINEERED: YES;                                                     
*COMPND  10 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 MOL_ID: 2;                                                           
*SOURCE   4 SYNTHETIC: YES                                                       
*KEYWDS    INSULIN, NMR, THRA3, CARBOHYDRATE METABOLISM, CLEAVAGE ON             
*KEYWDS   2 PAIR OF BASIC RESIDUES, DIABETES MELLITUS, DISEASE MUTATION,         
*KEYWDS   3 GLUCOSE METABOLISM, HORMONE, PHARMACEUTICAL, SECRETED                
*EXPDTA    NMR, 15 STRUCTURES                                                    
*AUTHOR    K.HUANG, S.CHAN, Q.HUA, Y.CHU, R.WANG, B.KLAPROTH, W.JIA,             
*AUTHOR   2 J.WHITTAKER, P.DE MEYTS, S.H.NAKAGAWA, D.F.STEINER,                  
*AUTHOR   3 P.G.KATSOYANNIS, M.A.WEISS                                           
*REVDAT   1   16-OCT-07 2JUM    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:LEU_32:HD2*   1:LEU_32:HD1*   1:LEU_32:CD2    1:LEU_32:CD1    1:LEU_32:CG    
1:LEU_16:HD1*   1:LEU_16:HD2*   1:LEU_16:CD1    1:LEU_16:CD2    1:LEU_16: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_27:HD1*   1:LEU_27:HD2*   1:LEU_27:CD1    1:LEU_27:CD2    1:LEU_27:CG    
1:VAL_33:HG1*   1:VAL_33:HG2*   1:VAL_33:CG1    1:VAL_33:CG2    1:VAL_33:CB    
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:THR_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:VAL_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:THR_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:THR_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:VAL_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:VAL_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:VAL_33:HN         2.300  2.600 10.00 10.00 1000.000
1:SER_30:O         1:VAL_33:N          2.700  3.300 10.00 10.00 1000.000
1:GLY_29:O         1:VAL_33:HN         2.300  2.600 10.00 10.00 1000.000
1:GLY_29:O         1:VAL_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:VAL_33:O         1:TYR_37:HN         2.300  2.600 10.00 10.00 1000.000
1:VAL_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:ARG+_43:O        1:ASNC_21:HD22      2.300  2.600 10.00 10.00 1000.000
1:ARG+_43:O        1:ASNC_21:ND2       2.700  3.300 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:HN         1:GLYN_1:HA*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HA         1:ILE_2:HD1*       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HA         1:ILE_2:HG2*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HA         1:GLN_5:HB1        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HA         1:GLN_5:HB2        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ILE_2:HB         1:ILE_2:HD1*       -1.000  5.400  2.300 10.00 10.00 1000.000  0.00
1:ILE_2:HN         1:ILE_2:HB         -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HN         1:ILE_2:HD1*       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HN         1:ILE_2:HG1*       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HN         1:ILE_2:HG2*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ILE_2:HD1*       1:LEU_36:HD1*      -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HA         1:THR_3:HG*        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:THR_3:HN         1:THR_3:HG*        -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:THR_3:HN         1:ILE_2:HN         -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HN         1:ILE_2:HG1*       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HN         1:ILE_2:HG2*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HA         1:LEU_32:HB1       -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HA         1:LEU_32:HB2       -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HA         1:LEU_32:HD2*      -1.000  4.000  2.700 10.00 10.00 1000.000  0.00
1:THR_3:HA         1:LEU_32:HD1*      -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HG*        1:LEU_32:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HG*        1:LEU_32:HB1       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HG*        1:LEU_32:HB2       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:THR_3:HN         1:LEU_32:HD2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:THR_3:HG*        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HA        1:THR_3:HG*        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:THR_3:HA         -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HA        1:THR_3:HB         -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HB1       1:THR_3:HB         -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HB2       1:THR_3:HB         -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLU-_4:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLU-_4:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLU-_4:HG1       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLU-_4:HG2       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLN_5:HN         1:GLN_5:HB1        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLN_5:HN         1:GLN_5:HB2        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLN_5:HN         1:GLN_5:HG*        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLN_5:HN         1:CYS_6:HB1        -1.000  5.200  3.000 10.00 10.00 1000.000  0.00
1:GLN_5:HN         1:CYS_6:HB2        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_5:HN         1:THR_3:HA         -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:GLN_5:HN         1:ILE_2:HA         -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:GLN_5:HN         1:GLU-_4:HA        -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:ILE_2:HA         -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:THR_3:HA         -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:THR_3:HG*        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:GLU-_4:HA        -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:GLN_5:HA         -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:CYS_7:HB1        -1.000  5.700  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:CYS_7:HB2        -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB1        1:LEU_32:HD2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB2        1:LEU_32:HD2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB1        1:LEU_32:HD1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB2        1:LEU_32:HD1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_7:HB1        1:CYS_28:HA        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_7:HB2        1:CYS_28:HA        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_7:HA         1:THR_3:HG*        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_7:HB1        1:THR_3:HG*        -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_7:HB2        1:THR_3:HG*        -1.000  5.400  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:HN         1:THR_3:HA         -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:THR_3:HG*        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:GLU-_4:HA        -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:GLN_5:HA         -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:THR_8:HA         1:THR_8:HG*        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:THR_8:HB         1:GLU-_4:HB1       -1.000  7.000  2.700 10.00 10.00 1000.000  0.00
1:THR_8:HB         1:GLU-_4:HB2       -1.000  7.000  2.700 10.00 10.00 1000.000  0.00
1:ILE_10:HA        1:ILE_10:HD1*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ILE_10:HA        1:ILE_10:HG2*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ILE_10:HB        1:ILE_10:HG2*      -1.000  3.000  2.700 10.00 10.00 1000.000  0.00
1:ILE_10:HB        1:ILE_10:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:ILE_10:HN        1:ILE_10:HD1*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ILE_10:HN        1:ILE_10:HG1*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_11:HN        1:ILE_10:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HN        1:ILE_10:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB1       1:GLN_15:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB1       1:GLN_15:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB2       1:GLN_15:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB2       1:GLN_15:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:GLN_15:HG*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:SER_12:HA        1:LEU_13:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_16:HD1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_16:HD2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:TYR_14:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:SER_12:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:SER_12:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:SER_12:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:TYR_14:HD*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:GLU-_17:HB1      -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:GLU-_17:HB2      -1.000  5.400  3.000 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:LEU_13:HD1*      -1.000  6.000  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_13:HG        -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HB1       1:LEU_13:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HB2       1:LEU_13:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HB1       1:LEU_13:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HB2       1:LEU_13:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:LEU_13:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:LEU_13:HB2       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:LEU_13:HD1*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:LEU_13:HD2*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:TYR_14:HB1       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:TYR_14:HB2       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:TYR_14:HB1       1:LEU_13:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HB2       1:LEU_13:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HB1       1:LEU_13:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HB2       1:LEU_13:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:TYR_14:HA        -1.000  4.700  2.700 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:HN        1:LEU_13:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:LEU_13:HB2       -1.000  4.000  2.700 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:LEU_13:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:GLN_15:HB1       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:GLN_15:HB2       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:GLN_15:HG*       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:SER_12:HA        -1.000  3.700  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HA        1:GLU-_17:HB1      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_14:HA        1:GLU-_17:HB2      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:TYR_14:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HA        1:ASN_18:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HA        1:ASN_18:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_15:HA        1:GLN_15:HG*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:GLN_15:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:GLN_15:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:GLN_15:HG*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HA        1:LEU_16:HG        -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HA        1:ILE_2:HG1*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HA        1:ILE_2:HD1*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_16:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_16:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_16:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_16:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HB2       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HG        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HD1*      1:LEU_36:HD1*      -1.000  7.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HD2*      1:LEU_36:HD1*      -1.000  7.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HD1*      1:LEU_36:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HD2*      1:LEU_36:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_36:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_36:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HA        1:LEU_36:HD2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_13:HB1       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_13:HB2       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_13:HB1       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_13:HB2       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_13:HG        -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_13:HG        -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_13:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_13:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB1       1:LEU_13:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB2       1:LEU_13:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLN_15:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLN_15:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLN_15:HB2       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLN_15:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:GLN_15:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:GLN_15:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HG*      1:VAL_39:HG1*      -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HG*      1:VAL_39:HG2*      -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HA       1:VAL_39:HG1*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HA       1:VAL_39:HG2*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HA       1:GLU-_17:HG*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:GLU-_17:HB1      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:GLU-_17:HB2      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:GLU-_17:HG*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ASN_18:HB1       1:TYR_19:HE*       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:ASN_18:HB2       1:TYR_19:HE*       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:ASN_18:HB1       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:ASN_18:HB2       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:GLU-_17:HB1      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:GLU-_17:HB2      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:GLU-_17:HG*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:GLU-_17:HA       -1.000  3.400  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:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_16:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_16:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:ASN_18:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:ASN_18:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_36:HD1*      -1.000  8.000  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_36:HD2*      -1.000  5.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:LEU_36:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:LEU_36:HD2*      -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:HE*       1:TYR_19:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:TYR_19:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:LEU_16:HA        -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:TYR_19:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:GLYN_1:HA*       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_16:HA        -1.000  5.400  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:HB2       1:LEU_36:HD2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:LEU_36:HD1*      -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:LEU_36:HD2*      -1.000  6.500  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:HD*       1:LEU_16:HG        -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:ILE_2:HD1*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HB1       1:ILE_2:HG2*       -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HB2       1:ILE_2:HG2*       -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:ASN_18:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:TYR_19:HD*       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:ASN_18:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:LEU_16:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:ILE_2:HN         -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:ILE_2:HA         -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:ILE_2:HG1*       -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:HD*       1:ILE_2:HG2*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:ILE_2:HB         -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:ILE_2:HB         -1.000  7.000  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:TYR_47:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:TYR_19:HA        -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:TYR_19:HB1       -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:TYR_19:HB2       -1.000  4.700  2.700 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  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:THR_48:HG*       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:CYS_20:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:CYS_20:HB2       -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:ASN_18:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:GLU-_17:HA       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HA        1:PHE_45:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HB1       1:PHE_45:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HB2       1:PHE_45:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HA        1:PHE_45:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:CYS_20:HA        1:PHE_45:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:ASNC_21:HB1      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:ASNC_21:HB2      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:TYR_19:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:ASNC_21:HB1      -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:ASNC_21:HB2      -1.000  3.400  2.700 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_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  2.700  2.700 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HB1       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HB2       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:PHEN_22:HA       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:LEU_13:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:LEU_13:HD2*      -1.000  8.000  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  8.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_23:HA        1:VAL_23:HG*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:VAL_23:HN        1:VAL_23:HG*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ASN_24:HN        1:ASN_24:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ASN_24:HN        1:ASN_24:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ASN_24:HN        1:VAL_23:HG*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ASN_24:HN        1:VAL_23:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:ASN_24:HA        1:ILE_10:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ASN_24:HA        1:ILE_10:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:ASN_24:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:ASN_24:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:ASN_24:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:ILE_10:HG2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:ILE_10:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HE2*      1:GLN_25:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HE2*      1:GLN_25:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HA        1:ILE_10:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HA        1:ILE_10:HG2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLN_25:HA        1:GLN_25:HG*       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:GLN_25:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:GLN_25:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:GLN_25:HG*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:HIS_26:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:HIS_26:HB2       -1.000  3.400  2.700 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  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HD2       1:HIS_26:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HD2       1:HIS_26:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HD2       1:ILE_10:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:ILE_10:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:ILE_10:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:GLN_25:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:HIS_26:HE*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:GLN_25:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:GLN_25:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:GLN_25:HG*       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:LEU_27:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:HIS_26:HD2       1:ILE_10:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:HIS_26:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:HIS_26:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:HIS_26:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:ASP-_31:HB1      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:ASP-_31:HB2      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_27:HD1*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_27:HD2*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_27:HG        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:LEU_27:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:LEU_27:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:LEU_27:HD2*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:LEU_27:HG        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_32:HD2*      -1.000  6.300  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_32:HD1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HB1       1:LEU_32:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HB2       1:LEU_32:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HB1       1:LEU_32:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_27:HB2       1:LEU_32:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:CYS_28:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:CYS_28:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HB1       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HB2       -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HG        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HD1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HD2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:LEU_32:HD2*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:LEU_32:HD1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:ASP-_31:HB1      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:ASP-_31:HB2      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_29:HN        1:CYS_28:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLY_29:HN        1:CYS_28:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLY_29:HN        1:LEU_27:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_29:HN        1:LEU_27:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_29:HN        1:GLY_29:HA*       -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:SER_30:HN        1:SER_30:HB*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:SER_30:HN        1:VAL_33:HG1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:SER_30:HN        1:VAL_33:HG2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:SER_30:HN        1:GLY_29:HA*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:GLU-_34:HB1      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:GLU-_34:HB2      -1.000  6.000  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:HN       1:SER_30:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:GLY_29:HA*       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HB1      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HB2      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:ASP-_31:HB1      -1.000  3.500  2.700 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:ASP-_31:HB2      -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_32:HG        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:LEU_32:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:LEU_32:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:LEU_32:HD2*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:LEU_32:HD1*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:ASP-_31:HA       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:SER_30:HA        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:ASP-_31:HB1      -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:ASP-_31:HB2      -1.000  5.000  2.700 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:HA        1:LEU_16:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_16:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_36:HB1       -1.000  7.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:LEU_36:HB2       -1.000  7.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_32:HB1       1:LEU_36:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HB2       1:LEU_36:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HB1       1:LEU_36:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HB2       1:LEU_36:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_32:HG        1:LEU_36:HD1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_33:HA        1:LEU_32:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_33:HA        1:LEU_32:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_33:HA        1:LEU_36:HD1*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:VAL_33:HA        1:LEU_36:HD2*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:VAL_33:HB        1:LEU_27:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_33:HB        1:LEU_27:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:LEU_36:HG        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_33:HA        1:VAL_33:HG1*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_33:HA        1:VAL_33:HG2*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:VAL_33:HB        -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:VAL_33:HG1*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:VAL_33:HG2*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:LEU_32:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:LEU_32:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:GLU-_34:HB1      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:GLU-_34:HB2      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:GLU-_34:HG*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:VAL_33:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:TYR_37:HB1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:TYR_37:HB2       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:VAL_33:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:VAL_33:HG1*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:VAL_33:HG2*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:GLU-_34:HN       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:LEU_36:HG        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HB1       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HB2       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ALA_35:HB*       1:LEU_32:HD1*      -1.000  5.400  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:LEU_36:HA        1:LEU_36:HD1*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:LEU_36:HD2*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:LEU_36:HG        -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HB1       1:LEU_36:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HB2       1:LEU_36:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HB1       1:LEU_36:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HB2       1:LEU_36:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_36:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_36:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_36:HG        -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HG        1:LEU_32:HD1*      -1.000  4.400  3.000 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:HA        1:VAL_39:HG1*      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:VAL_39:HG2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:ALA_35:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:VAL_39:HG1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:VAL_39:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_38:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_38:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:ALA_35:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:VAL_33:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:VAL_33:HG2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:GLU-_34:HA       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_38:HD1*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_38:HD2*      -1.000  5.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_36:HG        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_36:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HE*       1:GLU-_34:HA       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HE*       1:VAL_33:HG1*      -1.000  8.000  2.500 10.00 10.00 1000.000  0.00
1:TYR_37:HE*       1:VAL_33:HG2*      -1.000  8.000  2.500 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:GLU-_34:HA       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:TYR_37:HA        -1.000  4.700  2.700 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:VAL_33:HG1*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HD*       1:VAL_33:HG2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_38:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:PHE_45:HD*       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_36:HN        -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:LEU_38:HB1       1:LEU_38:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HB2       1:LEU_38:HD1*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HB1       1:LEU_38:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HB2       1:LEU_38:HD2*      -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HB1       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HB2       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HD1*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HD2*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_38:HG        -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:TYR_37:HD*       -1.000  7.000  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:GLU-_34:HG*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_36:HD1*      -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_36:HD2*      -1.000  8.500  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:ALA_35:HB*       -1.000  6.000  3.000 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:LEU_38:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HB1       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HB2       -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HG        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HB        1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:TYR_37:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_36:HA        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:VAL_39:HA        1:VAL_39:HG1*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:VAL_39:HA        1:VAL_39:HG2*      -1.000  4.400  2.700 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:VAL_39:HG1*      -1.000  4.400  2.700 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:CYS_40:HN        1:CYS_40:HB1       -1.000  3.600  2.700 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:CYS_40:HB2       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:VAL_39:HG1*      -1.000  6.300  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:VAL_39:HG2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:CYS_20:HB1       -1.000  3.800  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:CYS_20:HB2       -1.000  3.400  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:HA*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:LEU_36:HA        -1.000  5.000  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:VAL_39:HB        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HG1*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HG2*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:LEU_36:HD1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:LEU_36:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_41:HN        1:GLU-_42:HN       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_41:HN        1:CYS_40:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:GLY_41:HN        1:GLY_41:HA*       -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:GLU-_42:HB1      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:GLU-_42:HB2      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:GLU-_42:HG*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:GLY_41:HA*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:ARG+_43:HN       -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:GLY_41:HA*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:GLU-_42:HG*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:GLY_44:HN        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HA       1:ARG+_43:HD*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:ARG+_43:HA       1:ARG+_43:HG*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:ARG+_43:HB*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:ARG+_43:HG*      -1.000  4.400  2.700 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:GLU-_42:HN       1:GLY_44:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:GLY_44:HA*       1:PHE_45:HD*       -1.000  6.500  3.000 10.00 10.00 1000.000  0.00
1:GLY_44:HN        1:GLY_44:HA*       -1.000  2.700  2.700 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:HB*      -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:GLY_44:HN        1:ARG+_43:HG*      -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:HD*       1:LEU_36:HD1*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:LEU_36:HD2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:LEU_36:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:VAL_33:HG1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:VAL_33:HG2*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:VAL_33:HG1*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:VAL_33:HG2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:VAL_33:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:TYR_37:HA        -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:TYR_37:HA        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:TYR_47:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:TYR_47:HB2       -1.000  7.000  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:HB1       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: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  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB2       1:LEU_36:HD2*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:TYR_47:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:TYR_47:HB2       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB1       1:PHE_46:HN        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HB2       1:PHE_46:HN        -1.000  4.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_45:HN        1:PHE_45:HB1       -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:PHE_45:HN        1:PHE_45:HB2       -1.000  4.000  2.700 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_46: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:HD*       1:PHE_46:HA        -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:PHE_46:HD*       1:ASNC_21:HA       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_45:HN        -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:TYR_47:HN        -1.000  5.000  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  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_45:HA        -1.000  3.400  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:CYS_20:HB1       -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:CYS_20:HB2       -1.000  7.000  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:HE*       1:THR_3:HG*        -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:THR_3:HG*        -1.000  8.500  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:ILE_2:HG2*       -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:HE*       1:LEU_32:HD2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:LEU_32:HD2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB1       1:LEU_32:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB2       1:LEU_32:HD2*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB1       1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB2       1:LEU_36:HD1*      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:ILE_2:HG2*       -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LEU_36:HD1*      -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:VAL_33:HG1*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:VAL_33:HG2*      -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:VAL_33:HG1*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:TYR_47:HA        -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:TYR_47:HB1       -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:TYR_47:HB2       -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_47:HD*       1:VAL_33:HA        -1.000  6.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:PHE_45:HB1       -1.000  6.000  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:HN        1:TYR_47:HD*       -1.000  5.400  3.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:TYR_47:HB1       -1.000  3.400  2.700 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:TYR_47:HB2       -1.000  5.000  2.700 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:THR_48:HA        1:THR_48:HG*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:THR_48:HN        1:THR_48:HB        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:THR_48:HN        1:THR_48:HG*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:THR_48:HN        1:TYR_47:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:THR_48:HN        1:LYS+_49:HA       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:THR_48:HN        1:TYR_47:HD*       -1.000  8.000  3.000 10.00 10.00 1000.000  0.00
1:THR_48:HN        1:TYR_47:HB1       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:THR_48:HN        1:TYR_47:HB2       -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:THR_48:HA        1:LYS+_49:HB1      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:THR_48:HA        1:LYS+_49:HB2      -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LYS+_49:HN       1:THR_48:HG*       -1.000  6.000  3.000 10.00 10.00 1000.000  0.00
1:LYS+_49:HA       1:LYS+_49:HG*      -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:LYS+_49:HN       1:LYS+_49:HB1      -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:LYS+_49:HN       1:LYS+_49:HB2      -1.000  5.000  2.700 10.00 10.00 1000.000  0.00
1:LYS+_49:HN       1:LYS+_49:HG*      -1.000  6.000  2.700 10.00 10.00 1000.000  0.00
1:PRO_50:HA        1:PRO_50:HD1       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:PRO_50:HA        1:PRO_50:HD2       -1.000  4.000  2.700 10.00 10.00 1000.000  0.00
1:PRO_50:HA        1:PRO_50:HG*       -1.000  4.400  2.700 10.00 10.00 1000.000  0.00
1:PRO_50:HB*       1:PRO_50:HD1       -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:PRO_50:HB*       1:PRO_50:HD2       -1.000  5.400  2.700 10.00 10.00 1000.000  0.00
1:PRO_50:HD1       1:LYS+_49:HB1      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD1       1:LYS+_49:HB2      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD2       1:LYS+_49:HB1      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD2       1:LYS+_49:HB2      -1.000  5.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD1       1:LYS+_49:HG*      -1.000  7.000  3.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD2       1:LYS+_49:HG*      -1.000  7.000  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:THR_3:N          1:THR_3:CA         1:THR_3:C          -90.000 -40.000 30.00 30.00 1000.000
1:THR_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:VAL_33:N         1:VAL_33:CA        1:VAL_33:C         -90.000 -40.000 30.00 30.00 1000.000
1:VAL_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: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:LEU_32:N         1:LEU_32:CA        1:LEU_32:CB        1:LEU_32:CG        140.000 -140.000 30.00 30.00 1000.000
1:VAL_33:N         1:VAL_33:CA        1:VAL_33:CB        1:VAL_33:CG1       -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    H1   GLY   1           1H       GLY   1  -0.005   0.539   9.734
    2    H2   GLY   1           2H       GLY   1   0.541  -0.544  10.923
    3    H3   GLY   1           3H       GLY   1  -0.493   0.736  11.348
    4    HA2  GLY   1           1HA      GLY   1  -1.203  -1.767  10.144
    5    HA3  GLY   1           2HA      GLY   1  -2.154  -0.781  11.297
    6    H    ILE   2           H        ILE   2  -0.292  -0.869   8.121
    7    HA   ILE   2           HA       ILE   2  -2.654  -0.266   6.522
    8    HB   ILE   2           HB       ILE   2  -0.409   0.534   5.859
    9   HG12  ILE   2          2HG1      ILE   2  -0.417  -0.705   3.488
   10   HG13  ILE   2          1HG1      ILE   2  -1.948  -1.345   4.074
   11   HG21  ILE   2          1HG2      ILE   2   0.156  -2.392   5.919
   12   HG22  ILE   2          2HG2      ILE   2   1.108  -1.049   6.551
   13   HG23  ILE   2          3HG2      ILE   2   1.059  -1.354   4.815
   14   HD11  ILE   2          3HD1      ILE   2  -1.708   1.010   2.718
   15   HD12  ILE   2          1HD1      ILE   2  -1.611   1.589   4.381
   16   HD13  ILE   2          2HD1      ILE   2  -3.016   0.666   3.848
   17    H    THR   3           H        THR   3  -0.957  -3.147   7.534
   18    HA   THR   3           HA       THR   3  -2.140  -4.867   5.504
   19    HB   THR   3           HB       THR   3  -0.877  -5.575   8.168
   20    HG1  THR   3           HG1      THR   3   0.806  -4.903   7.103
   21   HG21  THR   3          3HG2      THR   3  -2.301  -7.143   6.238
   22   HG22  THR   3          1HG2      THR   3  -1.505  -7.682   7.716
   23   HG23  THR   3          2HG2      THR   3  -0.601  -7.613   6.203
   24    H    GLU   4           H        GLU   4  -3.020  -3.716   8.667
   25    HA   GLU   4           HA       GLU   4  -5.294  -5.615   8.831
   26    HB2  GLU   4           2HB      GLU   4  -3.913  -5.092  10.867
   27    HB3  GLU   4           1HB      GLU   4  -4.492  -3.428  10.774
   28    HG2  GLU   4           2HG      GLU   4  -6.438  -3.985  11.761
   29    HG3  GLU   4           1HG      GLU   4  -6.712  -5.277  10.592
   30    H    GLN   5           H        GLN   5  -5.411  -3.827   6.675
   31    HA   GLN   5           HA       GLN   5  -7.993  -2.627   7.084
   32    HB2  GLN   5           2HB      GLN   5  -6.374  -0.995   8.261
   33    HB3  GLN   5           1HB      GLN   5  -5.798  -0.594   6.643
   34    HG2  GLN   5           2HG      GLN   5  -8.686  -0.603   6.681
   35    HG3  GLN   5           1HG      GLN   5  -8.069   0.457   7.948
   36   HE21  GLN   5          1HE2      GLN   5  -9.133   0.725   4.901
   37   HE22  GLN   5          2HE2      GLN   5  -8.086   1.914   4.293
   38    H    CYS   6           H        CYS   6  -4.980  -2.462   5.178
   39    HA   CYS   6           HA       CYS   6  -6.521  -2.001   2.717
   40    HB2  CYS   6           2HB      CYS   6  -3.696  -1.847   3.517
   41    HB3  CYS   6           1HB      CYS   6  -3.947  -2.510   1.901
   42    H    CYS   7           H        CYS   7  -5.865  -4.655   4.557
   43    HA   CYS   7           HA       CYS   7  -5.839  -6.424   2.153
   44    HB2  CYS   7           2HB      CYS   7  -3.865  -6.810   3.431
   45    HB3  CYS   7           1HB      CYS   7  -4.756  -6.843   4.943
   46    H    THR   8           H        THR   8  -7.884  -5.119   4.321
   47    HA   THR   8           HA       THR   8  -9.565  -7.581   4.529
   48    HB   THR   8           HB       THR   8  -9.029  -6.349   6.673
   49    HG1  THR   8           HG1      THR   8 -10.972  -6.823   7.366
   50   HG21  THR   8          3HG2      THR   8 -10.104  -4.184   7.053
   51   HG22  THR   8          1HG2      THR   8 -10.756  -4.200   5.414
   52   HG23  THR   8          2HG2      THR   8  -9.016  -4.076   5.670
   53    H    SER   9           H        SER   9  -9.168  -4.535   3.026
   54    HA   SER   9           HA       SER   9 -11.653  -4.911   1.487
   55    HG   SER   9           HG       SER   9 -11.095  -1.999   4.080
   56    HB2  SER   9           2HB      SER   9 -12.376  -2.567   1.874
   57    HB3  SER   9           1HB      SER   9 -12.382  -3.494   3.371
   58    H    ILE  10           H        ILE  10 -11.574  -2.509   0.058
   59    HA   ILE  10           HA       ILE  10  -8.896  -2.747  -1.231
   60    HB   ILE  10           HB       ILE  10 -11.534  -1.712  -2.297
   61   HG12  ILE  10          2HG1      ILE  10  -9.884  -4.084  -3.195
   62   HG13  ILE  10          1HG1      ILE  10 -11.128  -4.225  -1.951
   63   HG21  ILE  10          1HG2      ILE  10 -10.403  -0.746  -3.994
   64   HG22  ILE  10          2HG2      ILE  10  -9.495  -2.231  -4.278
   65   HG23  ILE  10          3HG2      ILE  10  -8.906  -1.047  -3.111
   66   HD11  ILE  10          3HD1      ILE  10 -11.449  -4.157  -4.798
   67   HD12  ILE  10          1HD1      ILE  10 -12.257  -2.753  -4.098
   68   HD13  ILE  10          2HD1      ILE  10 -12.683  -4.377  -3.556
   69    H    CYS  11           H        CYS  11  -7.640  -0.886  -1.605
   70    HA   CYS  11           HA       CYS  11  -8.523   1.522  -0.075
   71    HB2  CYS  11           2HB      CYS  11  -5.668   1.183  -0.868
   72    HB3  CYS  11           1HB      CYS  11  -6.349   1.841   0.618
   73    H    SER  12           H        SER  12  -6.508   3.246  -1.168
   74    HA   SER  12           HA       SER  12  -7.160   3.378  -4.066
   75    HG   SER  12           HG       SER  12  -8.772   6.004  -1.541
   76    HB2  SER  12           2HB      SER  12  -7.404   6.000  -3.382
   77    HB3  SER  12           1HB      SER  12  -8.771   4.905  -3.556
   78    H    LEU  13           H        LEU  13  -5.339   3.788  -5.172
   79    HA   LEU  13           HA       LEU  13  -2.777   4.110  -4.180
   80    HG   LEU  13           HG       LEU  13  -2.029   5.714  -7.651
   81    HB2  LEU  13           2HB      LEU  13  -2.702   3.828  -6.434
   82    HB3  LEU  13           1HB      LEU  13  -4.167   4.745  -6.706
   83   HD11  LEU  13          1HD1      LEU  13  -3.203   7.621  -7.686
   84   HD12  LEU  13          2HD1      LEU  13  -2.867   7.900  -5.977
   85   HD13  LEU  13          3HD1      LEU  13  -4.262   6.931  -6.455
   86   HD21  LEU  13          3HD2      LEU  13  -0.267   6.015  -6.317
   87   HD22  LEU  13          1HD2      LEU  13  -1.206   5.473  -4.926
   88   HD23  LEU  13          2HD2      LEU  13  -1.201   7.177  -5.379
   89    H    TYR  14           H        TYR  14  -5.223   6.592  -4.668
   90    HA   TYR  14           HA       TYR  14  -3.772   8.941  -4.259
   91    HD1  TYR  14           HD2      TYR  14  -3.996  10.736  -2.755
   92    HD2  TYR  14           HD1      TYR  14  -7.582  10.253  -5.076
   93    HE1  TYR  14           HE2      TYR  14  -3.977  13.158  -3.291
   94    HE2  TYR  14           HE1      TYR  14  -7.560  12.676  -5.612
   95    HH   TYR  14           HH       TYR  14  -6.643  14.761  -4.654
   96    HB2  TYR  14           2HB      TYR  14  -6.442   8.345  -4.254
   97    HB3  TYR  14           1HB      TYR  14  -6.181   8.723  -2.552
   98    H    GLN  15           H        GLN  15  -5.279   7.068  -1.680
   99    HA   GLN  15           HA       GLN  15  -3.700   8.271   0.414
  100    HB2  GLN  15           2HB      GLN  15  -5.904   7.362   0.831
  101    HB3  GLN  15           1HB      GLN  15  -5.376   5.760   0.352
  102    HG2  GLN  15           2HG      GLN  15  -3.520   6.545   2.284
  103    HG3  GLN  15           1HG      GLN  15  -5.068   7.106   2.917
  104   HE21  GLN  15          1HE2      GLN  15  -5.997   5.531   4.226
  105   HE22  GLN  15          2HE2      GLN  15  -5.927   3.859   3.943
  106    H    LEU  16           H        LEU  16  -3.706   5.123  -1.166
  107    HA   LEU  16           HA       LEU  16  -1.722   3.728   0.129
  108    HG   LEU  16           HG       LEU  16  -1.022   1.829  -0.911
  109    HB2  LEU  16           2HB      LEU  16  -2.883   3.647  -2.462
  110    HB3  LEU  16           1HB      LEU  16  -1.142   3.647  -2.701
  111   HD11  LEU  16          1HD1      LEU  16  -3.644   0.804  -1.458
  112   HD12  LEU  16          2HD1      LEU  16  -3.793   2.432  -0.797
  113   HD13  LEU  16          3HD1      LEU  16  -2.921   1.192   0.104
  114   HD21  LEU  16          3HD2      LEU  16  -0.766   0.513  -2.714
  115   HD22  LEU  16          1HD2      LEU  16  -1.556   1.748  -3.692
  116   HD23  LEU  16          2HD2      LEU  16  -2.513   0.463  -2.955
  117    H    GLU  17           H        GLU  17  -1.350   6.624  -1.798
  118    HA   GLU  17           HA       GLU  17   1.539   6.341  -2.047
  119    HB2  GLU  17           2HB      GLU  17   0.335   7.603  -3.716
  120    HB3  GLU  17           1HB      GLU  17  -0.296   8.702  -2.491
  121    HG2  GLU  17           2HG      GLU  17   2.053   9.364  -1.946
  122    HG3  GLU  17           1HG      GLU  17   2.612   8.342  -3.269
  123    H    ASN  18           H        ASN  18  -0.579   7.706   0.347
  124    HA   ASN  18           HA       ASN  18   1.395   9.432   1.561
  125    HB2  ASN  18           2HB      ASN  18  -1.307   9.072   1.889
  126    HB3  ASN  18           1HB      ASN  18  -0.663   8.344   3.358
  127   HD21  ASN  18          1HD2      ASN  18  -0.935  11.370   1.545
  128   HD22  ASN  18          2HD2      ASN  18  -0.381  12.376   2.795
  129    H    TYR  19           H        TYR  19   1.412   6.109   1.317
  130    HA   TYR  19           HA       TYR  19   2.567   5.797   4.042
  131    HD1  TYR  19           HD2      TYR  19   1.438   4.169   5.693
  132    HD2  TYR  19           HD1      TYR  19  -0.587   4.143   1.905
  133    HE1  TYR  19           HE2      TYR  19  -0.744   4.336   6.857
  134    HE2  TYR  19           HE1      TYR  19  -2.769   4.311   3.065
  135    HH   TYR  19           HH       TYR  19  -3.010   5.031   6.427
  136    HB2  TYR  19           2HB      TYR  19   1.732   3.723   1.997
  137    HB3  TYR  19           1HB      TYR  19   2.519   3.342   3.528
  138    H    CYS  20           H        CYS  20   3.975   7.176   1.779
  139    HA   CYS  20           HA       CYS  20   6.205   5.238   1.373
  140    HB2  CYS  20           2HB      CYS  20   5.131   6.783  -0.494
  141    HB3  CYS  20           1HB      CYS  20   6.282   7.947   0.122
  142    H    ASN  21           H        ASN  21   8.392   6.577   1.264
  143    HA   ASN  21           HA       ASN  21   8.693   7.761   3.966
  144    HB2  ASN  21           2HB      ASN  21  10.243   5.957   3.348
  145    HB3  ASN  21           1HB      ASN  21  10.769   6.877   1.937
  146   HD21  ASN  21          1HD2      ASN  21  12.755   6.218   3.747
  147   HD22  ASN  21          2HD2      ASN  21  13.225   7.583   4.640
  148    HA   PHE   1           HA       PHE   1  -6.616   0.994 -10.789
  149    HD1  PHE   1           HD1      PHE   1  -4.208   2.284 -12.453
  150    HD2  PHE   1           HD2      PHE   1  -5.154   3.013  -8.325
  151    HE1  PHE   1           HE1      PHE   1  -1.907   1.613 -11.808
  152    HE2  PHE   1           HE2      PHE   1  -2.854   2.343  -7.680
  153    HZ   PHE   1           HZ       PHE   1  -1.231   1.643  -9.421
  154    H1   PHE   1           1H       PHE   1  -7.891   1.631 -13.141
  155    H2   PHE   1           2H       PHE   1  -6.378   0.876 -12.974
  156    H3   PHE   1           3H       PHE   1  -6.474   2.563 -13.152
  157    HB2  PHE   1           2HB      PHE   1  -6.178   3.812 -11.641
  158    HB3  PHE   1           1HB      PHE   1  -6.718   3.566  -9.980
  159    H    VAL   2           H        VAL   2  -8.861   0.109 -11.101
  160    HA   VAL   2           HA       VAL   2 -10.852   2.041 -10.011
  161    HB   VAL   2           HB       VAL   2 -12.560   0.692 -11.397
  162   HG11  VAL   2          1HG1      VAL   2 -10.838   2.097 -13.337
  163   HG12  VAL   2          2HG1      VAL   2 -11.184   3.018 -11.873
  164   HG13  VAL   2          3HG1      VAL   2 -12.508   2.423 -12.874
  165   HG21  VAL   2          3HG2      VAL   2 -10.172   0.124 -13.144
  166   HG22  VAL   2          1HG2      VAL   2 -11.772  -0.620 -13.183
  167   HG23  VAL   2          2HG2      VAL   2 -10.642  -1.024 -11.890
  168    H    ASN   3           H        ASN   3  -9.168   0.090  -8.762
  169    HA   ASN   3           HA       ASN   3 -10.598  -0.978  -6.719
  170    HB2  ASN   3           2HB      ASN   3 -11.214  -2.445  -9.199
  171    HB3  ASN   3           1HB      ASN   3 -10.824  -3.462  -7.818
  172   HD21  ASN   3          1HD2      ASN   3 -11.885  -1.889  -5.713
  173   HD22  ASN   3          2HD2      ASN   3 -13.569  -1.779  -5.895
  174    H    GLN   4           H        GLN   4  -8.719  -1.181  -5.585
  175    HA   GLN   4           HA       GLN   4  -6.686  -3.056  -6.678
  176    HB2  GLN   4           2HB      GLN   4  -5.462  -1.114  -6.781
  177    HB3  GLN   4           1HB      GLN   4  -6.431  -0.318  -5.546
  178    HG2  GLN   4           2HG      GLN   4  -4.649  -2.602  -4.757
  179    HG3  GLN   4           1HG      GLN   4  -3.943  -1.008  -5.022
  180   HE21  GLN   4          1HE2      GLN   4  -4.802  -2.795  -2.499
  181   HE22  GLN   4          2HE2      GLN   4  -5.504  -1.631  -1.481
  182    H    HIS   5           H        HIS   5  -6.299  -4.779  -5.420
  183    HA   HIS   5           HA       HIS   5  -7.243  -4.744  -2.590
  184    HD2  HIS   5           HD2      HIS   5  -9.873  -5.676  -4.336
  185    HE1  HIS   5           HE1      HIS   5  -8.452  -7.234  -8.000
  186    HE2  HIS   5           HE2      HIS   5 -10.423  -6.099  -6.843
  187    HB2  HIS   5           2HB      HIS   5  -6.271  -7.280  -3.793
  188    HB3  HIS   5           1HB      HIS   5  -7.695  -6.987  -2.797
  189    H    LEU   6           H        LEU   6  -5.656  -4.481  -1.060
  190    HA   LEU   6           HA       LEU   6  -2.868  -5.193  -1.853
  191    HG   LEU   6           HG       LEU   6  -2.989  -2.092  -2.226
  192    HB2  LEU   6           2HB      LEU   6  -4.042  -2.928  -0.338
  193    HB3  LEU   6           1HB      LEU   6  -2.571  -3.582   0.338
  194   HD11  LEU   6          1HD1      LEU   6  -0.365  -2.041  -0.990
  195   HD12  LEU   6          2HD1      LEU   6  -1.635  -1.717   0.192
  196   HD13  LEU   6          3HD1      LEU   6  -1.504  -0.722  -1.257
  197   HD21  LEU   6          3HD2      LEU   6  -1.305  -4.537  -1.973
  198   HD22  LEU   6          1HD2      LEU   6  -0.508  -3.130  -2.662
  199   HD23  LEU   6          2HD2      LEU   6  -1.966  -3.773  -3.414
  200    H    CYS   7           H        CYS   7  -1.659  -6.524  -0.567
  201    HA   CYS   7           HA       CYS   7  -2.147  -7.067   2.170
  202    HB2  CYS   7           2HB      CYS   7  -4.281  -8.031   1.134
  203    HB3  CYS   7           1HB      CYS   7  -3.255  -9.262   0.398
  204    H    GLY   8           H        GLY   8  -0.176  -7.802   2.777
  205    HA2  GLY   8           2HA      GLY   8   1.928  -8.835   2.675
  206    HA3  GLY   8           1HA      GLY   8   1.082 -10.136   1.841
  207    H    SER   9           H        SER   9   2.434 -10.604   0.172
  208    HA   SER   9           HA       SER   9   4.240  -9.091  -1.219
  209    HG   SER   9           HG       SER   9   3.697 -10.882  -4.156
  210    HB2  SER   9           2HB      SER   9   3.689 -11.504  -1.661
  211    HB3  SER   9           1HB      SER   9   2.291 -10.965  -2.587
  212    H    ASP  10           H        ASP  10   0.764  -9.270  -2.103
  213    HA   ASP  10           HA       ASP  10   0.926  -7.377  -4.223
  214    HB2  ASP  10           2HB      ASP  10  -1.341  -8.221  -2.409
  215    HB3  ASP  10           1HB      ASP  10  -1.561  -7.087  -3.737
  216    H    LEU  11           H        LEU  11   0.658  -6.976  -0.745
  217    HA   LEU  11           HA       LEU  11  -0.199  -4.279  -0.603
  218    HG   LEU  11           HG       LEU  11   2.064  -3.554   1.864
  219    HB2  LEU  11           2HB      LEU  11   0.044  -5.717   1.378
  220    HB3  LEU  11           1HB      LEU  11   1.789  -5.750   1.153
  221   HD11  LEU  11          1HD1      LEU  11  -0.105  -2.063   2.028
  222   HD12  LEU  11          2HD1      LEU  11  -0.722  -3.195   0.824
  223   HD13  LEU  11          3HD1      LEU  11   0.727  -2.246   0.484
  224   HD21  LEU  11          3HD2      LEU  11   0.958  -3.387   3.927
  225   HD22  LEU  11          1HD2      LEU  11   0.892  -5.114   3.576
  226   HD23  LEU  11          2HD2      LEU  11  -0.524  -4.102   3.291
  227    H    VAL  12           H        VAL  12   3.134  -5.554  -0.831
  228    HA   VAL  12           HA       VAL  12   4.317  -2.929  -0.991
  229    HB   VAL  12           HB       VAL  12   6.320  -4.210  -1.852
  230   HG11  VAL  12          1HG1      VAL  12   5.014  -4.324   0.711
  231   HG12  VAL  12          2HG1      VAL  12   6.743  -4.331   0.358
  232   HG13  VAL  12          3HG1      VAL  12   5.847  -5.850   0.418
  233   HG21  VAL  12          3HG2      VAL  12   4.801  -5.992  -2.909
  234   HG22  VAL  12          1HG2      VAL  12   4.625  -6.647  -1.281
  235   HG23  VAL  12          2HG2      VAL  12   6.216  -6.585  -2.038
  236    H    GLU  13           H        GLU  13   3.049  -5.197  -3.374
  237    HA   GLU  13           HA       GLU  13   4.168  -4.077  -5.717
  238    HB2  GLU  13           2HB      GLU  13   2.654  -6.162  -5.447
  239    HB3  GLU  13           1HB      GLU  13   1.309  -5.030  -5.594
  240    HG2  GLU  13           2HG      GLU  13   3.133  -4.351  -7.644
  241    HG3  GLU  13           1HG      GLU  13   2.994  -6.109  -7.672
  242    H    ALA  14           H        ALA  14   1.004  -3.289  -4.223
  243    HA   ALA  14           HA       ALA  14   0.463  -1.062  -5.927
  244    HB1  ALA  14           3HB      ALA  14  -1.300  -0.537  -4.419
  245    HB2  ALA  14           1HB      ALA  14  -0.467  -1.301  -3.064
  246    HB3  ALA  14           2HB      ALA  14  -1.146  -2.290  -4.357
  247    H    LEU  15           H        LEU  15   1.844  -1.208  -2.653
  248    HA   LEU  15           HA       LEU  15   2.376   1.601  -2.415
  249    HG   LEU  15           HG       LEU  15   1.522  -0.817  -0.465
  250    HB2  LEU  15           2HB      LEU  15   3.829  -0.761  -1.162
  251    HB3  LEU  15           1HB      LEU  15   4.003   0.915  -0.656
  252   HD11  LEU  15          1HD1      LEU  15   1.774  -0.246   1.935
  253   HD12  LEU  15          2HD1      LEU  15   3.236   0.663   1.550
  254   HD13  LEU  15          3HD1      LEU  15   3.194  -1.083   1.308
  255   HD21  LEU  15          3HD2      LEU  15   0.439   1.203   0.500
  256   HD22  LEU  15          1HD2      LEU  15   0.876   1.455  -1.190
  257   HD23  LEU  15          2HD2      LEU  15   1.867   2.153   0.091
  258    H    TYR  16           H        TYR  16   3.857  -0.926  -4.225
  259    HA   TYR  16           HA       TYR  16   6.523   0.142  -4.385
  260    HD1  TYR  16           HD2      TYR  16   8.451  -0.549  -5.935
  261    HD2  TYR  16           HD1      TYR  16   6.079  -3.725  -4.277
  262    HE1  TYR  16           HE2      TYR  16  10.506  -1.615  -5.041
  263    HE2  TYR  16           HE1      TYR  16   8.132  -4.791  -3.383
  264    HH   TYR  16           HH       TYR  16  10.996  -3.261  -3.029
  265    HB2  TYR  16           2HB      TYR  16   5.032  -2.057  -5.523
  266    HB3  TYR  16           1HB      TYR  16   5.992  -1.261  -6.771
  267    H    LEU  17           H        LEU  17   3.900   0.204  -6.844
  268    HA   LEU  17           HA       LEU  17   5.240   1.993  -8.588
  269    HG   LEU  17           HG       LEU  17   2.308   1.156  -6.889
  270    HB2  LEU  17           2HB      LEU  17   2.903   2.570  -9.404
  271    HB3  LEU  17           1HB      LEU  17   3.313   0.855  -9.421
  272   HD11  LEU  17          1HD1      LEU  17   1.666   3.541  -7.779
  273   HD12  LEU  17          2HD1      LEU  17   0.489   2.616  -6.845
  274   HD13  LEU  17          3HD1      LEU  17   0.370   2.675  -8.603
  275   HD21  LEU  17          3HD2      LEU  17   0.271   0.072  -7.820
  276   HD22  LEU  17          1HD2      LEU  17   1.752  -0.638  -8.465
  277   HD23  LEU  17          2HD2      LEU  17   0.816   0.492  -9.444
  278    H    VAL  18           H        VAL  18   3.239   2.664  -5.722
  279    HA   VAL  18           HA       VAL  18   3.176   5.523  -6.220
  280    HB   VAL  18           HB       VAL  18   2.398   5.723  -3.901
  281   HG11  VAL  18          1HG1      VAL  18   0.339   4.710  -4.255
  282   HG12  VAL  18          2HG1      VAL  18   1.061   3.261  -4.955
  283   HG13  VAL  18          3HG1      VAL  18   0.992   4.752  -5.892
  284   HG21  VAL  18          3HG2      VAL  18   3.090   2.786  -3.779
  285   HG22  VAL  18          1HG2      VAL  18   2.124   3.618  -2.566
  286   HG23  VAL  18          2HG2      VAL  18   3.807   4.076  -2.818
  287    H    CYS  19           H        CYS  19   5.063   3.460  -4.051
  288    HA   CYS  19           HA       CYS  19   6.700   5.645  -3.111
  289    HB2  CYS  19           2HB      CYS  19   6.652   2.694  -2.798
  290    HB3  CYS  19           1HB      CYS  19   8.230   3.449  -2.621
  291    H    GLY  20           H        GLY  20   7.587   2.801  -5.069
  292    HA2  GLY  20           2HA      GLY  20   8.982   2.735  -7.003
  293    HA3  GLY  20           1HA      GLY  20   9.196   4.485  -6.871
  294    H    GLU  21           H        GLU  21  11.534   4.219  -7.070
  295    HA   GLU  21           HA       GLU  21  12.980   2.593  -5.141
  296    HB2  GLU  21           2HB      GLU  21  13.609   4.065  -7.510
  297    HB3  GLU  21           1HB      GLU  21  14.660   4.643  -6.216
  298    HG2  GLU  21           2HG      GLU  21  15.706   2.607  -5.965
  299    HG3  GLU  21           1HG      GLU  21  14.272   1.695  -6.437
  300    H    ARG  22           H        ARG  22  11.254   4.148  -3.682
  301    HA   ARG  22           HA       ARG  22  13.104   6.052  -2.332
  302    HE   ARG  22           HE       ARG  22  11.072   9.727  -2.080
  303    HB2  ARG  22           2HB      ARG  22  10.142   6.296  -2.895
  304    HB3  ARG  22           1HB      ARG  22  10.931   7.236  -1.628
  305    HG2  ARG  22           2HG      ARG  22  12.447   8.238  -3.240
  306    HG3  ARG  22           1HG      ARG  22  11.820   7.205  -4.525
  307    HD2  ARG  22           2HD      ARG  22  10.619   9.170  -4.887
  308    HD3  ARG  22           1HD      ARG  22   9.507   8.263  -3.860
  309   HH11  ARG  22          1HH2      ARG  22   8.398  10.047  -4.128
  310   HH12  ARG  22          2HH2      ARG  22   8.212  11.752  -3.886
  311   HH21  ARG  22          1HH1      ARG  22  11.136  12.079  -2.051
  312   HH22  ARG  22          2HH1      ARG  22   9.761  12.902  -2.707
  313    H    GLY  23           H        GLY  23  11.294   3.203  -2.153
  314    HA2  GLY  23           2HA      GLY  23  11.172   1.721  -0.308
  315    HA3  GLY  23           1HA      GLY  23  11.845   2.987   0.715
  316    H    PHE  24           H        PHE  24   9.374   1.148   0.837
  317    HA   PHE  24           HA       PHE  24   7.341   3.287   1.346
  318    HD1  PHE  24           HD2      PHE  24   7.752   1.206  -1.767
  319    HD2  PHE  24           HD1      PHE  24   7.080  -1.105   1.796
  320    HE1  PHE  24           HE2      PHE  24   8.923  -0.723  -2.795
  321    HE2  PHE  24           HE1      PHE  24   8.252  -3.033   0.765
  322    HZ   PHE  24           HZ       PHE  24   9.173  -2.842  -1.530
  323    HB2  PHE  24           2HB      PHE  24   5.889   0.987   1.414
  324    HB3  PHE  24           1HB      PHE  24   6.128   1.922  -0.056
  325    H    PHE  25           H        PHE  25   5.643   1.910   3.041
  326    HA   PHE  25           HA       PHE  25   7.382   1.571   5.433
  327    HD1  PHE  25           HD2      PHE  25   7.644   2.268   7.149
  328    HD2  PHE  25           HD1      PHE  25   4.504   4.850   5.747
  329    HE1  PHE  25           HE2      PHE  25   8.713   4.189   8.293
  330    HE2  PHE  25           HE1      PHE  25   5.575   6.769   6.894
  331    HZ   PHE  25           HZ       PHE  25   7.678   6.439   8.167
  332    HB2  PHE  25           2HB      PHE  25   4.657   2.623   4.932
  333    HB3  PHE  25           1HB      PHE  25   4.824   1.656   6.392
  334    H    TYR  26           H        TYR  26   4.271   0.178   4.297
  335    HA   TYR  26           HA       TYR  26   3.418  -1.987   4.603
  336    HD1  TYR  26           HD1      TYR  26   2.833  -3.851   4.329
  337    HD2  TYR  26           HD2      TYR  26   6.946  -4.894   3.625
  338    HE1  TYR  26           HE1      TYR  26   2.264  -6.252   4.551
  339    HE2  TYR  26           HE2      TYR  26   6.372  -7.294   3.849
  340    HH   TYR  26           HH       TYR  26   3.777  -8.442   5.261
  341    HB2  TYR  26           2HB      TYR  26   5.055  -2.416   2.827
  342    HB3  TYR  26           1HB      TYR  26   6.322  -2.606   4.027
  343    H    THR  27           H        THR  27   3.790  -0.783   7.037
  344    HA   THR  27           HA       THR  27   5.441  -2.542   8.738
  345    HB   THR  27           HB       THR  27   5.489  -0.265   9.407
  346    HG1  THR  27           HG1      THR  27   3.850  -0.469  11.331
  347   HG21  THR  27          3HG2      THR  27   2.996   0.648  10.012
  348   HG22  THR  27          1HG2      THR  27   2.641  -0.372   8.618
  349   HG23  THR  27          2HG2      THR  27   3.802   0.947   8.473
  350    H    LYS  28           H        LYS  28   4.547  -3.816  10.459
  351    HA   LYS  28           HA       LYS  28   1.983  -5.055   9.771
  352    HB2  LYS  28           2HB      LYS  28   2.497  -6.678  11.452
  353    HB3  LYS  28           1HB      LYS  28   4.023  -6.303  10.657
  354    HG2  LYS  28           2HG      LYS  28   3.611  -4.458  12.835
  355    HG3  LYS  28           1HG      LYS  28   3.429  -6.110  13.424
  356    HD2  LYS  28           2HD      LYS  28   5.590  -6.648  12.175
  357    HD3  LYS  28           1HD      LYS  28   5.799  -4.907  11.982
  358    HE2  LYS  28           2HE      LYS  28   6.840  -5.009  13.997
  359    HE3  LYS  28           1HE      LYS  28   5.207  -5.106  14.658
  360    HZ1  LYS  28           3HZ      LYS  28   6.915  -6.901  15.291
  361    HZ2  LYS  28           1HZ      LYS  28   6.596  -7.543  13.754
  362    HZ3  LYS  28           2HZ      LYS  28   5.337  -7.384  14.884
  363    HA   PRO  29           HA       PRO  29  -0.486  -2.673  12.492
  364    HB2  PRO  29           2HB      PRO  29  -2.590  -4.426  12.749
  365    HB3  PRO  29           1HB      PRO  29  -2.308  -3.429  11.311
  366    HG2  PRO  29           2HG      PRO  29  -1.834  -6.350  11.694
  367    HG3  PRO  29           1HG      PRO  29  -2.186  -5.454  10.207
  368    HD2  PRO  29           2HD      PRO  29   0.360  -6.368  11.008
  369    HD3  PRO  29           1HD      PRO  29   0.041  -5.175   9.735
  370    H    THR  30           H        THR  30  -0.297  -6.143  13.366
  371    HA   THR  30           HA       THR  30   0.184  -5.291  16.185
  372    HB   THR  30           HB       THR  30  -2.152  -5.962  16.084
  373    HG1  THR  30           HG1      THR  30  -0.991  -8.297  17.044
  374   HG21  THR  30          3HG2      THR  30  -2.478  -7.254  14.194
  375   HG22  THR  30          1HG2      THR  30  -2.441  -8.519  15.421
  376   HG23  THR  30          2HG2      THR  30  -1.005  -8.190  14.452
  Start of MODEL    2
    1    H1   GLY   1           1H       GLY   1  -2.228   1.232  11.714
    2    H2   GLY   1           2H       GLY   1  -2.340  -0.284  12.471
    3    H3   GLY   1           3H       GLY   1  -3.589   0.251  11.451
    4    HA2  GLY   1           1HA      GLY   1  -1.235   0.220   9.991
    5    HA3  GLY   1           2HA      GLY   1  -1.354  -1.371  10.804
    6    H    ILE   2           H        ILE   2  -0.917  -1.111   8.178
    7    HA   ILE   2           HA       ILE   2  -3.342  -0.185   6.711
    8    HB   ILE   2           HB       ILE   2  -1.029   0.688   6.073
    9   HG12  ILE   2          2HG1      ILE   2  -2.815  -0.776   4.121
   10   HG13  ILE   2          1HG1      ILE   2  -2.811   0.946   4.500
   11   HG21  ILE   2          1HG2      ILE   2   0.590  -0.721   5.268
   12   HG22  ILE   2          2HG2      ILE   2  -0.583  -1.824   4.550
   13   HG23  ILE   2          3HG2      ILE   2  -0.248  -1.898   6.279
   14   HD11  ILE   2          3HD1      ILE   2  -1.426   1.234   2.745
   15   HD12  ILE   2          1HD1      ILE   2  -1.214  -0.506   2.554
   16   HD13  ILE   2          2HD1      ILE   2  -0.190   0.390   3.677
   17    H    THR   3           H        THR   3  -1.371  -2.992   7.426
   18    HA   THR   3           HA       THR   3  -2.370  -4.733   5.398
   19    HB   THR   3           HB       THR   3  -1.486  -5.450   8.208
   20    HG1  THR   3           HG1      THR   3   0.117  -4.328   7.125
   21   HG21  THR   3          3HG2      THR   3  -0.858  -7.365   6.150
   22   HG22  THR   3          1HG2      THR   3  -2.587  -7.019   6.127
   23   HG23  THR   3          2HG2      THR   3  -1.822  -7.591   7.610
   24    H    GLU   4           H        GLU   4  -3.752  -3.585   8.369
   25    HA   GLU   4           HA       GLU   4  -5.935  -5.588   8.239
   26    HB2  GLU   4           2HB      GLU   4  -4.934  -4.997  10.449
   27    HB3  GLU   4           1HB      GLU   4  -5.486  -3.337  10.224
   28    HG2  GLU   4           2HG      GLU   4  -7.437  -3.954  11.167
   29    HG3  GLU   4           1HG      GLU   4  -7.749  -4.912   9.719
   30    H    GLN   5           H        GLN   5  -5.832  -3.871   6.033
   31    HA   GLN   5           HA       GLN   5  -8.492  -2.818   5.996
   32    HB2  GLN   5           2HB      GLN   5  -6.936  -1.110   7.385
   33    HB3  GLN   5           1HB      GLN   5  -6.591  -0.537   5.752
   34    HG2  GLN   5           2HG      GLN   5  -9.247  -0.737   5.529
   35    HG3  GLN   5           1HG      GLN   5  -9.159  -0.493   7.274
   36   HE21  GLN   5          1HE2      GLN   5  -8.853   1.643   7.990
   37   HE22  GLN   5          2HE2      GLN   5  -8.430   2.940   6.980
   38    H    CYS   6           H        CYS   6  -5.209  -2.493   4.655
   39    HA   CYS   6           HA       CYS   6  -6.238  -1.958   1.964
   40    HB2  CYS   6           2HB      CYS   6  -3.542  -2.239   3.222
   41    HB3  CYS   6           1HB      CYS   6  -3.667  -2.518   1.493
   42    H    CYS   7           H        CYS   7  -6.095  -4.682   3.824
   43    HA   CYS   7           HA       CYS   7  -5.811  -6.388   1.387
   44    HB2  CYS   7           2HB      CYS   7  -3.998  -6.783   3.032
   45    HB3  CYS   7           1HB      CYS   7  -5.198  -7.139   4.258
   46    H    THR   8           H        THR   8  -7.638  -5.676   4.306
   47    HA   THR   8           HA       THR   8  -9.529  -7.867   3.903
   48    HB   THR   8           HB       THR   8  -9.283  -7.021   6.156
   49    HG1  THR   8           HG1      THR   8 -11.447  -7.495   5.301
   50   HG21  THR   8          3HG2      THR   8  -8.782  -4.859   6.496
   51   HG22  THR   8          1HG2      THR   8 -10.410  -4.412   5.984
   52   HG23  THR   8          2HG2      THR   8  -9.108  -4.506   4.799
   53    H    SER   9           H        SER   9  -9.055  -4.676   2.710
   54    HA   SER   9           HA       SER   9 -11.425  -4.947   0.975
   55    HG   SER   9           HG       SER   9 -12.282  -4.630   3.422
   56    HB2  SER   9           2HB      SER   9 -11.082  -2.310   2.353
   57    HB3  SER   9           1HB      SER   9 -12.537  -3.031   1.672
   58    H    ILE  10           H        ILE  10 -11.274  -2.248  -0.001
   59    HA   ILE  10           HA       ILE  10  -8.569  -2.357  -1.262
   60    HB   ILE  10           HB       ILE  10 -11.185  -1.231  -2.285
   61   HG12  ILE  10          2HG1      ILE  10  -9.442  -3.314  -3.585
   62   HG13  ILE  10          1HG1      ILE  10 -10.567  -3.774  -2.306
   63   HG21  ILE  10          1HG2      ILE  10  -9.043   0.096  -2.838
   64   HG22  ILE  10          2HG2      ILE  10 -10.021  -0.442  -4.203
   65   HG23  ILE  10          3HG2      ILE  10  -8.554  -1.319  -3.769
   66   HD11  ILE  10          3HD1      ILE  10 -11.370  -2.204  -4.764
   67   HD12  ILE  10          1HD1      ILE  10 -12.440  -2.905  -3.549
   68   HD13  ILE  10          2HD1      ILE  10 -11.520  -3.957  -4.626
   69    H    CYS  11           H        CYS  11  -7.246  -0.572  -1.090
   70    HA   CYS  11           HA       CYS  11  -8.188   1.606   0.678
   71    HB2  CYS  11           2HB      CYS  11  -5.471   0.788  -0.370
   72    HB3  CYS  11           1HB      CYS  11  -5.723   2.302   0.496
   73    H    SER  12           H        SER  12  -6.656   3.737  -0.212
   74    HA   SER  12           HA       SER  12  -7.857   4.285  -2.899
   75    HG   SER  12           HG       SER  12  -8.337   5.508   0.349
   76    HB2  SER  12           2HB      SER  12  -7.310   6.749  -1.910
   77    HB3  SER  12           1HB      SER  12  -8.854   5.935  -1.679
   78    H    LEU  13           H        LEU  13  -6.181   3.761  -4.238
   79    HA   LEU  13           HA       LEU  13  -3.485   3.807  -4.134
   80    HG   LEU  13           HG       LEU  13  -5.722   2.930  -5.821
   81    HB2  LEU  13           2HB      LEU  13  -4.328   5.552  -6.348
   82    HB3  LEU  13           1HB      LEU  13  -3.455   4.030  -6.391
   83   HD11  LEU  13          1HD1      LEU  13  -6.571   5.474  -5.463
   84   HD12  LEU  13          2HD1      LEU  13  -7.652   4.175  -5.968
   85   HD13  LEU  13          3HD1      LEU  13  -6.972   5.274  -7.168
   86   HD21  LEU  13          3HD2      LEU  13  -6.418   3.210  -8.282
   87   HD22  LEU  13          1HD2      LEU  13  -4.798   2.588  -7.970
   88   HD23  LEU  13          2HD2      LEU  13  -5.021   4.278  -8.423
   89    H    TYR  14           H        TYR  14  -5.412   6.734  -4.565
   90    HA   TYR  14           HA       TYR  14  -3.374   8.658  -4.574
   91    HD1  TYR  14           HD1      TYR  14  -3.274  10.951  -4.075
   92    HD2  TYR  14           HD2      TYR  14  -6.973  10.219  -2.017
   93    HE1  TYR  14           HE1      TYR  14  -2.935  13.011  -2.733
   94    HE2  TYR  14           HE2      TYR  14  -6.637  12.279  -0.675
   95    HH   TYR  14           HH       TYR  14  -4.753  14.680  -1.438
   96    HB2  TYR  14           2HB      TYR  14  -5.536   9.475  -4.978
   97    HB3  TYR  14           1HB      TYR  14  -6.205   8.657  -3.569
   98    H    GLN  15           H        GLN  15  -5.213   7.614  -1.717
   99    HA   GLN  15           HA       GLN  15  -3.357   8.746   0.171
  100    HB2  GLN  15           2HB      GLN  15  -5.646   6.849   0.271
  101    HB3  GLN  15           1HB      GLN  15  -4.501   6.779   1.607
  102    HG2  GLN  15           2HG      GLN  15  -6.083   9.194   0.684
  103    HG3  GLN  15           1HG      GLN  15  -6.235   8.344   2.222
  104   HE21  GLN  15          1HE2      GLN  15  -3.722   8.102   3.201
  105   HE22  GLN  15          2HE2      GLN  15  -2.946   9.606   3.330
  106    H    LEU  16           H        LEU  16  -3.883   5.585  -1.201
  107    HA   LEU  16           HA       LEU  16  -2.177   3.855   0.036
  108    HG   LEU  16           HG       LEU  16  -2.331   1.685  -2.837
  109    HB2  LEU  16           2HB      LEU  16  -3.544   3.630  -2.161
  110    HB3  LEU  16           1HB      LEU  16  -2.082   4.193  -2.962
  111   HD11  LEU  16          1HD1      LEU  16   0.087   2.557  -1.281
  112   HD12  LEU  16          2HD1      LEU  16  -0.134   3.093  -2.946
  113   HD13  LEU  16          3HD1      LEU  16  -0.028   1.371  -2.579
  114   HD21  LEU  16          3HD2      LEU  16  -2.421   0.586  -0.836
  115   HD22  LEU  16          1HD2      LEU  16  -3.123   2.112  -0.298
  116   HD23  LEU  16          2HD2      LEU  16  -1.414   1.780  -0.016
  117    H    GLU  17           H        GLU  17  -1.219   6.407  -2.224
  118    HA   GLU  17           HA       GLU  17   1.586   5.689  -2.192
  119    HB2  GLU  17           2HB      GLU  17   0.979   6.828  -4.122
  120    HB3  GLU  17           1HB      GLU  17  -0.033   7.977  -3.252
  121    HG2  GLU  17           2HG      GLU  17   2.038   8.982  -2.264
  122    HG3  GLU  17           1HG      GLU  17   3.003   7.881  -3.249
  123    H    ASN  18           H        ASN  18  -0.396   7.604  -0.089
  124    HA   ASN  18           HA       ASN  18   1.678   9.295   0.973
  125    HB2  ASN  18           2HB      ASN  18  -0.822   9.603   1.283
  126    HB3  ASN  18           1HB      ASN  18  -0.753   8.316   2.482
  127   HD21  ASN  18          1HD2      ASN  18   1.248  11.237   1.730
  128   HD22  ASN  18          2HD2      ASN  18   1.323  11.773   3.339
  129    H    TYR  19           H        TYR  19   1.342   5.959   1.142
  130    HA   TYR  19           HA       TYR  19   2.414   5.733   3.879
  131    HD1  TYR  19           HD2      TYR  19   0.974   4.729   5.278
  132    HD2  TYR  19           HD1      TYR  19  -0.500   3.571   1.413
  133    HE1  TYR  19           HE2      TYR  19  -1.354   4.980   6.093
  134    HE2  TYR  19           HE1      TYR  19  -2.830   3.823   2.225
  135    HH   TYR  19           HH       TYR  19  -4.124   4.132   4.032
  136    HB2  TYR  19           2HB      TYR  19   1.799   3.632   1.782
  137    HB3  TYR  19           1HB      TYR  19   2.333   3.289   3.430
  138    H    CYS  20           H        CYS  20   3.980   7.050   1.672
  139    HA   CYS  20           HA       CYS  20   6.250   5.134   1.470
  140    HB2  CYS  20           2HB      CYS  20   5.259   6.648  -0.484
  141    HB3  CYS  20           1HB      CYS  20   6.385   7.815   0.168
  142    H    ASN  21           H        ASN  21   8.403   6.642   1.402
  143    HA   ASN  21           HA       ASN  21   8.631   7.623   4.163
  144    HB2  ASN  21           2HB      ASN  21  10.372   6.176   2.965
  145    HB3  ASN  21           1HB      ASN  21  10.794   7.623   2.048
  146   HD21  ASN  21          1HD2      ASN  21  12.865   6.776   3.526
  147   HD22  ASN  21          2HD2      ASN  21  13.055   7.673   4.954
  148    HA   PHE   1           HA       PHE   1  -8.460   2.903 -12.237
  149    HD1  PHE   1           HD1      PHE   1  -9.214   4.674 -13.002
  150    HD2  PHE   1           HD2      PHE   1 -11.077   4.680  -9.127
  151    HE1  PHE   1           HE1      PHE   1  -9.003   7.144 -12.904
  152    HE2  PHE   1           HE2      PHE   1 -10.865   7.151  -9.032
  153    HZ   PHE   1           HZ       PHE   1  -9.828   8.381 -10.919
  154    H1   PHE   1           1H       PHE   1 -10.904   3.369 -13.413
  155    H2   PHE   1           2H       PHE   1 -10.423   1.848 -13.995
  156    H3   PHE   1           3H       PHE   1  -9.412   3.199 -14.202
  157    HB2  PHE   1           2HB      PHE   1 -11.327   2.743 -11.290
  158    HB3  PHE   1           1HB      PHE   1  -9.963   2.585 -10.184
  159    H    VAL   2           H        VAL   2  -8.766   1.111 -10.183
  160    HA   VAL   2           HA       VAL   2  -9.539  -1.514 -11.242
  161    HB   VAL   2           HB       VAL   2  -6.701  -1.437 -10.353
  162   HG11  VAL   2          1HG1      VAL   2  -7.976  -2.812 -12.724
  163   HG12  VAL   2          2HG1      VAL   2  -8.066  -3.471 -11.091
  164   HG13  VAL   2          3HG1      VAL   2  -6.499  -3.263 -11.873
  165   HG21  VAL   2          3HG2      VAL   2  -6.899   0.529 -11.899
  166   HG22  VAL   2          1HG2      VAL   2  -7.517  -0.559 -13.142
  167   HG23  VAL   2          2HG2      VAL   2  -5.870  -0.753 -12.540
  168    H    ASN   3           H        ASN   3 -10.050  -2.879  -9.550
  169    HA   ASN   3           HA       ASN   3 -10.361  -1.933  -6.922
  170    HB2  ASN   3           2HB      ASN   3  -9.903  -4.782  -7.863
  171    HB3  ASN   3           1HB      ASN   3 -10.492  -4.340  -6.261
  172   HD21  ASN   3          1HD2      ASN   3 -12.720  -3.881  -6.048
  173   HD22  ASN   3          2HD2      ASN   3 -13.802  -3.815  -7.352
  174    H    GLN   4           H        GLN   4  -8.742  -1.192  -5.620
  175    HA   GLN   4           HA       GLN   4  -6.017  -2.206  -5.974
  176    HB2  GLN   4           2HB      GLN   4  -6.485   0.213  -5.658
  177    HB3  GLN   4           1HB      GLN   4  -7.105  -0.140  -4.051
  178    HG2  GLN   4           2HG      GLN   4  -4.559   0.591  -4.463
  179    HG3  GLN   4           1HG      GLN   4  -5.026  -0.497  -3.163
  180   HE21  GLN   4          1HE2      GLN   4  -3.008  -0.208  -5.937
  181   HE22  GLN   4          2HE2      GLN   4  -2.547  -1.838  -6.052
  182    H    HIS   5           H        HIS   5  -6.418  -4.411  -5.181
  183    HA   HIS   5           HA       HIS   5  -7.031  -4.665  -2.295
  184    HD2  HIS   5           HD2      HIS   5  -8.893  -5.289  -1.570
  185    HE1  HIS   5           HE1      HIS   5 -11.348  -7.583  -4.137
  186    HE2  HIS   5           HE2      HIS   5 -11.322  -6.068  -2.085
  187    HB2  HIS   5           2HB      HIS   5  -6.714  -6.577  -4.584
  188    HB3  HIS   5           1HB      HIS   5  -6.441  -7.173  -2.949
  189    H    LEU   6           H        LEU   6  -5.409  -5.017  -0.766
  190    HA   LEU   6           HA       LEU   6  -2.646  -5.421  -1.805
  191    HG   LEU   6           HG       LEU   6  -2.694  -2.319  -2.146
  192    HB2  LEU   6           2HB      LEU   6  -3.765  -3.164  -0.281
  193    HB3  LEU   6           1HB      LEU   6  -2.300  -3.829   0.404
  194   HD11  LEU   6          1HD1      LEU   6  -1.395  -1.889   0.214
  195   HD12  LEU   6          2HD1      LEU   6  -0.996  -1.080  -1.300
  196   HD13  LEU   6          3HD1      LEU   6  -0.080  -2.497  -0.790
  197   HD21  LEU   6          3HD2      LEU   6  -0.932  -4.750  -1.866
  198   HD22  LEU   6          1HD2      LEU   6  -0.356  -3.377  -2.804
  199   HD23  LEU   6          2HD2      LEU   6  -1.844  -4.197  -3.270
  200    H    CYS   7           H        CYS   7  -1.461  -6.872  -0.738
  201    HA   CYS   7           HA       CYS   7  -1.994  -7.470   2.085
  202    HB2  CYS   7           2HB      CYS   7  -2.290  -9.695   0.026
  203    HB3  CYS   7           1HB      CYS   7  -2.496  -9.836   1.768
  204    H    GLY   8           H        GLY   8   0.043  -7.689   2.906
  205    HA2  GLY   8           2HA      GLY   8   2.406  -7.934   2.883
  206    HA3  GLY   8           1HA      GLY   8   1.936  -9.572   2.452
  207    H    SER   9           H        SER   9   2.849 -10.332   0.636
  208    HA   SER   9           HA       SER   9   4.700  -9.117  -0.971
  209    HG   SER   9           HG       SER   9   5.266 -10.773  -2.807
  210    HB2  SER   9           2HB      SER   9   3.076 -11.453  -1.172
  211    HB3  SER   9           1HB      SER   9   3.067 -10.660  -2.744
  212    H    ASP  10           H        ASP  10   1.194  -9.142  -1.710
  213    HA   ASP  10           HA       ASP  10   1.491  -7.340  -3.953
  214    HB2  ASP  10           2HB      ASP  10  -0.883  -8.184  -2.271
  215    HB3  ASP  10           1HB      ASP  10  -1.022  -7.086  -3.640
  216    H    LEU  11           H        LEU  11   1.042  -6.993  -0.514
  217    HA   LEU  11           HA       LEU  11   0.170  -4.305  -0.363
  218    HG   LEU  11           HG       LEU  11   2.088  -3.605   2.349
  219    HB2  LEU  11           2HB      LEU  11   0.323  -5.887   1.564
  220    HB3  LEU  11           1HB      LEU  11   2.076  -5.757   1.501
  221   HD11  LEU  11          1HD1      LEU  11  -0.607  -3.385   1.049
  222   HD12  LEU  11          2HD1      LEU  11   0.814  -2.360   0.835
  223   HD13  LEU  11          3HD1      LEU  11  -0.144  -2.247   2.312
  224   HD21  LEU  11          3HD2      LEU  11  -0.596  -4.452   3.423
  225   HD22  LEU  11          1HD2      LEU  11   0.693  -3.585   4.255
  226   HD23  LEU  11          2HD2      LEU  11   0.885  -5.297   3.874
  227    H    VAL  12           H        VAL  12   3.467  -5.646  -0.618
  228    HA   VAL  12           HA       VAL  12   4.689  -3.001  -0.573
  229    HB   VAL  12           HB       VAL  12   6.732  -4.310  -1.371
  230   HG11  VAL  12          1HG1      VAL  12   5.620  -4.027   1.121
  231   HG12  VAL  12          2HG1      VAL  12   7.197  -4.753   0.814
  232   HG13  VAL  12          3HG1      VAL  12   5.777  -5.780   1.005
  233   HG21  VAL  12          3HG2      VAL  12   6.602  -6.678  -1.503
  234   HG22  VAL  12          1HG2      VAL  12   5.201  -6.101  -2.404
  235   HG23  VAL  12          2HG2      VAL  12   5.002  -6.710  -0.761
  236    H    GLU  13           H        GLU  13   3.498  -5.199  -3.039
  237    HA   GLU  13           HA       GLU  13   4.785  -4.066  -5.306
  238    HB2  GLU  13           2HB      GLU  13   3.328  -6.162  -5.230
  239    HB3  GLU  13           1HB      GLU  13   1.935  -5.079  -5.281
  240    HG2  GLU  13           2HG      GLU  13   3.437  -4.059  -7.313
  241    HG3  GLU  13           1HG      GLU  13   3.866  -5.767  -7.413
  242    H    ALA  14           H        ALA  14   1.545  -3.310  -3.966
  243    HA   ALA  14           HA       ALA  14   0.978  -1.107  -5.651
  244    HB1  ALA  14           3HB      ALA  14  -0.492  -0.325  -3.778
  245    HB2  ALA  14           1HB      ALA  14   0.210  -1.583  -2.761
  246    HB3  ALA  14           2HB      ALA  14  -0.731  -2.024  -4.185
  247    H    LEU  15           H        LEU  15   2.457  -1.119  -2.407
  248    HA   LEU  15           HA       LEU  15   3.050   1.667  -2.332
  249    HG   LEU  15           HG       LEU  15   2.294  -0.798  -0.288
  250    HB2  LEU  15           2HB      LEU  15   4.552  -0.613  -1.013
  251    HB3  LEU  15           1HB      LEU  15   4.642   1.085  -0.553
  252   HD11  LEU  15          1HD1      LEU  15   3.323   1.131   1.766
  253   HD12  LEU  15          2HD1      LEU  15   4.209  -0.364   1.468
  254   HD13  LEU  15          3HD1      LEU  15   2.528  -0.426   1.999
  255   HD21  LEU  15          3HD2      LEU  15   1.028   0.991  -0.934
  256   HD22  LEU  15          1HD2      LEU  15   2.335   2.144  -0.663
  257   HD23  LEU  15          2HD2      LEU  15   1.372   1.566   0.697
  258    H    TYR  16           H        TYR  16   4.746  -1.089  -3.726
  259    HA   TYR  16           HA       TYR  16   7.289   0.107  -4.108
  260    HD1  TYR  16           HD2      TYR  16   9.319  -0.791  -5.330
  261    HD2  TYR  16           HD1      TYR  16   6.737  -3.744  -3.575
  262    HE1  TYR  16           HE2      TYR  16  11.256  -1.771  -4.130
  263    HE2  TYR  16           HE1      TYR  16   8.674  -4.724  -2.373
  264    HH   TYR  16           HH       TYR  16  11.965  -3.629  -2.994
  265    HB2  TYR  16           2HB      TYR  16   5.854  -2.229  -5.115
  266    HB3  TYR  16           1HB      TYR  16   6.950  -1.540  -6.314
  267    H    LEU  17           H        LEU  17   4.754  -0.255  -6.632
  268    HA   LEU  17           HA       LEU  17   6.003   1.412  -8.524
  269    HG   LEU  17           HG       LEU  17   3.130   0.499  -6.772
  270    HB2  LEU  17           2HB      LEU  17   3.586   1.875  -9.322
  271    HB3  LEU  17           1HB      LEU  17   4.162   0.210  -9.341
  272   HD11  LEU  17          1HD1      LEU  17   1.086   1.654  -8.659
  273   HD12  LEU  17          2HD1      LEU  17   2.159   2.696  -7.724
  274   HD13  LEU  17          3HD1      LEU  17   1.051   1.602  -6.896
  275   HD21  LEU  17          3HD2      LEU  17   2.912  -1.422  -8.371
  276   HD22  LEU  17          1HD2      LEU  17   1.674  -0.510  -9.236
  277   HD23  LEU  17          2HD2      LEU  17   1.394  -1.016  -7.570
  278    H    VAL  18           H        VAL  18   3.999   2.337  -5.751
  279    HA   VAL  18           HA       VAL  18   3.905   5.139  -6.587
  280    HB   VAL  18           HB       VAL  18   2.926   5.533  -4.348
  281   HG11  VAL  18          1HG1      VAL  18   1.587   3.037  -5.250
  282   HG12  VAL  18          2HG1      VAL  18   1.739   4.340  -6.431
  283   HG13  VAL  18          3HG1      VAL  18   0.896   4.623  -4.907
  284   HG21  VAL  18          3HG2      VAL  18   2.496   3.542  -2.910
  285   HG22  VAL  18          1HG2      VAL  18   4.210   3.923  -3.055
  286   HG23  VAL  18          2HG2      VAL  18   3.518   2.594  -3.983
  287    H    CYS  19           H        CYS  19   5.596   3.289  -4.119
  288    HA   CYS  19           HA       CYS  19   7.087   5.538  -3.100
  289    HB2  CYS  19           2HB      CYS  19   7.180   2.569  -2.770
  290    HB3  CYS  19           1HB      CYS  19   8.625   3.478  -2.345
  291    H    GLY  20           H        GLY  20   8.227   2.678  -4.889
  292    HA2  GLY  20           2HA      GLY  20   9.763   2.639  -6.722
  293    HA3  GLY  20           1HA      GLY  20   9.993   4.382  -6.533
  294    H    GLU  21           H        GLU  21  12.358   3.708  -6.669
  295    HA   GLU  21           HA       GLU  21  13.502   2.223  -4.461
  296    HB2  GLU  21           2HB      GLU  21  14.434   2.822  -6.906
  297    HB3  GLU  21           1HB      GLU  21  15.181   4.142  -6.007
  298    HG2  GLU  21           2HG      GLU  21  16.094   2.470  -4.391
  299    HG3  GLU  21           1HG      GLU  21  15.439   1.182  -5.403
  300    H    ARG  22           H        ARG  22  11.898   4.093  -3.289
  301    HA   ARG  22           HA       ARG  22  13.860   5.996  -2.098
  302    HE   ARG  22           HE       ARG  22   9.531   8.091  -3.507
  303    HB2  ARG  22           2HB      ARG  22  10.902   6.378  -2.646
  304    HB3  ARG  22           1HB      ARG  22  11.841   7.445  -1.604
  305    HG2  ARG  22           2HG      ARG  22  12.681   8.538  -3.382
  306    HG3  ARG  22           1HG      ARG  22  13.227   7.025  -4.108
  307    HD2  ARG  22           2HD      ARG  22  11.637   8.079  -5.618
  308    HD3  ARG  22           1HD      ARG  22  10.889   6.638  -4.928
  309   HH11  ARG  22          1HH2      ARG  22  11.566  10.392  -3.539
  310   HH12  ARG  22          2HH2      ARG  22  10.708  11.568  -4.477
  311   HH21  ARG  22          1HH1      ARG  22   8.399   9.292  -5.707
  312   HH22  ARG  22          2HH1      ARG  22   8.914  10.946  -5.703
  313    H    GLY  23           H        GLY  23  11.788   3.339  -1.648
  314    HA2  GLY  23           2HA      GLY  23  11.810   2.099   0.439
  315    HA3  GLY  23           1HA      GLY  23  12.144   3.600   1.296
  316    H    PHE  24           H        PHE  24   9.911   1.398   1.285
  317    HA   PHE  24           HA       PHE  24   7.596   3.297   1.277
  318    HD1  PHE  24           HD1      PHE  24   7.480  -0.926   2.275
  319    HD2  PHE  24           HD2      PHE  24   8.924   0.789  -1.391
  320    HE1  PHE  24           HE1      PHE  24   8.940  -2.900   1.927
  321    HE2  PHE  24           HE2      PHE  24  10.384  -1.185  -1.740
  322    HZ   PHE  24           HZ       PHE  24  10.392  -3.030  -0.081
  323    HB2  PHE  24           2HB      PHE  24   6.327   0.964   1.203
  324    HB3  PHE  24           1HB      PHE  24   6.952   1.681  -0.278
  325    H    PHE  25           H        PHE  25   5.777   2.023   2.786
  326    HA   PHE  25           HA       PHE  25   7.144   1.799   5.426
  327    HD1  PHE  25           HD2      PHE  25   6.282   2.322   7.803
  328    HD2  PHE  25           HD1      PHE  25   5.276   5.248   4.818
  329    HE1  PHE  25           HE2      PHE  25   7.254   4.106   9.223
  330    HE2  PHE  25           HE1      PHE  25   6.248   7.030   6.240
  331    HZ   PHE  25           HZ       PHE  25   7.236   6.461   8.443
  332    HB2  PHE  25           2HB      PHE  25   4.637   3.019   4.498
  333    HB3  PHE  25           1HB      PHE  25   4.416   2.004   5.921
  334    H    TYR  26           H        TYR  26   3.991   0.537   4.279
  335    HA   TYR  26           HA       TYR  26   3.070  -1.611   4.542
  336    HD1  TYR  26           HD1      TYR  26   2.623  -3.705   4.651
  337    HD2  TYR  26           HD2      TYR  26   6.791  -4.483   3.925
  338    HE1  TYR  26           HE1      TYR  26   2.279  -6.091   5.222
  339    HE2  TYR  26           HE2      TYR  26   6.442  -6.867   4.499
  340    HH   TYR  26           HH       TYR  26   4.816  -8.214   5.852
  341    HB2  TYR  26           2HB      TYR  26   4.660  -2.309   2.879
  342    HB3  TYR  26           1HB      TYR  26   5.989  -2.230   4.023
  343    H    THR  27           H        THR  27   3.344  -0.283   6.905
  344    HA   THR  27           HA       THR  27   4.891  -1.878   8.822
  345    HB   THR  27           HB       THR  27   4.474  -0.180  10.308
  346    HG1  THR  27           HG1      THR  27   1.897  -0.027   9.140
  347   HG21  THR  27          3HG2      THR  27   4.721   1.805   9.198
  348   HG22  THR  27          1HG2      THR  27   3.315   1.523   8.172
  349   HG23  THR  27          2HG2      THR  27   4.853   0.749   7.791
  350    H    LYS  28           H        LYS  28   3.556  -2.527  10.907
  351    HA   LYS  28           HA       LYS  28   1.067  -3.920  10.000
  352    HB2  LYS  28           2HB      LYS  28   3.358  -4.907  11.699
  353    HB3  LYS  28           1HB      LYS  28   1.761  -5.649  11.798
  354    HG2  LYS  28           2HG      LYS  28   2.882  -5.225   9.071
  355    HG3  LYS  28           1HG      LYS  28   3.619  -6.494  10.050
  356    HD2  LYS  28           2HD      LYS  28   0.832  -6.764  10.408
  357    HD3  LYS  28           1HD      LYS  28   1.078  -6.517   8.679
  358    HE2  LYS  28           2HE      LYS  28   2.354  -8.630  10.432
  359    HE3  LYS  28           1HE      LYS  28   1.251  -8.883   9.080
  360    HZ1  LYS  28           3HZ      LYS  28   3.057  -9.053   7.824
  361    HZ2  LYS  28           1HZ      LYS  28   4.077  -8.494   9.059
  362    HZ3  LYS  28           2HZ      LYS  28   3.289  -7.384   8.042
  363    HA   PRO  29           HA       PRO  29  -0.838  -1.973  13.426
  364    HB2  PRO  29           2HB      PRO  29  -2.948  -3.702  13.777
  365    HB3  PRO  29           1HB      PRO  29  -2.854  -2.514  12.464
  366    HG2  PRO  29           2HG      PRO  29  -2.459  -5.467  12.355
  367    HG3  PRO  29           1HG      PRO  29  -2.991  -4.358  11.080
  368    HD2  PRO  29           2HD      PRO  29  -0.392  -5.439  11.351
  369    HD3  PRO  29           1HD      PRO  29  -0.853  -4.084  10.303
  370    H    THR  30           H        THR  30  -0.723  -5.544  13.781
  371    HA   THR  30           HA       THR  30  -0.923  -5.701  16.573
  372    HB   THR  30           HB       THR  30   1.062  -7.582  15.733
  373    HG1  THR  30           HG1      THR  30  -1.149  -7.436  13.978
  374   HG21  THR  30          3HG2      THR  30  -0.382  -8.631  17.119
  375   HG22  THR  30          1HG2      THR  30  -1.396  -8.860  15.694
  376   HG23  THR  30          2HG2      THR  30  -1.674  -7.485  16.763
  Start of MODEL    3
    1    H1   GLY   1           1H       GLY   1  -4.457  -0.613  11.646
    2    H2   GLY   1           2H       GLY   1  -3.184  -0.320  12.731
    3    H3   GLY   1           3H       GLY   1  -3.297  -1.818  11.938
    4    HA2  GLY   1           1HA      GLY   1  -2.692   0.716  10.610
    5    HA3  GLY   1           2HA      GLY   1  -1.501  -0.589  10.898
    6    H    ILE   2           H        ILE   2  -1.341  -0.144   8.502
    7    HA   ILE   2           HA       ILE   2  -3.611   0.503   6.825
    8    HB   ILE   2           HB       ILE   2  -1.207   1.093   6.313
    9   HG12  ILE   2          2HG1      ILE   2  -2.915  -0.416   4.323
   10   HG13  ILE   2          1HG1      ILE   2  -2.801   1.329   4.543
   11   HG21  ILE   2          1HG2      ILE   2  -1.053  -1.805   5.444
   12   HG22  ILE   2          2HG2      ILE   2  -0.322  -1.184   6.923
   13   HG23  ILE   2          3HG2      ILE   2   0.231  -0.600   5.353
   14   HD11  ILE   2          3HD1      ILE   2  -0.513  -0.436   3.624
   15   HD12  ILE   2          1HD1      ILE   2  -0.503   1.324   3.731
   16   HD13  ILE   2          2HD1      ILE   2  -1.532   0.518   2.546
   17    H    THR   3           H        THR   3  -1.759  -2.483   7.437
   18    HA   THR   3           HA       THR   3  -2.919  -4.183   5.562
   19    HB   THR   3           HB       THR   3  -2.197  -4.741   8.449
   20    HG1  THR   3           HG1      THR   3  -0.325  -4.553   7.520
   21   HG21  THR   3          3HG2      THR   3  -2.040  -7.151   7.236
   22   HG22  THR   3          1HG2      THR   3  -3.397  -6.459   6.348
   23   HG23  THR   3          2HG2      THR   3  -3.476  -6.605   8.104
   24    H    GLU   4           H        GLU   4  -4.246  -3.145   8.661
   25    HA   GLU   4           HA       GLU   4  -6.720  -4.675   8.244
   26    HB2  GLU   4           2HB      GLU   4  -5.402  -3.473  10.471
   27    HB3  GLU   4           1HB      GLU   4  -6.998  -2.734  10.329
   28    HG2  GLU   4           2HG      GLU   4  -7.485  -4.620  11.608
   29    HG3  GLU   4           1HG      GLU   4  -7.795  -5.220   9.978
   30    H    GLN   5           H        GLN   5  -6.343  -2.953   6.114
   31    HA   GLN   5           HA       GLN   5  -8.798  -1.480   6.089
   32    HB2  GLN   5           2HB      GLN   5  -7.311   0.017   7.552
   33    HB3  GLN   5           1HB      GLN   5  -6.364   0.319   6.093
   34    HG2  GLN   5           2HG      GLN   5  -8.509   1.008   4.949
   35    HG3  GLN   5           1HG      GLN   5  -9.300   0.919   6.524
   36   HE21  GLN   5          1HE2      GLN   5  -7.253   2.880   4.502
   37   HE22  GLN   5          2HE2      GLN   5  -6.998   4.130   5.622
   38    H    CYS   6           H        CYS   6  -5.557  -1.918   4.783
   39    HA   CYS   6           HA       CYS   6  -6.548  -1.249   2.071
   40    HB2  CYS   6           2HB      CYS   6  -3.821  -1.639   3.277
   41    HB3  CYS   6           1HB      CYS   6  -4.038  -1.706   1.537
   42    H    CYS   7           H        CYS   7  -6.244  -3.891   4.087
   43    HA   CYS   7           HA       CYS   7  -6.056  -5.728   1.741
   44    HB2  CYS   7           2HB      CYS   7  -4.204  -6.027   3.318
   45    HB3  CYS   7           1HB      CYS   7  -5.343  -6.237   4.642
   46    H    THR   8           H        THR   8  -7.769  -4.952   4.738
   47    HA   THR   8           HA       THR   8  -9.610  -7.131   4.724
   48    HB   THR   8           HB       THR   8 -10.306  -4.299   5.540
   49    HG1  THR   8           HG1      THR   8  -9.222  -6.062   7.381
   50   HG21  THR   8          3HG2      THR   8 -11.179  -6.209   7.406
   51   HG22  THR   8          1HG2      THR   8 -11.505  -6.920   5.825
   52   HG23  THR   8          2HG2      THR   8 -12.173  -5.340   6.236
   53    H    SER   9           H        SER   9  -9.196  -4.463   2.628
   54    HA   SER   9           HA       SER   9 -11.422  -5.342   0.941
   55    HG   SER   9           HG       SER   9 -13.023  -4.723   2.563
   56    HB2  SER   9           2HB      SER   9 -11.354  -2.506   2.025
   57    HB3  SER   9           1HB      SER   9 -12.515  -3.147   0.866
   58    H    ILE  10           H        ILE  10 -11.157  -2.457  -0.264
   59    HA   ILE  10           HA       ILE  10  -8.517  -2.975  -1.571
   60    HB   ILE  10           HB       ILE  10 -11.061  -1.793  -2.714
   61   HG12  ILE  10          2HG1      ILE  10  -9.557  -4.007  -4.004
   62   HG13  ILE  10          1HG1      ILE  10 -10.341  -4.401  -2.473
   63   HG21  ILE  10          1HG2      ILE  10  -8.322  -1.253  -3.384
   64   HG22  ILE  10          2HG2      ILE  10  -9.779  -0.670  -4.189
   65   HG23  ILE  10          3HG2      ILE  10  -9.045  -2.194  -4.689
   66   HD11  ILE  10          3HD1      ILE  10 -12.105  -2.826  -4.137
   67   HD12  ILE  10          1HD1      ILE  10 -12.366  -4.426  -3.445
   68   HD13  ILE  10          2HD1      ILE  10 -11.556  -4.260  -5.002
   69    H    CYS  11           H        CYS  11  -7.122  -1.182  -1.814
   70    HA   CYS  11           HA       CYS  11  -7.978   1.251  -0.306
   71    HB2  CYS  11           2HB      CYS  11  -5.535  -0.327  -0.343
   72    HB3  CYS  11           1HB      CYS  11  -5.207   1.374  -0.677
   73    H    SER  12           H        SER  12  -7.090   3.338  -1.127
   74    HA   SER  12           HA       SER  12  -7.228   3.399  -4.094
   75    HG   SER  12           HG       SER  12  -7.947   6.340  -1.433
   76    HB2  SER  12           2HB      SER  12  -7.473   5.862  -3.756
   77    HB3  SER  12           1HB      SER  12  -8.718   4.933  -2.926
   78    H    LEU  13           H        LEU  13  -5.363   3.434  -5.197
   79    HA   LEU  13           HA       LEU  13  -2.780   3.468  -4.273
   80    HG   LEU  13           HG       LEU  13  -5.065   5.080  -6.329
   81    HB2  LEU  13           2HB      LEU  13  -2.185   4.670  -6.462
   82    HB3  LEU  13           1HB      LEU  13  -3.061   3.154  -6.581
   83   HD11  LEU  13          1HD1      LEU  13  -4.409   6.498  -8.404
   84   HD12  LEU  13          2HD1      LEU  13  -2.753   6.036  -8.013
   85   HD13  LEU  13          3HD1      LEU  13  -3.714   6.946  -6.846
   86   HD21  LEU  13          3HD2      LEU  13  -3.913   3.682  -8.756
   87   HD22  LEU  13          1HD2      LEU  13  -5.489   4.472  -8.713
   88   HD23  LEU  13          2HD2      LEU  13  -5.179   3.067  -7.693
   89    H    TYR  14           H        TYR  14  -4.827   6.243  -4.911
   90    HA   TYR  14           HA       TYR  14  -3.074   8.380  -4.541
   91    HD1  TYR  14           HD1      TYR  14  -3.763  10.506  -5.408
   92    HD2  TYR  14           HD2      TYR  14  -5.946   9.977  -1.746
   93    HE1  TYR  14           HE1      TYR  14  -3.364  12.886  -4.827
   94    HE2  TYR  14           HE2      TYR  14  -5.548  12.356  -1.163
   95    HH   TYR  14           HH       TYR  14  -5.047  14.563  -2.698
   96    HB2  TYR  14           2HB      TYR  14  -5.550   8.580  -4.958
   97    HB3  TYR  14           1HB      TYR  14  -5.812   8.210  -3.255
   98    H    GLN  15           H        GLN  15  -5.072   7.265  -1.840
   99    HA   GLN  15           HA       GLN  15  -3.389   8.278   0.207
  100    HB2  GLN  15           2HB      GLN  15  -5.610   6.341   0.014
  101    HB3  GLN  15           1HB      GLN  15  -4.531   6.088   1.384
  102    HG2  GLN  15           2HG      GLN  15  -5.787   7.667   2.418
  103    HG3  GLN  15           1HG      GLN  15  -4.880   8.815   1.434
  104   HE21  GLN  15          1HE2      GLN  15  -7.853   6.781   1.303
  105   HE22  GLN  15          2HE2      GLN  15  -8.722   7.856   0.317
  106    H    LEU  16           H        LEU  16  -3.544   5.147  -1.365
  107    HA   LEU  16           HA       LEU  16  -1.716   3.607   0.036
  108    HG   LEU  16           HG       LEU  16  -0.413   1.955  -1.428
  109    HB2  LEU  16           2HB      LEU  16  -3.027   3.237  -2.246
  110    HB3  LEU  16           1HB      LEU  16  -1.481   3.710  -2.950
  111   HD11  LEU  16          1HD1      LEU  16  -3.132   1.812  -0.544
  112   HD12  LEU  16          2HD1      LEU  16  -1.746   0.894   0.044
  113   HD13  LEU  16          3HD1      LEU  16  -2.715   0.271  -1.291
  114   HD21  LEU  16          3HD2      LEU  16  -1.908   1.693  -3.903
  115   HD22  LEU  16          1HD2      LEU  16  -1.886   0.169  -3.016
  116   HD23  LEU  16          2HD2      LEU  16  -0.370   0.958  -3.451
  117    H    GLU  17           H        GLU  17  -1.056   6.239  -2.220
  118    HA   GLU  17           HA       GLU  17   1.810   5.838  -2.244
  119    HB2  GLU  17           2HB      GLU  17   0.974   6.979  -4.119
  120    HB3  GLU  17           1HB      GLU  17  -0.057   8.022  -3.141
  121    HG2  GLU  17           2HG      GLU  17   2.832   8.238  -2.558
  122    HG3  GLU  17           1HG      GLU  17   2.358   8.783  -4.168
  123    H    ASN  18           H        ASN  18  -0.412   7.492  -0.147
  124    HA   ASN  18           HA       ASN  18   1.474   9.323   1.046
  125    HB2  ASN  18           2HB      ASN  18  -0.948   9.670   1.246
  126    HB3  ASN  18           1HB      ASN  18  -1.100   8.169   2.161
  127   HD21  ASN  18          1HD2      ASN  18  -1.644   8.974   4.236
  128   HD22  ASN  18          2HD2      ASN  18  -0.672  10.056   5.112
  129    H    TYR  19           H        TYR  19   1.411   5.986   1.151
  130    HA   TYR  19           HA       TYR  19   2.404   5.884   3.951
  131    HD1  TYR  19           HD2      TYR  19   0.781   4.610   5.495
  132    HD2  TYR  19           HD1      TYR  19  -0.475   4.007   1.430
  133    HE1  TYR  19           HE2      TYR  19  -1.581   4.930   6.174
  134    HE2  TYR  19           HE1      TYR  19  -2.836   4.327   2.108
  135    HH   TYR  19           HH       TYR  19  -4.236   4.526   3.847
  136    HB2  TYR  19           2HB      TYR  19   1.771   3.635   2.015
  137    HB3  TYR  19           1HB      TYR  19   2.235   3.437   3.702
  138    H    CYS  20           H        CYS  20   3.962   7.055   1.669
  139    HA   CYS  20           HA       CYS  20   6.208   5.090   1.560
  140    HB2  CYS  20           2HB      CYS  20   5.183   6.324  -0.527
  141    HB3  CYS  20           1HB      CYS  20   6.216   7.641  -0.018
  142    H    ASN  21           H        ASN  21   8.377   6.549   1.307
  143    HA   ASN  21           HA       ASN  21   9.040   7.456   3.888
  144    HB2  ASN  21           2HB      ASN  21  10.852   6.922   2.453
  145    HB3  ASN  21           1HB      ASN  21  10.257   7.976   1.171
  146   HD21  ASN  21          1HD2      ASN  21  11.209  10.020   1.081
  147   HD22  ASN  21          2HD2      ASN  21  12.056  10.755   2.355
  148    HA   PHE   1           HA       PHE   1  -9.011   2.972 -13.282
  149    HD1  PHE   1           HD1      PHE   1  -9.743   6.308 -12.628
  150    HD2  PHE   1           HD2      PHE   1  -6.921   3.546 -10.932
  151    HE1  PHE   1           HE1      PHE   1  -7.892   7.871 -13.164
  152    HE2  PHE   1           HE2      PHE   1  -5.069   5.109 -11.468
  153    HZ   PHE   1           HZ       PHE   1  -5.555   7.271 -12.584
  154    H1   PHE   1           1H       PHE   1 -10.679   4.177 -14.159
  155    H2   PHE   1           2H       PHE   1 -11.612   4.149 -12.740
  156    H3   PHE   1           3H       PHE   1 -11.607   2.808 -13.782
  157    HB2  PHE   1           2HB      PHE   1 -10.461   4.439 -11.155
  158    HB3  PHE   1           1HB      PHE   1  -9.289   3.247 -10.589
  159    H    VAL   2           H        VAL   2  -8.510   1.398 -11.194
  160    HA   VAL   2           HA       VAL   2 -10.678  -0.655 -11.118
  161    HB   VAL   2           HB       VAL   2  -7.832  -1.567 -11.235
  162   HG11  VAL   2          1HG1      VAL   2  -9.144  -3.429 -11.068
  163   HG12  VAL   2          2HG1      VAL   2  -9.325  -3.209 -12.809
  164   HG13  VAL   2          3HG1      VAL   2 -10.567  -2.607 -11.710
  165   HG21  VAL   2          3HG2      VAL   2  -9.301  -0.200 -13.429
  166   HG22  VAL   2          1HG2      VAL   2  -8.499  -1.712 -13.857
  167   HG23  VAL   2          2HG2      VAL   2  -7.564  -0.379 -13.179
  168    H    ASN   3           H        ASN   3 -10.917  -1.638  -9.113
  169    HA   ASN   3           HA       ASN   3  -9.533  -0.414  -6.860
  170    HB2  ASN   3           2HB      ASN   3 -11.533  -2.680  -7.072
  171    HB3  ASN   3           1HB      ASN   3 -10.860  -2.135  -5.536
  172   HD21  ASN   3          1HD2      ASN   3 -12.854  -1.233  -4.724
  173   HD22  ASN   3          2HD2      ASN   3 -13.578   0.134  -5.420
  174    H    GLN   4           H        GLN   4  -7.565  -1.092  -6.135
  175    HA   GLN   4           HA       GLN   4  -6.655  -3.808  -6.922
  176    HB2  GLN   4           2HB      GLN   4  -5.406  -1.361  -7.123
  177    HB3  GLN   4           1HB      GLN   4  -4.750  -1.957  -5.604
  178    HG2  GLN   4           2HG      GLN   4  -4.381  -3.014  -8.378
  179    HG3  GLN   4           1HG      GLN   4  -3.208  -2.852  -7.075
  180   HE21  GLN   4          1HE2      GLN   4  -4.868  -5.172  -8.797
  181   HE22  GLN   4          2HE2      GLN   4  -4.889  -6.416  -7.641
  182    H    HIS   5           H        HIS   5  -6.328  -5.366  -5.385
  183    HA   HIS   5           HA       HIS   5  -7.029  -4.738  -2.594
  184    HD2  HIS   5           HD2      HIS   5  -9.293  -6.183  -1.618
  185    HE1  HIS   5           HE1      HIS   5 -10.901  -7.354  -5.349
  186    HE2  HIS   5           HE2      HIS   5 -11.469  -6.562  -2.992
  187    HB2  HIS   5           2HB      HIS   5  -6.347  -7.302  -4.052
  188    HB3  HIS   5           1HB      HIS   5  -6.608  -7.247  -2.309
  189    H    LEU   6           H        LEU   6  -5.539  -4.885  -0.849
  190    HA   LEU   6           HA       LEU   6  -2.698  -5.302  -1.624
  191    HG   LEU   6           HG       LEU   6  -2.816  -2.264  -2.399
  192    HB2  LEU   6           2HB      LEU   6  -3.987  -2.896  -0.515
  193    HB3  LEU   6           1HB      LEU   6  -2.552  -3.401   0.347
  194   HD11  LEU   6          1HD1      LEU   6  -0.275  -2.207  -0.908
  195   HD12  LEU   6          2HD1      LEU   6  -1.648  -1.513  -0.046
  196   HD13  LEU   6          3HD1      LEU   6  -1.192  -0.886  -1.630
  197   HD21  LEU   6          3HD2      LEU   6  -1.039  -4.602  -1.725
  198   HD22  LEU   6          1HD2      LEU   6  -0.422  -3.338  -2.781
  199   HD23  LEU   6          2HD2      LEU   6  -1.868  -4.236  -3.237
  200    H    CYS   7           H        CYS   7  -1.582  -6.579  -0.309
  201    HA   CYS   7           HA       CYS   7  -2.239  -6.777   2.539
  202    HB2  CYS   7           2HB      CYS   7  -2.457  -9.271   0.810
  203    HB3  CYS   7           1HB      CYS   7  -2.712  -9.171   2.548
  204    H    GLY   8           H        GLY   8  -0.207  -6.712   3.385
  205    HA2  GLY   8           2HA      GLY   8   2.156  -6.933   3.462
  206    HA3  GLY   8           1HA      GLY   8   1.710  -8.634   3.381
  207    H    SER   9           H        SER   9   2.538  -9.766   1.725
  208    HA   SER   9           HA       SER   9   4.449  -8.974  -0.058
  209    HG   SER   9           HG       SER   9   1.560 -11.622  -0.757
  210    HB2  SER   9           2HB      SER   9   3.996 -10.907  -1.330
  211    HB3  SER   9           1HB      SER   9   3.366 -11.307   0.265
  212    H    ASP  10           H        ASP  10   0.950  -8.944  -0.841
  213    HA   ASP  10           HA       ASP  10   1.410  -7.510  -3.328
  214    HB2  ASP  10           2HB      ASP  10  -1.076  -8.079  -1.692
  215    HB3  ASP  10           1HB      ASP  10  -1.105  -7.199  -3.217
  216    H    LEU  11           H        LEU  11   0.764  -6.703  -0.004
  217    HA   LEU  11           HA       LEU  11  -0.070  -4.005  -0.271
  218    HG   LEU  11           HG       LEU  11   1.775  -3.003   2.383
  219    HB2  LEU  11           2HB      LEU  11  -0.099  -5.283   1.852
  220    HB3  LEU  11           1HB      LEU  11   1.660  -5.273   1.877
  221   HD11  LEU  11          1HD1      LEU  11  -0.884  -2.870   1.007
  222   HD12  LEU  11          2HD1      LEU  11   0.564  -1.902   0.727
  223   HD13  LEU  11          3HD1      LEU  11  -0.437  -1.603   2.148
  224   HD21  LEU  11          3HD2      LEU  11   0.780  -4.134   4.268
  225   HD22  LEU  11          1HD2      LEU  11  -0.822  -4.033   3.539
  226   HD23  LEU  11          2HD2      LEU  11  -0.013  -2.568   4.096
  227    H    VAL  12           H        VAL  12   3.159  -5.461  -0.349
  228    HA   VAL  12           HA       VAL  12   4.486  -2.857  -0.448
  229    HB   VAL  12           HB       VAL  12   6.512  -4.265  -1.009
  230   HG11  VAL  12          1HG1      VAL  12   5.385  -3.749   1.372
  231   HG12  VAL  12          2HG1      VAL  12   6.837  -4.737   1.218
  232   HG13  VAL  12          3HG1      VAL  12   5.260  -5.508   1.392
  233   HG21  VAL  12          3HG2      VAL  12   4.714  -6.600  -0.370
  234   HG22  VAL  12          1HG2      VAL  12   6.345  -6.629  -1.038
  235   HG23  VAL  12          2HG2      VAL  12   4.995  -6.083  -2.032
  236    H    GLU  13           H        GLU  13   3.423  -5.320  -2.744
  237    HA   GLU  13           HA       GLU  13   4.774  -4.440  -5.059
  238    HB2  GLU  13           2HB      GLU  13   3.188  -6.457  -4.764
  239    HB3  GLU  13           1HB      GLU  13   1.883  -5.317  -5.091
  240    HG2  GLU  13           2HG      GLU  13   3.639  -4.720  -7.108
  241    HG3  GLU  13           1HG      GLU  13   3.885  -6.458  -6.931
  242    H    ALA  14           H        ALA  14   1.560  -3.411  -3.870
  243    HA   ALA  14           HA       ALA  14   1.196  -1.357  -5.828
  244    HB1  ALA  14           3HB      ALA  14  -0.624  -0.609  -4.461
  245    HB2  ALA  14           1HB      ALA  14   0.066  -1.358  -3.021
  246    HB3  ALA  14           2HB      ALA  14  -0.580  -2.362  -4.320
  247    H    LEU  15           H        LEU  15   2.379  -1.214  -2.466
  248    HA   LEU  15           HA       LEU  15   2.979   1.599  -2.506
  249    HG   LEU  15           HG       LEU  15   1.923  -0.557  -0.351
  250    HB2  LEU  15           2HB      LEU  15   4.273  -0.616  -0.882
  251    HB3  LEU  15           1HB      LEU  15   4.447   1.106  -0.570
  252   HD11  LEU  15          1HD1      LEU  15   2.184   0.787   1.957
  253   HD12  LEU  15          2HD1      LEU  15   3.882   0.731   1.483
  254   HD13  LEU  15          3HD1      LEU  15   2.971  -0.767   1.680
  255   HD21  LEU  15          3HD2      LEU  15   0.765   1.532   0.219
  256   HD22  LEU  15          1HD2      LEU  15   1.455   1.676  -1.398
  257   HD23  LEU  15          2HD2      LEU  15   2.250   2.453  -0.028
  258    H    TYR  16           H        TYR  16   4.522  -1.179  -3.845
  259    HA   TYR  16           HA       TYR  16   7.220  -0.233  -3.930
  260    HD1  TYR  16           HD2      TYR  16   9.072  -0.838  -4.723
  261    HD2  TYR  16           HD1      TYR  16   6.697  -4.369  -4.126
  262    HE1  TYR  16           HE2      TYR  16  10.997  -1.944  -3.615
  263    HE2  TYR  16           HE1      TYR  16   8.621  -5.475  -3.018
  264    HH   TYR  16           HH       TYR  16  10.660  -5.099  -2.067
  265    HB2  TYR  16           2HB      TYR  16   5.694  -2.441  -5.010
  266    HB3  TYR  16           1HB      TYR  16   6.781  -1.792  -6.238
  267    H    LEU  17           H        LEU  17   4.828  -0.319  -6.599
  268    HA   LEU  17           HA       LEU  17   6.335   1.313  -8.358
  269    HG   LEU  17           HG       LEU  17   3.262   0.591  -6.862
  270    HB2  LEU  17           2HB      LEU  17   4.056   1.831  -9.403
  271    HB3  LEU  17           1HB      LEU  17   4.506   0.130  -9.296
  272   HD11  LEU  17          1HD1      LEU  17   2.568   2.830  -7.997
  273   HD12  LEU  17          2HD1      LEU  17   1.326   1.880  -7.182
  274   HD13  LEU  17          3HD1      LEU  17   1.466   1.825  -8.938
  275   HD21  LEU  17          3HD2      LEU  17   2.580  -0.697  -9.451
  276   HD22  LEU  17          1HD2      LEU  17   1.237  -0.433  -8.339
  277   HD23  LEU  17          2HD2      LEU  17   2.630  -1.390  -7.830
  278    H    VAL  18           H        VAL  18   3.882   2.288  -5.922
  279    HA   VAL  18           HA       VAL  18   3.937   5.069  -6.632
  280    HB   VAL  18           HB       VAL  18   2.998   5.489  -4.401
  281   HG11  VAL  18          1HG1      VAL  18   1.315   4.819  -5.870
  282   HG12  VAL  18          2HG1      VAL  18   1.135   3.670  -4.544
  283   HG13  VAL  18          3HG1      VAL  18   1.968   3.188  -6.022
  284   HG21  VAL  18          3HG2      VAL  18   2.617   3.403  -2.960
  285   HG22  VAL  18          1HG2      VAL  18   4.255   4.056  -2.992
  286   HG23  VAL  18          2HG2      VAL  18   3.852   2.637  -3.956
  287    H    CYS  19           H        CYS  19   5.678   3.242  -4.172
  288    HA   CYS  19           HA       CYS  19   7.167   5.482  -3.176
  289    HB2  CYS  19           2HB      CYS  19   7.365   2.501  -2.958
  290    HB3  CYS  19           1HB      CYS  19   8.733   3.481  -2.437
  291    H    GLY  20           H        GLY  20   8.324   2.693  -5.068
  292    HA2  GLY  20           2HA      GLY  20   9.869   2.679  -6.875
  293    HA3  GLY  20           1HA      GLY  20   9.920   4.443  -6.801
  294    H    GLU  21           H        GLU  21  12.259   4.432  -6.850
  295    HA   GLU  21           HA       GLU  21  13.775   2.979  -4.843
  296    HB2  GLU  21           2HB      GLU  21  14.392   4.980  -6.975
  297    HB3  GLU  21           1HB      GLU  21  15.561   4.787  -5.667
  298    HG2  GLU  21           2HG      GLU  21  15.185   2.207  -6.162
  299    HG3  GLU  21           1HG      GLU  21  14.701   2.813  -7.747
  300    H    ARG  22           H        ARG  22  11.825   4.405  -3.474
  301    HA   ARG  22           HA       ARG  22  13.504   6.387  -2.021
  302    HE   ARG  22           HE       ARG  22   9.482   8.656  -1.096
  303    HB2  ARG  22           2HB      ARG  22  11.592   7.805  -1.666
  304    HB3  ARG  22           1HB      ARG  22  11.668   7.466  -3.395
  305    HG2  ARG  22           2HG      ARG  22  10.048   5.565  -2.999
  306    HG3  ARG  22           1HG      ARG  22   9.859   6.165  -1.349
  307    HD2  ARG  22           2HD      ARG  22   9.281   7.711  -3.894
  308    HD3  ARG  22           1HD      ARG  22   8.084   7.088  -2.757
  309   HH11  ARG  22          1HH2      ARG  22   7.676   9.174  -3.911
  310   HH12  ARG  22          2HH2      ARG  22   7.965  10.880  -3.978
  311   HH21  ARG  22          1HH1      ARG  22  10.247  10.867  -1.370
  312   HH22  ARG  22          2HH1      ARG  22   9.420  11.838  -2.543
  313    H    GLY  23           H        GLY  23  11.895   3.463  -1.932
  314    HA2  GLY  23           2HA      GLY  23  11.682   2.015  -0.069
  315    HA3  GLY  23           1HA      GLY  23  12.151   3.348   0.981
  316    H    PHE  24           H        PHE  24   9.864   1.326   1.006
  317    HA   PHE  24           HA       PHE  24   7.589   3.260   1.168
  318    HD1  PHE  24           HD1      PHE  24   7.514  -0.527   2.714
  319    HD2  PHE  24           HD2      PHE  24   8.472   0.071  -1.432
  320    HE1  PHE  24           HE1      PHE  24   8.752  -2.675   2.690
  321    HE2  PHE  24           HE2      PHE  24   9.710  -2.078  -1.455
  322    HZ   PHE  24           HZ       PHE  24   9.850  -3.452   0.605
  323    HB2  PHE  24           2HB      PHE  24   6.208   1.079   1.156
  324    HB3  PHE  24           1HB      PHE  24   6.981   1.536  -0.359
  325    H    PHE  25           H        PHE  25   5.896   2.301   2.887
  326    HA   PHE  25           HA       PHE  25   7.477   1.950   5.388
  327    HD1  PHE  25           HD2      PHE  25   6.001   1.082   7.433
  328    HD2  PHE  25           HD1      PHE  25   5.871   5.326   6.761
  329    HE1  PHE  25           HE2      PHE  25   6.556   1.477   9.817
  330    HE2  PHE  25           HE1      PHE  25   6.426   5.719   9.146
  331    HZ   PHE  25           HZ       PHE  25   6.768   3.795  10.674
  332    HB2  PHE  25           2HB      PHE  25   5.682   3.856   4.932
  333    HB3  PHE  25           1HB      PHE  25   4.549   2.591   5.404
  334    H    TYR  26           H        TYR  26   4.179   0.954   4.340
  335    HA   TYR  26           HA       TYR  26   3.038  -1.060   4.789
  336    HD1  TYR  26           HD1      TYR  26   2.355  -3.200   4.749
  337    HD2  TYR  26           HD2      TYR  26   6.520  -4.220   4.410
  338    HE1  TYR  26           HE1      TYR  26   1.849  -5.513   5.475
  339    HE2  TYR  26           HE2      TYR  26   6.007  -6.532   5.133
  340    HH   TYR  26           HH       TYR  26   2.701  -7.650   5.519
  341    HB2  TYR  26           2HB      TYR  26   4.437  -1.993   3.085
  342    HB3  TYR  26           1HB      TYR  26   5.847  -1.978   4.131
  343    H    THR  27           H        THR  27   3.225   0.117   7.119
  344    HA   THR  27           HA       THR  27   4.942  -1.269   9.029
  345    HB   THR  27           HB       THR  27   4.361   1.009   9.519
  346    HG1  THR  27           HG1      THR  27   3.173   0.707  11.501
  347   HG21  THR  27          3HG2      THR  27   1.712   1.265   9.998
  348   HG22  THR  27          1HG2      THR  27   1.668   0.064   8.708
  349   HG23  THR  27          2HG2      THR  27   2.444   1.624   8.434
  350    H    LYS  28           H        LYS  28   4.371  -2.934  10.402
  351    HA   LYS  28           HA       LYS  28   1.601  -3.768  10.757
  352    HB2  LYS  28           2HB      LYS  28   2.151  -4.725   8.510
  353    HB3  LYS  28           1HB      LYS  28   3.477  -5.620   9.254
  354    HG2  LYS  28           2HG      LYS  28   2.042  -7.008  10.466
  355    HG3  LYS  28           1HG      LYS  28   0.709  -5.855  10.396
  356    HD2  LYS  28           2HD      LYS  28  -0.068  -6.754   8.480
  357    HD3  LYS  28           1HD      LYS  28   1.526  -6.669   7.728
  358    HE2  LYS  28           2HE      LYS  28   2.170  -8.742   8.975
  359    HE3  LYS  28           1HE      LYS  28   0.514  -8.853   9.573
  360    HZ1  LYS  28           3HZ      LYS  28   0.923 -10.208   7.573
  361    HZ2  LYS  28           1HZ      LYS  28   1.264  -8.793   6.701
  362    HZ3  LYS  28           2HZ      LYS  28  -0.291  -9.041   7.341
  363    HA   PRO  29           HA       PRO  29   4.568  -4.858  14.091
  364    HB2  PRO  29           2HB      PRO  29   3.132  -3.625  16.084
  365    HB3  PRO  29           1HB      PRO  29   4.375  -2.809  15.119
  366    HG2  PRO  29           2HG      PRO  29   1.405  -2.576  14.942
  367    HG3  PRO  29           1HG      PRO  29   2.652  -1.390  14.519
  368    HD2  PRO  29           2HD      PRO  29   1.231  -2.998  12.689
  369    HD3  PRO  29           1HD      PRO  29   2.719  -2.097  12.338
  370    H    THR  30           H        THR  30   4.277  -6.636  15.485
  371    HA   THR  30           HA       THR  30   1.528  -7.804  15.511
  372    HB   THR  30           HB       THR  30   4.217  -9.158  15.903
  373    HG1  THR  30           HG1      THR  30   4.170  -9.408  13.833
  374   HG21  THR  30          3HG2      THR  30   3.082 -10.949  16.646
  375   HG22  THR  30          1HG2      THR  30   2.006 -10.891  15.250
  376   HG23  THR  30          2HG2      THR  30   1.626  -9.955  16.695
  Start of MODEL    4
    1    H1   GLY   1           1H       GLY   1  -2.929   1.418  11.315
    2    H2   GLY   1           2H       GLY   1  -2.618   0.117  12.362
    3    H3   GLY   1           3H       GLY   1  -3.962   0.071  11.325
    4    HA2  GLY   1           1HA      GLY   1  -1.481   0.349   9.958
    5    HA3  GLY   1           2HA      GLY   1  -1.605  -1.205  10.839
    6    H    ILE   2           H        ILE   2  -0.928  -1.128   8.277
    7    HA   ILE   2           HA       ILE   2  -3.183  -0.347   6.491
    8    HB   ILE   2           HB       ILE   2  -0.819   0.498   6.040
    9   HG12  ILE   2          2HG1      ILE   2  -2.348  -1.147   4.009
   10   HG13  ILE   2          1HG1      ILE   2  -2.450   0.591   4.279
   11   HG21  ILE   2          1HG2      ILE   2   0.886  -0.947   5.606
   12   HG22  ILE   2          2HG2      ILE   2  -0.158  -2.071   4.738
   13   HG23  ILE   2          3HG2      ILE   2  -0.103  -2.100   6.501
   14   HD11  ILE   2          3HD1      ILE   2  -0.714   0.977   2.895
   15   HD12  ILE   2          1HD1      ILE   2  -0.800  -0.719   2.428
   16   HD13  ILE   2          2HD1      ILE   2   0.288  -0.213   3.720
   17    H    THR   3           H        THR   3  -1.405  -3.081   7.722
   18    HA   THR   3           HA       THR   3  -2.229  -4.959   5.683
   19    HB   THR   3           HB       THR   3  -1.361  -5.426   8.553
   20    HG1  THR   3           HG1      THR   3   0.067  -4.432   6.846
   21   HG21  THR   3          3HG2      THR   3  -1.842  -7.287   6.222
   22   HG22  THR   3          1HG2      THR   3  -2.514  -7.385   7.849
   23   HG23  THR   3          2HG2      THR   3  -0.806  -7.730   7.578
   24    H    GLU   4           H        GLU   4  -3.722  -3.603   8.497
   25    HA   GLU   4           HA       GLU   4  -5.918  -5.611   8.367
   26    HB2  GLU   4           2HB      GLU   4  -5.021  -5.183  10.608
   27    HB3  GLU   4           1HB      GLU   4  -5.311  -3.454  10.415
   28    HG2  GLU   4           2HG      GLU   4  -7.432  -3.708  11.114
   29    HG3  GLU   4           1HG      GLU   4  -7.737  -4.866   9.819
   30    H    GLN   5           H        GLN   5  -5.756  -3.866   6.194
   31    HA   GLN   5           HA       GLN   5  -8.382  -2.707   6.188
   32    HB2  GLN   5           2HB      GLN   5  -6.760  -1.062   7.548
   33    HB3  GLN   5           1HB      GLN   5  -6.342  -0.540   5.915
   34    HG2  GLN   5           2HG      GLN   5  -8.176   0.838   6.621
   35    HG3  GLN   5           1HG      GLN   5  -8.838  -0.326   5.472
   36   HE21  GLN   5          1HE2      GLN   5 -10.303  -1.952   6.278
   37   HE22  GLN   5          2HE2      GLN   5 -10.889  -1.938   7.871
   38    H    CYS   6           H        CYS   6  -5.129  -2.760   4.818
   39    HA   CYS   6           HA       CYS   6  -6.181  -2.170   2.122
   40    HB2  CYS   6           2HB      CYS   6  -3.448  -2.479   3.324
   41    HB3  CYS   6           1HB      CYS   6  -3.643  -2.616   1.584
   42    H    CYS   7           H        CYS   7  -5.847  -4.852   4.072
   43    HA   CYS   7           HA       CYS   7  -5.690  -6.605   1.663
   44    HB2  CYS   7           2HB      CYS   7  -3.740  -6.880   3.159
   45    HB3  CYS   7           1HB      CYS   7  -4.825  -7.261   4.488
   46    H    THR   8           H        THR   8  -7.454  -5.690   4.485
   47    HA   THR   8           HA       THR   8  -9.284  -8.008   4.255
   48    HB   THR   8           HB       THR   8  -8.990  -7.409   6.521
   49    HG1  THR   8           HG1      THR   8 -11.004  -6.285   7.040
   50   HG21  THR   8          3HG2      THR   8  -8.879  -4.647   5.404
   51   HG22  THR   8          1HG2      THR   8  -7.853  -5.410   6.619
   52   HG23  THR   8          2HG2      THR   8  -9.460  -4.832   7.059
   53    H    SER   9           H        SER   9  -8.799  -5.155   2.676
   54    HA   SER   9           HA       SER   9 -11.370  -5.213   1.367
   55    HG   SER   9           HG       SER   9 -13.270  -4.198   2.914
   56    HB2  SER   9           2HB      SER   9 -11.358  -3.763   3.739
   57    HB3  SER   9           1HB      SER   9 -11.063  -2.533   2.513
   58    H    ILE  10           H        ILE  10 -11.369  -2.668   0.230
   59    HA   ILE  10           HA       ILE  10  -8.758  -2.730  -1.195
   60    HB   ILE  10           HB       ILE  10 -11.434  -1.519  -1.910
   61   HG12  ILE  10          2HG1      ILE  10  -9.809  -3.685  -3.268
   62   HG13  ILE  10          1HG1      ILE  10 -11.075  -4.023  -2.085
   63   HG21  ILE  10          1HG2      ILE  10  -8.962  -1.594  -3.649
   64   HG22  ILE  10          2HG2      ILE  10  -9.359  -0.195  -2.652
   65   HG23  ILE  10          3HG2      ILE  10 -10.461  -0.710  -3.929
   66   HD11  ILE  10          3HD1      ILE  10 -12.310  -4.118  -4.035
   67   HD12  ILE  10          1HD1      ILE  10 -11.311  -2.913  -4.848
   68   HD13  ILE  10          2HD1      ILE  10 -12.488  -2.410  -3.635
   69    H    CYS  11           H        CYS  11  -7.353  -1.039  -1.078
   70    HA   CYS  11           HA       CYS  11  -8.092   1.229   0.689
   71    HB2  CYS  11           2HB      CYS  11  -5.502   0.053  -0.287
   72    HB3  CYS  11           1HB      CYS  11  -5.538   1.725   0.266
   73    H    SER  12           H        SER  12  -6.852   3.360  -0.157
   74    HA   SER  12           HA       SER  12  -7.716   3.717  -3.001
   75    HG   SER  12           HG       SER  12  -6.785   5.660  -0.143
   76    HB2  SER  12           2HB      SER  12  -7.637   6.232  -2.192
   77    HB3  SER  12           1HB      SER  12  -9.036   5.227  -1.826
   78    H    LEU  13           H        LEU  13  -5.998   3.765  -4.339
   79    HA   LEU  13           HA       LEU  13  -3.314   3.849  -3.806
   80    HG   LEU  13           HG       LEU  13  -5.930   5.434  -5.449
   81    HB2  LEU  13           2HB      LEU  13  -3.088   5.218  -5.991
   82    HB3  LEU  13           1HB      LEU  13  -3.853   3.641  -6.066
   83   HD11  LEU  13          1HD1      LEU  13  -4.165   7.143  -6.305
   84   HD12  LEU  13          2HD1      LEU  13  -5.787   7.207  -6.995
   85   HD13  LEU  13          3HD1      LEU  13  -4.477   6.439  -7.891
   86   HD21  LEU  13          3HD2      LEU  13  -6.905   4.406  -7.254
   87   HD22  LEU  13          1HD2      LEU  13  -5.528   3.319  -7.072
   88   HD23  LEU  13          2HD2      LEU  13  -5.478   4.611  -8.271
   89    H    TYR  14           H        TYR  14  -5.480   6.591  -4.055
   90    HA   TYR  14           HA       TYR  14  -3.802   8.785  -3.822
   91    HD1  TYR  14           HD1      TYR  14  -4.266  10.777  -4.214
   92    HD2  TYR  14           HD2      TYR  14  -6.775  10.211  -0.772
   93    HE1  TYR  14           HE1      TYR  14  -3.945  13.157  -3.588
   94    HE2  TYR  14           HE2      TYR  14  -6.457  12.590  -0.146
   95    HH   TYR  14           HH       TYR  14  -5.865  14.782  -1.506
   96    HB2  TYR  14           2HB      TYR  14  -6.322   8.841  -3.827
   97    HB3  TYR  14           1HB      TYR  14  -6.279   8.385  -2.125
   98    H    GLN  15           H        GLN  15  -5.232   7.279  -0.949
   99    HA   GLN  15           HA       GLN  15  -3.249   8.343   0.843
  100    HB2  GLN  15           2HB      GLN  15  -5.338   6.189   1.048
  101    HB3  GLN  15           1HB      GLN  15  -4.173   6.432   2.347
  102    HG2  GLN  15           2HG      GLN  15  -5.522   8.067   3.129
  103    HG3  GLN  15           1HG      GLN  15  -5.083   9.009   1.704
  104   HE21  GLN  15          1HE2      GLN  15  -7.415   6.461   2.733
  105   HE22  GLN  15          2HE2      GLN  15  -8.661   6.977   1.703
  106    H    LEU  16           H        LEU  16  -3.725   5.267  -0.748
  107    HA   LEU  16           HA       LEU  16  -1.844   3.570   0.287
  108    HG   LEU  16           HG       LEU  16  -2.268   1.482  -2.571
  109    HB2  LEU  16           2HB      LEU  16  -3.330   3.572  -1.954
  110    HB3  LEU  16           1HB      LEU  16  -1.761   3.921  -2.674
  111   HD11  LEU  16          1HD1      LEU  16  -0.029   1.939  -0.648
  112   HD12  LEU  16          2HD1      LEU  16   0.080   2.678  -2.245
  113   HD13  LEU  16          3HD1      LEU  16  -0.079   0.928  -2.091
  114   HD21  LEU  16          3HD2      LEU  16  -1.707   1.249   0.278
  115   HD22  LEU  16          1HD2      LEU  16  -2.991   0.505  -0.674
  116   HD23  LEU  16          2HD2      LEU  16  -3.201   2.134  -0.029
  117    H    GLU  17           H        GLU  17  -1.203   6.346  -1.806
  118    HA   GLU  17           HA       GLU  17   1.639   5.804  -2.036
  119    HB2  GLU  17           2HB      GLU  17   0.730   7.054  -3.812
  120    HB3  GLU  17           1HB      GLU  17  -0.142   8.133  -2.726
  121    HG2  GLU  17           2HG      GLU  17   2.067   9.011  -1.919
  122    HG3  GLU  17           1HG      GLU  17   2.861   8.019  -3.143
  123    H    ASN  18           H        ASN  18  -0.342   7.459   0.280
  124    HA   ASN  18           HA       ASN  18   1.740   9.127   1.385
  125    HB2  ASN  18           2HB      ASN  18  -0.697   9.525   1.743
  126    HB3  ASN  18           1HB      ASN  18  -0.753   8.086   2.760
  127   HD21  ASN  18          1HD2      ASN  18   0.605   8.137   4.776
  128   HD22  ASN  18          2HD2      ASN  18   0.990   9.633   5.481
  129    H    TYR  19           H        TYR  19   1.521   5.798   1.332
  130    HA   TYR  19           HA       TYR  19   2.621   5.465   4.065
  131    HD1  TYR  19           HD2      TYR  19   0.954   5.102   5.093
  132    HD2  TYR  19           HD1      TYR  19  -0.224   2.709   1.724
  133    HE1  TYR  19           HE2      TYR  19  -1.423   5.337   5.758
  134    HE2  TYR  19           HE1      TYR  19  -2.603   2.943   2.389
  135    HH   TYR  19           HH       TYR  19  -3.973   4.652   3.738
  136    HB2  TYR  19           2HB      TYR  19   2.021   3.375   1.949
  137    HB3  TYR  19           1HB      TYR  19   2.457   3.061   3.629
  138    H    CYS  20           H        CYS  20   4.095   6.824   1.793
  139    HA   CYS  20           HA       CYS  20   6.323   4.903   1.390
  140    HB2  CYS  20           2HB      CYS  20   5.277   6.623  -0.376
  141    HB3  CYS  20           1HB      CYS  20   6.500   7.672   0.304
  142    H    ASN  21           H        ASN  21   8.483   6.531   1.281
  143    HA   ASN  21           HA       ASN  21   8.783   7.334   4.128
  144    HB2  ASN  21           2HB      ASN  21  10.363   5.670   2.943
  145    HB3  ASN  21           1HB      ASN  21  11.009   7.081   2.105
  146   HD21  ASN  21          1HD2      ASN  21  11.956   8.828   3.495
  147   HD22  ASN  21          2HD2      ASN  21  12.563   8.435   5.031
  148    HA   PHE   1           HA       PHE   1  -9.495   2.426 -12.747
  149    HD1  PHE   1           HD2      PHE   1  -7.029   3.308 -14.456
  150    HD2  PHE   1           HD1      PHE   1  -6.447   4.671 -10.422
  151    HE1  PHE   1           HE2      PHE   1  -5.832   5.311 -15.303
  152    HE2  PHE   1           HE1      PHE   1  -5.250   6.671 -11.269
  153    HZ   PHE   1           HZ       PHE   1  -4.942   6.991 -13.709
  154    H1   PHE   1           1H       PHE   1  -9.245   4.709 -12.873
  155    H2   PHE   1           2H       PHE   1  -8.662   4.848 -11.283
  156    H3   PHE   1           3H       PHE   1 -10.308   4.532 -11.562
  157    HB2  PHE   1           2HB      PHE   1  -7.226   2.438 -10.849
  158    HB3  PHE   1           1HB      PHE   1  -7.317   1.792 -12.486
  159    H    VAL   2           H        VAL   2 -10.483   0.774 -11.631
  160    HA   VAL   2           HA       VAL   2 -10.894   1.210  -8.700
  161    HB   VAL   2           HB       VAL   2 -12.924   1.240 -10.254
  162   HG11  VAL   2          1HG1      VAL   2 -13.489  -0.598 -11.483
  163   HG12  VAL   2          2HG1      VAL   2 -12.931  -1.720 -10.241
  164   HG13  VAL   2          3HG1      VAL   2 -11.772  -0.980 -11.347
  165   HG21  VAL   2          3HG2      VAL   2 -14.257   0.306  -8.583
  166   HG22  VAL   2          1HG2      VAL   2 -12.753   0.578  -7.702
  167   HG23  VAL   2          2HG2      VAL   2 -13.144  -1.033  -8.303
  168    H    ASN   3           H        ASN   3 -11.324  -0.957  -7.534
  169    HA   ASN   3           HA       ASN   3 -10.682  -3.166  -7.010
  170    HB2  ASN   3           2HB      ASN   3  -9.193  -3.314  -9.629
  171    HB3  ASN   3           1HB      ASN   3  -9.907  -4.628  -8.694
  172   HD21  ASN   3          1HD2      ASN   3 -10.416  -2.936 -11.480
  173   HD22  ASN   3          2HD2      ASN   3 -12.110  -3.018 -11.568
  174    H    GLN   4           H        GLN   4  -9.326  -2.145  -5.396
  175    HA   GLN   4           HA       GLN   4  -6.433  -2.219  -6.127
  176    HB2  GLN   4           2HB      GLN   4  -7.055   0.105  -5.872
  177    HB3  GLN   4           1HB      GLN   4  -7.890  -0.238  -4.357
  178    HG2  GLN   4           2HG      GLN   4  -5.787   0.644  -3.705
  179    HG3  GLN   4           1HG      GLN   4  -5.630  -1.099  -3.498
  180   HE21  GLN   4          1HE2      GLN   4  -3.342   0.594  -3.934
  181   HE22  GLN   4          2HE2      GLN   4  -2.676   0.196  -5.444
  182    H    HIS   5           H        HIS   5  -6.522  -4.446  -5.273
  183    HA   HIS   5           HA       HIS   5  -7.080  -4.714  -2.379
  184    HD2  HIS   5           HD2      HIS   5  -9.070  -4.761  -4.598
  185    HE1  HIS   5           HE1      HIS   5  -8.723  -7.724  -7.594
  186    HE2  HIS   5           HE2      HIS   5 -10.003  -5.642  -6.861
  187    HB2  HIS   5           2HB      HIS   5  -5.921  -7.020  -3.825
  188    HB3  HIS   5           1HB      HIS   5  -7.327  -6.949  -2.767
  189    H    LEU   6           H        LEU   6  -5.436  -5.422  -0.875
  190    HA   LEU   6           HA       LEU   6  -2.651  -5.442  -1.857
  191    HG   LEU   6           HG       LEU   6  -2.795  -2.292  -2.045
  192    HB2  LEU   6           2HB      LEU   6  -3.878  -3.278  -0.274
  193    HB3  LEU   6           1HB      LEU   6  -2.404  -3.911   0.421
  194   HD11  LEU   6          1HD1      LEU   6  -1.436  -2.090   0.352
  195   HD12  LEU   6          2HD1      LEU   6  -1.159  -1.082  -1.069
  196   HD13  LEU   6          3HD1      LEU   6  -0.157  -2.504  -0.790
  197   HD21  LEU   6          3HD2      LEU   6  -0.478  -3.277  -2.814
  198   HD22  LEU   6          1HD2      LEU   6  -1.957  -4.117  -3.278
  199   HD23  LEU   6          2HD2      LEU   6  -0.987  -4.708  -1.928
  200    H    CYS   7           H        CYS   7  -1.477  -6.933  -0.846
  201    HA   CYS   7           HA       CYS   7  -1.963  -7.616   1.959
  202    HB2  CYS   7           2HB      CYS   7  -2.431  -9.677  -0.236
  203    HB3  CYS   7           1HB      CYS   7  -2.361 -10.036   1.486
  204    H    GLY   8           H        GLY   8  -0.014  -8.170   2.822
  205    HA2  GLY   8           2HA      GLY   8   2.358  -8.379   2.800
  206    HA3  GLY   8           1HA      GLY   8   1.885  -9.950   2.169
  207    H    SER   9           H        SER   9   2.918 -10.493   0.346
  208    HA   SER   9           HA       SER   9   4.767  -9.034  -1.068
  209    HG   SER   9           HG       SER   9   5.243 -10.734  -3.392
  210    HB2  SER   9           2HB      SER   9   3.478 -11.488  -1.438
  211    HB3  SER   9           1HB      SER   9   3.186 -10.610  -2.937
  212    H    ASP  10           H        ASP  10   1.296  -9.208  -1.931
  213    HA   ASP  10           HA       ASP  10   1.529  -7.325  -4.091
  214    HB2  ASP  10           2HB      ASP  10  -0.959  -7.843  -2.455
  215    HB3  ASP  10           1HB      ASP  10  -0.856  -7.375  -4.147
  216    H    LEU  11           H        LEU  11   1.360  -7.027  -0.672
  217    HA   LEU  11           HA       LEU  11   0.290  -4.400  -0.384
  218    HG   LEU  11           HG       LEU  11   2.162  -3.661   2.403
  219    HB2  LEU  11           2HB      LEU  11   0.848  -6.127   1.439
  220    HB3  LEU  11           1HB      LEU  11   2.520  -5.611   1.278
  221   HD11  LEU  11          1HD1      LEU  11  -0.553  -3.604   1.078
  222   HD12  LEU  11          2HD1      LEU  11   0.828  -2.551   0.761
  223   HD13  LEU  11          3HD1      LEU  11  -0.049  -2.422   2.285
  224   HD21  LEU  11          3HD2      LEU  11   0.990  -4.188   4.268
  225   HD22  LEU  11          1HD2      LEU  11   0.734  -5.739   3.468
  226   HD23  LEU  11          2HD2      LEU  11  -0.496  -4.480   3.365
  227    H    VAL  12           H        VAL  12   3.684  -5.491  -0.757
  228    HA   VAL  12           HA       VAL  12   4.706  -2.787  -0.895
  229    HB   VAL  12           HB       VAL  12   6.730  -3.982  -1.925
  230   HG11  VAL  12          1HG1      VAL  12   7.389  -4.919   0.235
  231   HG12  VAL  12          2HG1      VAL  12   5.701  -4.996   0.742
  232   HG13  VAL  12          3HG1      VAL  12   6.479  -3.432   0.498
  233   HG21  VAL  12          3HG2      VAL  12   5.282  -6.465  -1.008
  234   HG22  VAL  12          1HG2      VAL  12   6.750  -6.349  -1.980
  235   HG23  VAL  12          2HG2      VAL  12   5.191  -5.916  -2.681
  236    H    GLU  13           H        GLU  13   3.215  -4.962  -3.132
  237    HA   GLU  13           HA       GLU  13   4.228  -3.936  -5.593
  238    HB2  GLU  13           2HB      GLU  13   2.728  -5.995  -5.213
  239    HB3  GLU  13           1HB      GLU  13   1.377  -4.861  -5.175
  240    HG2  GLU  13           2HG      GLU  13   2.836  -4.091  -7.424
  241    HG3  GLU  13           1HG      GLU  13   2.888  -5.855  -7.464
  242    H    ALA  14           H        ALA  14   1.223  -3.081  -3.830
  243    HA   ALA  14           HA       ALA  14   0.511  -0.864  -5.470
  244    HB1  ALA  14           3HB      ALA  14  -1.026  -1.813  -3.799
  245    HB2  ALA  14           1HB      ALA  14  -0.783  -0.092  -3.496
  246    HB3  ALA  14           2HB      ALA  14   0.050  -1.288  -2.504
  247    H    LEU  15           H        LEU  15   2.301  -0.977  -2.402
  248    HA   LEU  15           HA       LEU  15   2.989   1.772  -2.270
  249    HG   LEU  15           HG       LEU  15   2.361  -0.728  -0.364
  250    HB2  LEU  15           2HB      LEU  15   4.596  -0.624  -1.315
  251    HB3  LEU  15           1HB      LEU  15   4.798   1.034  -0.765
  252   HD11  LEU  15          1HD1      LEU  15   3.267   0.422   2.031
  253   HD12  LEU  15          2HD1      LEU  15   4.729  -0.086   1.185
  254   HD13  LEU  15          3HD1      LEU  15   3.457  -1.258   1.530
  255   HD21  LEU  15          3HD2      LEU  15   1.804   1.682  -0.877
  256   HD22  LEU  15          1HD2      LEU  15   2.784   2.150   0.510
  257   HD23  LEU  15          2HD2      LEU  15   1.332   1.176   0.743
  258    H    TYR  16           H        TYR  16   4.496  -0.943  -3.965
  259    HA   TYR  16           HA       TYR  16   6.939   0.274  -4.697
  260    HD1  TYR  16           HD2      TYR  16   8.640  -0.274  -5.482
  261    HD2  TYR  16           HD1      TYR  16   6.459  -3.954  -5.075
  262    HE1  TYR  16           HE2      TYR  16  10.685  -1.392  -4.631
  263    HE2  TYR  16           HE1      TYR  16   8.503  -5.073  -4.225
  264    HH   TYR  16           HH       TYR  16  11.050  -4.679  -4.468
  265    HB2  TYR  16           2HB      TYR  16   5.310  -1.978  -5.633
  266    HB3  TYR  16           1HB      TYR  16   6.256  -1.228  -6.919
  267    H    LEU  17           H        LEU  17   4.141  -0.042  -6.906
  268    HA   LEU  17           HA       LEU  17   5.047   1.774  -8.832
  269    HG   LEU  17           HG       LEU  17   2.480   0.633  -6.775
  270    HB2  LEU  17           2HB      LEU  17   2.517   2.153  -9.277
  271    HB3  LEU  17           1HB      LEU  17   3.181   0.534  -9.478
  272   HD11  LEU  17          1HD1      LEU  17   0.115   1.661  -8.324
  273   HD12  LEU  17          2HD1      LEU  17   1.223   2.777  -7.524
  274   HD13  LEU  17          3HD1      LEU  17   0.341   1.578  -6.576
  275   HD21  LEU  17          3HD2      LEU  17   2.052  -1.367  -7.876
  276   HD22  LEU  17          1HD2      LEU  17   1.344  -0.563  -9.277
  277   HD23  LEU  17          2HD2      LEU  17   0.419  -0.709  -7.783
  278    H    VAL  18           H        VAL  18   3.705   2.538  -5.684
  279    HA   VAL  18           HA       VAL  18   3.343   5.372  -6.482
  280    HB   VAL  18           HB       VAL  18   2.500   5.695  -4.188
  281   HG11  VAL  18          1HG1      VAL  18   1.013   4.844  -6.026
  282   HG12  VAL  18          2HG1      VAL  18   0.487   4.375  -4.408
  283   HG13  VAL  18          3HG1      VAL  18   1.316   3.209  -5.439
  284   HG21  VAL  18          3HG2      VAL  18   3.909   4.091  -3.011
  285   HG22  VAL  18          1HG2      VAL  18   3.166   2.761  -3.898
  286   HG23  VAL  18          2HG2      VAL  18   2.215   3.686  -2.741
  287    H    CYS  19           H        CYS  19   5.200   3.449  -4.203
  288    HA   CYS  19           HA       CYS  19   6.774   5.632  -3.186
  289    HB2  CYS  19           2HB      CYS  19   6.906   2.647  -3.079
  290    HB3  CYS  19           1HB      CYS  19   8.375   3.541  -2.705
  291    H    GLY  20           H        GLY  20   7.660   2.962  -5.391
  292    HA2  GLY  20           2HA      GLY  20   9.081   3.026  -7.290
  293    HA3  GLY  20           1HA      GLY  20   9.274   4.766  -7.046
  294    H    GLU  21           H        GLU  21  11.631   4.109  -7.469
  295    HA   GLU  21           HA       GLU  21  13.027   2.626  -5.410
  296    HB2  GLU  21           2HB      GLU  21  13.794   3.006  -7.829
  297    HB3  GLU  21           1HB      GLU  21  14.281   4.619  -7.306
  298    HG2  GLU  21           2HG      GLU  21  16.241   3.340  -7.021
  299    HG3  GLU  21           1HG      GLU  21  15.543   3.386  -5.401
  300    H    ARG  22           H        ARG  22  11.498   4.468  -4.070
  301    HA   ARG  22           HA       ARG  22  13.514   6.431  -3.095
  302    HE   ARG  22           HE       ARG  22  12.645  10.632  -4.847
  303    HB2  ARG  22           2HB      ARG  22  10.611   6.686  -3.681
  304    HB3  ARG  22           1HB      ARG  22  11.162   7.443  -2.186
  305    HG2  ARG  22           2HG      ARG  22  13.064   8.027  -4.249
  306    HG3  ARG  22           1HG      ARG  22  11.451   8.420  -4.847
  307    HD2  ARG  22           2HD      ARG  22  11.016   9.776  -2.850
  308    HD3  ARG  22           1HD      ARG  22  12.599   9.351  -2.198
  309   HH11  ARG  22          1HH2      ARG  22  14.693  10.551  -2.476
  310   HH12  ARG  22          2HH2      ARG  22  14.697  12.228  -2.041
  311   HH21  ARG  22          1HH1      ARG  22  11.828  12.975  -3.840
  312   HH22  ARG  22          2HH1      ARG  22  13.078  13.601  -2.816
  313    H    GLY  23           H        GLY  23  11.619   3.676  -2.427
  314    HA2  GLY  23           2HA      GLY  23  12.082   2.402  -0.387
  315    HA3  GLY  23           1HA      GLY  23  12.343   3.925   0.460
  316    H    PHE  24           H        PHE  24  10.299   1.462   0.491
  317    HA   PHE  24           HA       PHE  24   7.871   3.172   0.836
  318    HD1  PHE  24           HD2      PHE  24   9.298   1.441  -1.925
  319    HD2  PHE  24           HD1      PHE  24   7.969  -1.406   1.006
  320    HE1  PHE  24           HE2      PHE  24  10.868  -0.244  -2.849
  321    HE2  PHE  24           HE1      PHE  24   9.536  -3.092   0.082
  322    HZ   PHE  24           HZ       PHE  24  10.987  -2.511  -1.846
  323    HB2  PHE  24           2HB      PHE  24   6.857   0.655   0.800
  324    HB3  PHE  24           1HB      PHE  24   7.049   1.627  -0.652
  325    H    PHE  25           H        PHE  25   6.280   1.877   2.437
  326    HA   PHE  25           HA       PHE  25   7.834   0.896   4.781
  327    HD1  PHE  25           HD1      PHE  25   8.589   1.178   6.474
  328    HD2  PHE  25           HD2      PHE  25   4.998   3.403   7.261
  329    HE1  PHE  25           HE1      PHE  25   8.813   0.682   8.894
  330    HE2  PHE  25           HE2      PHE  25   5.222   2.907   9.683
  331    HZ   PHE  25           HZ       PHE  25   7.130   1.546  10.498
  332    HB2  PHE  25           2HB      PHE  25   7.355   3.392   4.962
  333    HB3  PHE  25           1HB      PHE  25   5.643   2.971   5.032
  334    H    TYR  26           H        TYR  26   6.904  -1.182   4.148
  335    HA   TYR  26           HA       TYR  26   3.973  -1.463   4.225
  336    HD1  TYR  26           HD1      TYR  26   2.789  -3.415   4.811
  337    HD2  TYR  26           HD2      TYR  26   6.226  -5.667   3.540
  338    HE1  TYR  26           HE1      TYR  26   1.728  -5.498   5.631
  339    HE2  TYR  26           HE2      TYR  26   5.162  -7.746   4.362
  340    HH   TYR  26           HH       TYR  26   2.716  -7.862   6.459
  341    HB2  TYR  26           2HB      TYR  26   4.896  -2.913   2.634
  342    HB3  TYR  26           1HB      TYR  26   6.305  -3.261   3.617
  343    H    THR  27           H        THR  27   4.213  -0.464   6.576
  344    HA   THR  27           HA       THR  27   5.158  -2.345   8.610
  345    HB   THR  27           HB       THR  27   5.311   0.024   9.092
  346    HG1  THR  27           HG1      THR  27   3.091  -0.799  10.606
  347   HG21  THR  27          3HG2      THR  27   3.116   1.320   9.335
  348   HG22  THR  27          1HG2      THR  27   2.361   0.001   8.441
  349   HG23  THR  27          2HG2      THR  27   3.633   0.962   7.687
  350    H    LYS  28           H        LYS  28   3.506  -2.863  10.455
  351    HA   LYS  28           HA       LYS  28   0.754  -3.282   9.499
  352    HB2  LYS  28           2HB      LYS  28   1.428  -5.817  10.518
  353    HB3  LYS  28           1HB      LYS  28   1.054  -5.419   8.844
  354    HG2  LYS  28           2HG      LYS  28   3.175  -6.466   8.735
  355    HG3  LYS  28           1HG      LYS  28   3.540  -4.744   8.643
  356    HD2  LYS  28           2HD      LYS  28   4.206  -4.658  10.932
  357    HD3  LYS  28           1HD      LYS  28   3.512  -6.245  11.266
  358    HE2  LYS  28           2HE      LYS  28   5.228  -7.379  10.142
  359    HE3  LYS  28           1HE      LYS  28   5.680  -5.957   9.200
  360    HZ1  LYS  28           3HZ      LYS  28   7.326  -6.148  10.818
  361    HZ2  LYS  28           1HZ      LYS  28   6.223  -6.523  12.050
  362    HZ3  LYS  28           2HZ      LYS  28   6.297  -4.942  11.430
  363    HA   PRO  29           HA       PRO  29   0.064  -2.735  13.787
  364    HB2  PRO  29           2HB      PRO  29  -2.538  -3.620  13.875
  365    HB3  PRO  29           1HB      PRO  29  -2.057  -2.040  13.228
  366    HG2  PRO  29           2HG      PRO  29  -2.890  -4.498  11.757
  367    HG3  PRO  29           1HG      PRO  29  -3.025  -2.800  11.272
  368    HD2  PRO  29           2HD      PRO  29  -1.065  -4.618  10.362
  369    HD3  PRO  29           1HD      PRO  29  -1.009  -2.853  10.183
  370    H    THR  30           H        THR  30  -1.604  -4.328  15.399
  371    HA   THR  30           HA       THR  30  -0.067  -6.886  15.437
  372    HB   THR  30           HB       THR  30  -1.706  -6.280  17.791
  373    HG1  THR  30           HG1      THR  30  -1.003  -4.350  18.179
  374   HG21  THR  30          3HG2      THR  30   0.304  -6.907  18.943
  375   HG22  THR  30          1HG2      THR  30   1.285  -6.629  17.505
  376   HG23  THR  30          2HG2      THR  30   0.155  -7.982  17.553
  Start of MODEL    5
    1    H1   GLY   1           1H       GLY   1  -0.924   0.777   9.992
    2    H2   GLY   1           2H       GLY   1  -0.903  -0.887  10.337
    3    H3   GLY   1           3H       GLY   1  -1.408   0.221  11.521
    4    HA2  GLY   1           1HA      GLY   1  -3.153  -1.036  10.026
    5    HA3  GLY   1           2HA      GLY   1  -3.494   0.602  10.661
    6    H    ILE   2           H        ILE   2  -1.165  -0.272   8.122
    7    HA   ILE   2           HA       ILE   2  -3.062   0.250   5.976
    8    HB   ILE   2           HB       ILE   2  -0.851   1.038   5.588
    9   HG12  ILE   2          2HG1      ILE   2   0.037  -0.525   3.715
   10   HG13  ILE   2          1HG1      ILE   2  -1.367  -1.528   4.052
   11   HG21  ILE   2          1HG2      ILE   2  -0.128  -1.450   6.920
   12   HG22  ILE   2          2HG2      ILE   2   0.714   0.098   6.872
   13   HG23  ILE   2          3HG2      ILE   2   0.912  -1.054   5.553
   14   HD11  ILE   2          3HD1      ILE   2  -1.244   1.224   2.852
   15   HD12  ILE   2          1HD1      ILE   2  -2.685   0.753   3.754
   16   HD13  ILE   2          2HD1      ILE   2  -2.187  -0.175   2.339
   17    H    THR   3           H        THR   3  -1.511  -2.598   7.371
   18    HA   THR   3           HA       THR   3  -2.562  -4.373   5.288
   19    HB   THR   3           HB       THR   3  -1.174  -4.862   7.936
   20    HG1  THR   3           HG1      THR   3   0.380  -5.735   6.392
   21   HG21  THR   3          3HG2      THR   3  -2.264  -6.839   5.919
   22   HG22  THR   3          1HG2      THR   3  -2.687  -6.714   7.626
   23   HG23  THR   3          2HG2      THR   3  -1.077  -7.259   7.154
   24    H    GLU   4           H        GLU   4  -3.775  -2.879   8.087
   25    HA   GLU   4           HA       GLU   4  -5.817  -4.996   8.517
   26    HB2  GLU   4           2HB      GLU   4  -4.442  -3.626  10.366
   27    HB3  GLU   4           1HB      GLU   4  -5.777  -2.495  10.144
   28    HG2  GLU   4           2HG      GLU   4  -6.810  -3.822  11.689
   29    HG3  GLU   4           1HG      GLU   4  -7.149  -4.836  10.286
   30    H    GLN   5           H        GLN   5  -5.811  -3.288   6.109
   31    HA   GLN   5           HA       GLN   5  -8.603  -2.534   6.139
   32    HB2  GLN   5           2HB      GLN   5  -7.165  -0.586   7.301
   33    HB3  GLN   5           1HB      GLN   5  -6.885  -0.146   5.615
   34    HG2  GLN   5           2HG      GLN   5  -9.545  -0.585   5.513
   35    HG3  GLN   5           1HG      GLN   5  -9.400  -0.078   7.197
   36   HE21  GLN   5          1HE2      GLN   5  -7.765   1.966   7.369
   37   HE22  GLN   5          2HE2      GLN   5  -8.088   3.204   6.253
   38    H    CYS   6           H        CYS   6  -5.431  -2.123   4.610
   39    HA   CYS   6           HA       CYS   6  -6.631  -1.900   1.940
   40    HB2  CYS   6           2HB      CYS   6  -3.802  -1.973   2.984
   41    HB3  CYS   6           1HB      CYS   6  -4.142  -2.051   1.264
   42    H    CYS   7           H        CYS   7  -6.180  -4.409   4.004
   43    HA   CYS   7           HA       CYS   7  -5.770  -6.314   1.738
   44    HB2  CYS   7           2HB      CYS   7  -3.855  -6.473   3.143
   45    HB3  CYS   7           1HB      CYS   7  -4.824  -6.439   4.609
   46    H    THR   8           H        THR   8  -8.023  -5.065   3.773
   47    HA   THR   8           HA       THR   8  -9.504  -7.647   4.031
   48    HB   THR   8           HB       THR   8  -9.194  -6.383   6.147
   49    HG1  THR   8           HG1      THR   8 -11.872  -5.965   5.543
   50   HG21  THR   8          3HG2      THR   8 -10.709  -4.218   4.662
   51   HG22  THR   8          1HG2      THR   8  -9.037  -4.129   5.217
   52   HG23  THR   8          2HG2      THR   8 -10.353  -4.195   6.389
   53    H    SER   9           H        SER   9  -9.312  -4.695   2.329
   54    HA   SER   9           HA       SER   9 -11.796  -5.342   0.866
   55    HG   SER   9           HG       SER   9 -13.587  -3.450   0.738
   56    HB2  SER   9           2HB      SER   9 -12.551  -3.785   2.618
   57    HB3  SER   9           1HB      SER   9 -11.289  -2.643   2.164
   58    H    ILE  10           H        ILE  10 -11.410  -2.389  -0.179
   59    HA   ILE  10           HA       ILE  10  -9.009  -2.999  -1.858
   60    HB   ILE  10           HB       ILE  10 -11.383  -1.435  -2.876
   61   HG12  ILE  10          2HG1      ILE  10 -12.255  -3.633  -2.224
   62   HG13  ILE  10          1HG1      ILE  10 -12.132  -3.543  -3.981
   63   HG21  ILE  10          1HG2      ILE  10 -10.444  -2.111  -5.056
   64   HG22  ILE  10          2HG2      ILE  10  -9.183  -3.027  -4.231
   65   HG23  ILE  10          3HG2      ILE  10  -9.234  -1.270  -4.087
   66   HD11  ILE  10          3HD1      ILE  10 -11.122  -5.596  -2.508
   67   HD12  ILE  10          1HD1      ILE  10  -9.712  -4.543  -2.602
   68   HD13  ILE  10          2HD1      ILE  10 -10.484  -5.114  -4.080
   69    H    CYS  11           H        CYS  11  -7.494  -1.397  -1.814
   70    HA   CYS  11           HA       CYS  11  -8.265   1.165  -0.501
   71    HB2  CYS  11           2HB      CYS  11  -5.744  -0.411  -0.714
   72    HB3  CYS  11           1HB      CYS  11  -5.588   1.343  -0.651
   73    H    SER  12           H        SER  12  -7.210   3.152  -1.394
   74    HA   SER  12           HA       SER  12  -7.060   3.007  -4.379
   75    HG   SER  12           HG       SER  12  -8.328   6.359  -2.481
   76    HB2  SER  12           2HB      SER  12  -7.971   5.212  -4.473
   77    HB3  SER  12           1HB      SER  12  -8.962   4.346  -3.303
   78    H    LEU  13           H        LEU  13  -5.102   3.534  -5.240
   79    HA   LEU  13           HA       LEU  13  -2.775   3.853  -3.854
   80    HG   LEU  13           HG       LEU  13  -2.837   5.718  -7.602
   81    HB2  LEU  13           2HB      LEU  13  -1.727   4.566  -5.771
   82    HB3  LEU  13           1HB      LEU  13  -3.135   3.717  -6.373
   83   HD11  LEU  13          1HD1      LEU  13  -5.035   6.084  -7.716
   84   HD12  LEU  13          2HD1      LEU  13  -5.058   6.806  -6.109
   85   HD13  LEU  13          3HD1      LEU  13  -5.189   5.059  -6.292
   86   HD21  LEU  13          3HD2      LEU  13  -3.389   7.673  -5.515
   87   HD22  LEU  13          1HD2      LEU  13  -2.169   7.704  -6.789
   88   HD23  LEU  13          2HD2      LEU  13  -1.853   6.837  -5.286
   89    H    TYR  14           H        TYR  14  -5.189   6.266  -4.340
   90    HA   TYR  14           HA       TYR  14  -3.997   8.690  -3.847
   91    HD1  TYR  14           HD1      TYR  14  -5.933   9.563  -5.423
   92    HD2  TYR  14           HD2      TYR  14  -6.310  10.442  -1.234
   93    HE1  TYR  14           HE1      TYR  14  -6.215  11.971  -5.954
   94    HE2  TYR  14           HE2      TYR  14  -6.591  12.849  -1.763
   95    HH   TYR  14           HH       TYR  14  -6.467  14.016  -5.135
   96    HB2  TYR  14           2HB      TYR  14  -6.586   7.796  -3.595
   97    HB3  TYR  14           1HB      TYR  14  -6.185   8.214  -1.934
   98    H    GLN  15           H        GLN  15  -5.193   6.819  -1.094
   99    HA   GLN  15           HA       GLN  15  -3.412   8.112   0.766
  100    HB2  GLN  15           2HB      GLN  15  -5.412   5.935   0.841
  101    HB3  GLN  15           1HB      GLN  15  -4.148   5.844   2.066
  102    HG2  GLN  15           2HG      GLN  15  -5.744   8.360   1.530
  103    HG3  GLN  15           1HG      GLN  15  -6.208   7.170   2.745
  104   HE21  GLN  15          1HE2      GLN  15  -5.634   9.659   3.752
  105   HE22  GLN  15          2HE2      GLN  15  -4.116   9.674   4.511
  106    H    LEU  16           H        LEU  16  -3.414   5.092  -0.989
  107    HA   LEU  16           HA       LEU  16  -1.332   3.651   0.148
  108    HG   LEU  16           HG       LEU  16  -0.429   1.814  -1.465
  109    HB2  LEU  16           2HB      LEU  16  -2.750   3.602  -2.260
  110    HB3  LEU  16           1HB      LEU  16  -1.068   3.764  -2.758
  111   HD11  LEU  16          1HD1      LEU  16  -1.613   1.521   0.447
  112   HD12  LEU  16          2HD1      LEU  16  -2.747   0.626  -0.564
  113   HD13  LEU  16          3HD1      LEU  16  -3.037   2.329  -0.210
  114   HD21  LEU  16          3HD2      LEU  16  -2.740   0.481  -2.515
  115   HD22  LEU  16          1HD2      LEU  16  -1.109   0.539  -3.176
  116   HD23  LEU  16          2HD2      LEU  16  -2.281   1.777  -3.621
  117    H    GLU  17           H        GLU  17  -1.135   6.553  -1.826
  118    HA   GLU  17           HA       GLU  17   1.727   6.346  -2.211
  119    HB2  GLU  17           2HB      GLU  17   0.515   7.562  -3.859
  120    HB3  GLU  17           1HB      GLU  17  -0.242   8.586  -2.639
  121    HG2  GLU  17           2HG      GLU  17   2.031   9.456  -2.039
  122    HG3  GLU  17           1HG      GLU  17   2.702   8.513  -3.370
  123    H    ASN  18           H        ASN  18  -0.237   7.532   0.372
  124    HA   ASN  18           HA       ASN  18   1.848   9.302   1.417
  125    HB2  ASN  18           2HB      ASN  18  -0.899   8.686   2.084
  126    HB3  ASN  18           1HB      ASN  18   0.110   8.607   3.524
  127   HD21  ASN  18          1HD2      ASN  18   0.030  10.602   4.565
  128   HD22  ASN  18          2HD2      ASN  18   0.093  12.109   3.787
  129    H    TYR  19           H        TYR  19   1.084   5.951   1.549
  130    HA   TYR  19           HA       TYR  19   2.690   5.489   3.973
  131    HD1  TYR  19           HD2      TYR  19   0.760   5.406   5.063
  132    HD2  TYR  19           HD1      TYR  19  -0.560   2.972   1.778
  133    HE1  TYR  19           HE2      TYR  19  -1.599   5.846   5.677
  134    HE2  TYR  19           HE1      TYR  19  -2.915   3.411   2.387
  135    HH   TYR  19           HH       TYR  19  -3.730   5.497   5.174
  136    HB2  TYR  19           2HB      TYR  19   1.707   3.393   2.033
  137    HB3  TYR  19           1HB      TYR  19   2.111   3.189   3.735
  138    H    CYS  20           H        CYS  20   3.429   6.243   0.836
  139    HA   CYS  20           HA       CYS  20   5.465   4.260   0.305
  140    HB2  CYS  20           2HB      CYS  20   5.939   5.454  -1.606
  141    HB3  CYS  20           1HB      CYS  20   4.352   6.060  -1.324
  142    H    ASN  21           H        ASN  21   7.729   5.757  -0.219
  143    HA   ASN  21           HA       ASN  21   8.988   5.828   2.349
  144    HB2  ASN  21           2HB      ASN  21  10.217   5.479   0.205
  145    HB3  ASN  21           1HB      ASN  21   9.919   7.168  -0.210
  146   HD21  ASN  21          1HD2      ASN  21  11.894   8.231   0.093
  147   HD22  ASN  21          2HD2      ASN  21  12.863   8.091   1.480
  148    HA   PHE   1           HA       PHE   1  -9.226   3.434 -11.154
  149    HD1  PHE   1           HD2      PHE   1  -7.505   4.046  -9.495
  150    HD2  PHE   1           HD1      PHE   1 -11.346   5.532  -8.266
  151    HE1  PHE   1           HE2      PHE   1  -6.498   6.264  -9.027
  152    HE2  PHE   1           HE1      PHE   1 -10.339   7.749  -7.797
  153    HZ   PHE   1           HZ       PHE   1  -7.914   8.116  -8.177
  154    H1   PHE   1           1H       PHE   1 -11.606   4.568 -10.613
  155    H2   PHE   1           2H       PHE   1 -12.079   3.190 -11.488
  156    H3   PHE   1           3H       PHE   1 -10.995   4.305 -12.173
  157    HB2  PHE   1           2HB      PHE   1 -11.107   3.265  -8.803
  158    HB3  PHE   1           1HB      PHE   1  -9.505   2.526  -8.743
  159    H    VAL   2           H        VAL   2  -8.439   1.207 -10.511
  160    HA   VAL   2           HA       VAL   2 -10.318  -0.847 -11.596
  161    HB   VAL   2           HB       VAL   2  -7.336  -1.206 -11.377
  162   HG11  VAL   2          1HG1      VAL   2  -8.250  -2.364 -13.699
  163   HG12  VAL   2          2HG1      VAL   2  -9.638  -2.551 -12.627
  164   HG13  VAL   2          3HG1      VAL   2  -8.069  -3.207 -12.160
  165   HG21  VAL   2          3HG2      VAL   2  -8.879   0.508 -13.280
  166   HG22  VAL   2          1HG2      VAL   2  -7.568  -0.471 -13.940
  167   HG23  VAL   2          2HG2      VAL   2  -7.236   0.708 -12.670
  168    H    ASN   3           H        ASN   3 -10.236  -2.974 -10.566
  169    HA   ASN   3           HA       ASN   3 -10.461  -2.943  -7.766
  170    HB2  ASN   3           2HB      ASN   3  -9.444  -5.395  -9.192
  171    HB3  ASN   3           1HB      ASN   3 -10.604  -5.285  -7.868
  172   HD21  ASN   3          1HD2      ASN   3 -12.726  -4.049  -8.498
  173   HD22  ASN   3          2HD2      ASN   3 -13.335  -4.344 -10.054
  174    H    GLN   4           H        GLN   4  -8.903  -2.480  -6.281
  175    HA   GLN   4           HA       GLN   4  -6.111  -3.339  -6.899
  176    HB2  GLN   4           2HB      GLN   4  -6.234  -0.927  -7.006
  177    HB3  GLN   4           1HB      GLN   4  -7.101  -0.859  -5.472
  178    HG2  GLN   4           2HG      GLN   4  -4.887  -0.347  -4.864
  179    HG3  GLN   4           1HG      GLN   4  -5.020  -2.063  -4.487
  180   HE21  GLN   4          1HE2      GLN   4  -2.644  -0.307  -5.424
  181   HE22  GLN   4          2HE2      GLN   4  -2.004  -1.167  -6.740
  182    H    HIS   5           H        HIS   5  -5.955  -5.202  -5.671
  183    HA   HIS   5           HA       HIS   5  -6.858  -5.091  -2.838
  184    HD2  HIS   5           HD2      HIS   5  -8.382  -5.177  -5.239
  185    HE1  HIS   5           HE1      HIS   5  -9.728  -9.036  -6.323
  186    HE2  HIS   5           HE2      HIS   5 -10.119  -6.535  -6.619
  187    HB2  HIS   5           2HB      HIS   5  -5.636  -7.501  -4.176
  188    HB3  HIS   5           1HB      HIS   5  -6.738  -7.447  -2.807
  189    H    LEU   6           H        LEU   6  -5.347  -4.893  -1.208
  190    HA   LEU   6           HA       LEU   6  -2.485  -5.287  -1.954
  191    HG   LEU   6           HG       LEU   6  -2.704  -2.216  -2.615
  192    HB2  LEU   6           2HB      LEU   6  -3.853  -2.952  -0.756
  193    HB3  LEU   6           1HB      LEU   6  -2.402  -3.443   0.092
  194   HD11  LEU   6          1HD1      LEU   6  -1.143  -0.795  -1.788
  195   HD12  LEU   6          2HD1      LEU   6  -0.167  -2.100  -1.116
  196   HD13  LEU   6          3HD1      LEU   6  -1.568  -1.498  -0.229
  197   HD21  LEU   6          3HD2      LEU   6  -0.863  -4.520  -2.020
  198   HD22  LEU   6          1HD2      LEU   6  -0.256  -3.191  -2.999
  199   HD23  LEU   6          2HD2      LEU   6  -1.670  -4.101  -3.529
  200    H    CYS   7           H        CYS   7  -1.264  -6.444  -0.525
  201    HA   CYS   7           HA       CYS   7  -1.870  -6.763   2.249
  202    HB2  CYS   7           2HB      CYS   7  -3.805  -8.010   1.038
  203    HB3  CYS   7           1HB      CYS   7  -2.586  -9.221   0.643
  204    H    GLY   8           H        GLY   8  -0.067  -7.694   3.214
  205    HA2  GLY   8           2HA      GLY   8   2.177  -8.424   3.268
  206    HA3  GLY   8           1HA      GLY   8   1.522  -9.789   2.365
  207    H    SER   9           H        SER   9   3.104 -10.114   0.836
  208    HA   SER   9           HA       SER   9   4.816  -8.350  -0.402
  209    HG   SER   9           HG       SER   9   3.289 -11.788  -1.236
  210    HB2  SER   9           2HB      SER   9   4.564  -9.845  -2.477
  211    HB3  SER   9           1HB      SER   9   5.022 -10.643  -0.975
  212    H    ASP  10           H        ASP  10   1.515  -9.091  -1.603
  213    HA   ASP  10           HA       ASP  10   1.489  -7.323  -3.781
  214    HB2  ASP  10           2HB      ASP  10  -0.822  -7.849  -1.889
  215    HB3  ASP  10           1HB      ASP  10  -0.930  -7.334  -3.570
  216    H    LEU  11           H        LEU  11   0.955  -6.684  -0.347
  217    HA   LEU  11           HA       LEU  11   0.071  -3.994  -0.531
  218    HG   LEU  11           HG       LEU  11   1.907  -3.063   2.212
  219    HB2  LEU  11           2HB      LEU  11   0.043  -5.313   1.560
  220    HB3  LEU  11           1HB      LEU  11   1.803  -5.299   1.599
  221   HD11  LEU  11          1HD1      LEU  11   0.789  -1.950   0.473
  222   HD12  LEU  11          2HD1      LEU  11  -0.196  -1.570   1.886
  223   HD13  LEU  11          3HD1      LEU  11  -0.714  -2.826   0.763
  224   HD21  LEU  11          3HD2      LEU  11   0.687  -4.351   3.949
  225   HD22  LEU  11          1HD2      LEU  11  -0.838  -3.881   3.199
  226   HD23  LEU  11          2HD2      LEU  11   0.202  -2.655   3.923
  227    H    VAL  12           H        VAL  12   3.432  -5.219  -0.147
  228    HA   VAL  12           HA       VAL  12   4.596  -2.594  -0.376
  229    HB   VAL  12           HB       VAL  12   6.704  -3.888  -0.936
  230   HG11  VAL  12          1HG1      VAL  12   6.303  -3.299   1.350
  231   HG12  VAL  12          2HG1      VAL  12   6.758  -5.003   1.348
  232   HG13  VAL  12          3HG1      VAL  12   5.065  -4.544   1.518
  233   HG21  VAL  12          3HG2      VAL  12   5.402  -5.801  -1.973
  234   HG22  VAL  12          1HG2      VAL  12   4.954  -6.284  -0.337
  235   HG23  VAL  12          2HG2      VAL  12   6.648  -6.288  -0.824
  236    H    GLU  13           H        GLU  13   3.511  -4.964  -2.705
  237    HA   GLU  13           HA       GLU  13   4.955  -4.074  -4.988
  238    HB2  GLU  13           2HB      GLU  13   3.440  -6.120  -4.807
  239    HB3  GLU  13           1HB      GLU  13   2.078  -5.018  -5.014
  240    HG2  GLU  13           2HG      GLU  13   3.147  -4.206  -7.142
  241    HG3  GLU  13           1HG      GLU  13   4.357  -5.476  -6.959
  242    H    ALA  14           H        ALA  14   1.619  -3.196  -4.034
  243    HA   ALA  14           HA       ALA  14   1.331  -1.083  -5.903
  244    HB1  ALA  14           3HB      ALA  14  -0.567  -0.404  -4.616
  245    HB2  ALA  14           1HB      ALA  14   0.073  -1.152  -3.152
  246    HB3  ALA  14           2HB      ALA  14  -0.488  -2.158  -4.490
  247    H    LEU  15           H        LEU  15   2.694  -1.122  -2.640
  248    HA   LEU  15           HA       LEU  15   3.075   1.748  -2.487
  249    HG   LEU  15           HG       LEU  15   2.106  -0.510  -0.413
  250    HB2  LEU  15           2HB      LEU  15   4.430  -0.520  -0.992
  251    HB3  LEU  15           1HB      LEU  15   4.607   1.186  -0.597
  252   HD11  LEU  15          1HD1      LEU  15   2.350  -0.251   1.852
  253   HD12  LEU  15          2HD1      LEU  15   3.093   1.341   1.695
  254   HD13  LEU  15          3HD1      LEU  15   4.047  -0.111   1.392
  255   HD21  LEU  15          3HD2      LEU  15   0.936   1.587   0.231
  256   HD22  LEU  15          1HD2      LEU  15   1.498   1.657  -1.440
  257   HD23  LEU  15          2HD2      LEU  15   2.382   2.511  -0.175
  258    H    TYR  16           H        TYR  16   4.905  -1.006  -3.657
  259    HA   TYR  16           HA       TYR  16   7.453   0.227  -3.942
  260    HD1  TYR  16           HD2      TYR  16   9.493  -0.562  -4.926
  261    HD2  TYR  16           HD1      TYR  16   6.975  -3.790  -3.616
  262    HE1  TYR  16           HE2      TYR  16  11.406  -1.556  -3.700
  263    HE2  TYR  16           HE1      TYR  16   8.889  -4.783  -2.389
  264    HH   TYR  16           HH       TYR  16  11.865  -4.283  -2.913
  265    HB2  TYR  16           2HB      TYR  16   6.080  -2.146  -4.989
  266    HB3  TYR  16           1HB      TYR  16   7.199  -1.441  -6.154
  267    H    LEU  17           H        LEU  17   4.445   0.734  -5.520
  268    HA   LEU  17           HA       LEU  17   5.713   2.033  -7.859
  269    HG   LEU  17           HG       LEU  17   3.205  -0.103  -6.662
  270    HB2  LEU  17           2HB      LEU  17   2.766   2.164  -7.432
  271    HB3  LEU  17           1HB      LEU  17   3.674   1.872  -8.913
  272   HD11  LEU  17          1HD1      LEU  17   1.334  -0.481  -7.882
  273   HD12  LEU  17          2HD1      LEU  17   2.413  -1.215  -9.068
  274   HD13  LEU  17          3HD1      LEU  17   1.929   0.472  -9.241
  275   HD21  LEU  17          3HD2      LEU  17   4.634  -1.621  -7.754
  276   HD22  LEU  17          1HD2      LEU  17   5.513  -0.097  -7.883
  277   HD23  LEU  17          2HD2      LEU  17   4.601  -0.708  -9.264
  278    H    VAL  18           H        VAL  18   3.572   2.906  -5.112
  279    HA   VAL  18           HA       VAL  18   3.210   5.600  -5.716
  280    HB   VAL  18           HB       VAL  18   3.208   6.005  -3.194
  281   HG11  VAL  18          1HG1      VAL  18   1.247   4.196  -3.024
  282   HG12  VAL  18          2HG1      VAL  18   1.523   4.121  -4.765
  283   HG13  VAL  18          3HG1      VAL  18   1.087   5.653  -4.006
  284   HG21  VAL  18          3HG2      VAL  18   2.944   3.694  -2.008
  285   HG22  VAL  18          1HG2      VAL  18   4.562   4.333  -2.264
  286   HG23  VAL  18          2HG2      VAL  18   3.921   3.104  -3.340
  287    H    CYS  19           H        CYS  19   5.807   4.550  -3.468
  288    HA   CYS  19           HA       CYS  19   7.167   7.043  -4.229
  289    HB2  CYS  19           2HB      CYS  19   7.439   5.279  -1.933
  290    HB3  CYS  19           1HB      CYS  19   8.983   5.768  -2.598
  291    H    GLY  20           H        GLY  20   7.427   3.640  -4.965
  292    HA2  GLY  20           2HA      GLY  20   8.774   2.733  -6.727
  293    HA3  GLY  20           1HA      GLY  20   9.622   4.276  -6.831
  294    H    GLU  21           H        GLU  21  11.736   3.357  -6.642
  295    HA   GLU  21           HA       GLU  21  12.424   1.516  -4.529
  296    HB2  GLU  21           2HB      GLU  21  13.781   2.859  -6.699
  297    HB3  GLU  21           1HB      GLU  21  14.738   2.979  -5.221
  298    HG2  GLU  21           2HG      GLU  21  14.742   0.598  -4.927
  299    HG3  GLU  21           1HG      GLU  21  13.533   0.379  -6.192
  300    H    ARG  22           H        ARG  22  11.597   4.778  -4.471
  301    HA   ARG  22           HA       ARG  22  13.336   5.948  -2.601
  302    HE   ARG  22           HE       ARG  22  11.721   9.315  -5.767
  303    HB2  ARG  22           2HB      ARG  22  10.587   6.390  -3.517
  304    HB3  ARG  22           1HB      ARG  22  10.842   6.886  -1.844
  305    HG2  ARG  22           2HG      ARG  22  12.622   8.362  -2.452
  306    HG3  ARG  22           1HG      ARG  22  12.718   7.684  -4.078
  307    HD2  ARG  22           2HD      ARG  22  10.135   8.452  -4.089
  308    HD3  ARG  22           1HD      ARG  22  10.776   9.638  -2.952
  309   HH11  ARG  22          1HH2      ARG  22  10.123  11.570  -4.134
  310   HH12  ARG  22          2HH2      ARG  22  11.326  12.815  -4.185
  311   HH21  ARG  22          1HH1      ARG  22  13.850  10.698  -5.270
  312   HH22  ARG  22          2HH1      ARG  22  13.437  12.320  -4.825
  313    H    GLY  23           H        GLY  23  11.024   3.405  -2.159
  314    HA2  GLY  23           2HA      GLY  23  11.387   1.969  -0.154
  315    HA3  GLY  23           1HA      GLY  23  11.638   3.450   0.769
  316    H    PHE  24           H        PHE  24   9.863   2.163   2.037
  317    HA   PHE  24           HA       PHE  24   7.355   3.560   1.636
  318    HD1  PHE  24           HD1      PHE  24   8.901   0.303   2.451
  319    HD2  PHE  24           HD2      PHE  24   7.103   0.324  -1.452
  320    HE1  PHE  24           HE1      PHE  24  10.417  -1.529   1.744
  321    HE2  PHE  24           HE2      PHE  24   8.620  -1.507  -2.158
  322    HZ   PHE  24           HZ       PHE  24  10.277  -2.435  -0.562
  323    HB2  PHE  24           2HB      PHE  24   6.175   1.142   1.567
  324    HB3  PHE  24           1HB      PHE  24   6.575   2.035   0.100
  325    H    PHE  25           H        PHE  25   5.638   2.104   3.173
  326    HA   PHE  25           HA       PHE  25   7.151   1.795   5.729
  327    HD1  PHE  25           HD2      PHE  25   7.003   2.471   7.809
  328    HD2  PHE  25           HD1      PHE  25   4.862   5.332   5.417
  329    HE1  PHE  25           HE2      PHE  25   8.134   4.321   9.011
  330    HE2  PHE  25           HE1      PHE  25   5.996   7.180   6.620
  331    HZ   PHE  25           HZ       PHE  25   7.631   6.676   8.416
  332    HB2  PHE  25           2HB      PHE  25   4.568   3.055   5.001
  333    HB3  PHE  25           1HB      PHE  25   4.543   2.103   6.480
  334    H    TYR  26           H        TYR  26   3.911   0.710   4.649
  335    HA   TYR  26           HA       TYR  26   2.926  -1.419   4.760
  336    HD1  TYR  26           HD1      TYR  26   2.427  -3.666   4.029
  337    HD2  TYR  26           HD2      TYR  26   6.560  -4.240   5.070
  338    HE1  TYR  26           HE1      TYR  26   1.966  -6.041   4.554
  339    HE2  TYR  26           HE2      TYR  26   6.094  -6.616   5.591
  340    HH   TYR  26           HH       TYR  26   3.666  -7.889   6.352
  341    HB2  TYR  26           2HB      TYR  26   4.571  -2.140   3.171
  342    HB3  TYR  26           1HB      TYR  26   5.844  -2.123   4.382
  343    H    THR  27           H        THR  27   2.879  -0.310   7.174
  344    HA   THR  27           HA       THR  27   4.425  -1.807   9.154
  345    HB   THR  27           HB       THR  27   3.840   0.427   9.757
  346    HG1  THR  27           HG1      THR  27   2.085  -0.118  11.433
  347   HG21  THR  27          3HG2      THR  27   1.305   0.987   9.885
  348   HG22  THR  27          1HG2      THR  27   1.103  -0.388   8.798
  349   HG23  THR  27          2HG2      THR  27   2.080   0.994   8.301
  350    H    LYS  28           H        LYS  28   3.511  -3.300  10.691
  351    HA   LYS  28           HA       LYS  28   0.799  -4.195  10.628
  352    HB2  LYS  28           2HB      LYS  28   1.322  -5.054   8.412
  353    HB3  LYS  28           1HB      LYS  28   2.781  -5.834   9.019
  354    HG2  LYS  28           2HG      LYS  28   0.960  -7.472   8.770
  355    HG3  LYS  28           1HG      LYS  28   1.398  -7.290  10.465
  356    HD2  LYS  28           2HD      LYS  28  -0.537  -5.346  10.135
  357    HD3  LYS  28           1HD      LYS  28  -1.124  -6.656   9.113
  358    HE2  LYS  28           2HE      LYS  28  -1.305  -8.149  10.893
  359    HE3  LYS  28           1HE      LYS  28  -0.119  -7.283  11.870
  360    HZ1  LYS  28           3HZ      LYS  28  -2.008  -5.422  11.559
  361    HZ2  LYS  28           1HZ      LYS  28  -1.933  -6.480  12.882
  362    HZ3  LYS  28           2HZ      LYS  28  -2.962  -6.827  11.576
  363    HA   PRO  29           HA       PRO  29   3.477  -5.625  14.086
  364    HB2  PRO  29           2HB      PRO  29   2.075  -4.305  16.045
  365    HB3  PRO  29           1HB      PRO  29   3.438  -3.591  15.166
  366    HG2  PRO  29           2HG      PRO  29   0.522  -3.045  14.871
  367    HG3  PRO  29           1HG      PRO  29   1.903  -1.992  14.518
  368    HD2  PRO  29           2HD      PRO  29   0.388  -3.433  12.612
  369    HD3  PRO  29           1HD      PRO  29   1.951  -2.645  12.325
  370    H    THR  30           H        THR  30   2.201  -6.285  16.454
  371    HA   THR  30           HA       THR  30   0.042  -8.131  15.518
  372    HB   THR  30           HB       THR  30   1.045  -8.880  18.092
  373    HG1  THR  30           HG1      THR  30   3.023  -8.221  17.879
  374   HG21  THR  30          3HG2      THR  30   1.111 -10.024  15.302
  375   HG22  THR  30          1HG2      THR  30   0.122 -10.529  16.672
  376   HG23  THR  30          2HG2      THR  30   1.851 -10.873  16.659
  Start of MODEL    6
    1    H1   GLY   1           1H       GLY   1  -2.047   0.002  10.893
    2    H2   GLY   1           2H       GLY   1  -2.615  -1.400  10.122
    3    H3   GLY   1           3H       GLY   1  -3.447  -0.772  11.462
    4    HA2  GLY   1           1HA      GLY   1  -4.671   0.008   9.652
    5    HA3  GLY   1           2HA      GLY   1  -3.667   1.432  10.061
    6    H    ILE   2           H        ILE   2  -1.805  -0.258   8.169
    7    HA   ILE   2           HA       ILE   2  -3.352   0.036   5.679
    8    HB   ILE   2           HB       ILE   2  -1.099   0.903   5.632
    9   HG12  ILE   2          2HG1      ILE   2  -0.006  -0.880   3.976
   10   HG13  ILE   2          1HG1      ILE   2  -1.589  -1.634   4.078
   11   HG21  ILE   2          1HG2      ILE   2  -0.082  -0.245   7.430
   12   HG22  ILE   2          2HG2      ILE   2   0.833  -0.676   5.984
   13   HG23  ILE   2          3HG2      ILE   2  -0.335  -1.811   6.662
   14   HD11  ILE   2          3HD1      ILE   2  -0.766   0.816   2.668
   15   HD12  ILE   2          1HD1      ILE   2  -2.241   1.011   3.617
   16   HD13  ILE   2          2HD1      ILE   2  -2.149  -0.238   2.376
   17    H    THR   3           H        THR   3  -1.834  -2.554   7.575
   18    HA   THR   3           HA       THR   3  -2.509  -4.586   5.589
   19    HB   THR   3           HB       THR   3  -1.643  -4.872   8.481
   20    HG1  THR   3           HG1      THR   3  -0.290  -3.930   6.578
   21   HG21  THR   3          3HG2      THR   3  -0.876  -7.154   7.276
   22   HG22  THR   3          1HG2      THR   3  -2.311  -6.796   6.314
   23   HG23  THR   3          2HG2      THR   3  -2.445  -6.980   8.063
   24    H    GLU   4           H        GLU   4  -4.070  -3.086   8.282
   25    HA   GLU   4           HA       GLU   4  -6.203  -5.171   8.254
   26    HB2  GLU   4           2HB      GLU   4  -5.121  -4.481  10.454
   27    HB3  GLU   4           1HB      GLU   4  -5.886  -2.906  10.237
   28    HG2  GLU   4           2HG      GLU   4  -7.358  -4.233  11.610
   29    HG3  GLU   4           1HG      GLU   4  -8.097  -4.112  10.013
   30    H    GLN   5           H        GLN   5  -5.994  -3.296   6.078
   31    HA   GLN   5           HA       GLN   5  -8.701  -2.250   6.116
   32    HB2  GLN   5           2HB      GLN   5  -7.124  -0.533   7.389
   33    HB3  GLN   5           1HB      GLN   5  -6.649  -0.090   5.748
   34    HG2  GLN   5           2HG      GLN   5  -8.664   0.864   5.286
   35    HG3  GLN   5           1HG      GLN   5  -9.561  -0.379   6.160
   36   HE21  GLN   5          1HE2      GLN   5  -7.957   2.751   6.490
   37   HE22  GLN   5          2HE2      GLN   5  -8.488   3.059   8.073
   38    H    CYS   6           H        CYS   6  -5.490  -2.206   4.644
   39    HA   CYS   6           HA       CYS   6  -6.655  -1.788   1.965
   40    HB2  CYS   6           2HB      CYS   6  -3.820  -2.060   2.981
   41    HB3  CYS   6           1HB      CYS   6  -4.214  -1.943   1.272
   42    H    CYS   7           H        CYS   7  -6.321  -4.351   3.999
   43    HA   CYS   7           HA       CYS   7  -5.982  -6.245   1.715
   44    HB2  CYS   7           2HB      CYS   7  -4.098  -6.394   3.302
   45    HB3  CYS   7           1HB      CYS   7  -5.227  -6.665   4.621
   46    H    THR   8           H        THR   8  -7.548  -5.733   4.886
   47    HA   THR   8           HA       THR   8  -9.361  -7.940   4.667
   48    HB   THR   8           HB       THR   8  -8.966  -6.637   6.773
   49    HG1  THR   8           HG1      THR   8 -10.995  -6.957   7.436
   50   HG21  THR   8          3HG2      THR   8 -10.848  -4.557   6.452
   51   HG22  THR   8          1HG2      THR   8  -9.782  -4.472   5.050
   52   HG23  THR   8          2HG2      THR   8  -9.106  -4.397   6.677
   53    H    SER   9           H        SER   9  -9.235  -4.807   3.214
   54    HA   SER   9           HA       SER   9 -11.761  -5.406   1.745
   55    HG   SER   9           HG       SER   9 -13.312  -3.618   1.547
   56    HB2  SER   9           2HB      SER   9 -12.158  -3.656   3.502
   57    HB3  SER   9           1HB      SER   9 -10.916  -2.665   2.744
   58    H    ILE  10           H        ILE  10 -11.420  -2.857   0.234
   59    HA   ILE  10           HA       ILE  10  -9.063  -3.731  -1.380
   60    HB   ILE  10           HB       ILE  10 -11.439  -2.063  -2.237
   61   HG12  ILE  10          2HG1      ILE  10 -10.715  -4.865  -3.116
   62   HG13  ILE  10          1HG1      ILE  10 -11.781  -4.572  -1.739
   63   HG21  ILE  10          1HG2      ILE  10  -9.038  -3.184  -3.712
   64   HG22  ILE  10          2HG2      ILE  10  -9.459  -1.484  -3.508
   65   HG23  ILE  10          3HG2      ILE  10 -10.462  -2.528  -4.515
   66   HD11  ILE  10          3HD1      ILE  10 -12.927  -2.913  -3.501
   67   HD12  ILE  10          1HD1      ILE  10 -13.374  -4.615  -3.387
   68   HD13  ILE  10          2HD1      ILE  10 -12.246  -4.081  -4.634
   69    H    CYS  11           H        CYS  11  -7.329  -2.378  -1.419
   70    HA   CYS  11           HA       CYS  11  -7.607   0.277  -0.142
   71    HB2  CYS  11           2HB      CYS  11  -5.724  -1.486   0.293
   72    HB3  CYS  11           1HB      CYS  11  -5.026  -0.854  -1.196
   73    H    SER  12           H        SER  12  -6.968   2.218  -1.219
   74    HA   SER  12           HA       SER  12  -7.086   2.022  -4.196
   75    HG   SER  12           HG       SER  12  -7.638   5.215  -1.930
   76    HB2  SER  12           2HB      SER  12  -7.537   4.572  -3.900
   77    HB3  SER  12           1HB      SER  12  -8.823   3.437  -3.501
   78    H    LEU  13           H        LEU  13  -5.284   2.463  -5.334
   79    HA   LEU  13           HA       LEU  13  -2.733   2.825  -4.370
   80    HG   LEU  13           HG       LEU  13  -5.175   4.239  -6.393
   81    HB2  LEU  13           2HB      LEU  13  -2.264   4.122  -6.507
   82    HB3  LEU  13           1HB      LEU  13  -2.995   2.536  -6.697
   83   HD11  LEU  13          1HD1      LEU  13  -4.754   5.925  -8.210
   84   HD12  LEU  13          2HD1      LEU  13  -3.050   5.473  -8.171
   85   HD13  LEU  13          3HD1      LEU  13  -3.799   6.209  -6.754
   86   HD21  LEU  13          3HD2      LEU  13  -5.211   3.851  -8.996
   87   HD22  LEU  13          1HD2      LEU  13  -5.388   2.486  -7.894
   88   HD23  LEU  13          2HD2      LEU  13  -3.829   2.811  -8.652
   89    H    TYR  14           H        TYR  14  -5.184   5.259  -4.887
   90    HA   TYR  14           HA       TYR  14  -3.843   7.656  -4.558
   91    HD1  TYR  14           HD1      TYR  14  -5.148   9.347  -5.715
   92    HD2  TYR  14           HD2      TYR  14  -6.579   9.026  -1.676
   93    HE1  TYR  14           HE1      TYR  14  -5.166  11.821  -5.525
   94    HE2  TYR  14           HE2      TYR  14  -6.596  11.500  -1.486
   95    HH   TYR  14           HH       TYR  14  -6.751  13.464  -3.055
   96    HB2  TYR  14           2HB      TYR  14  -6.381   7.229  -4.722
   97    HB3  TYR  14           1HB      TYR  14  -6.341   7.090  -2.966
   98    H    GLN  15           H        GLN  15  -5.359   6.188  -1.706
   99    HA   GLN  15           HA       GLN  15  -3.642   7.492   0.163
  100    HB2  GLN  15           2HB      GLN  15  -5.563   5.230   0.229
  101    HB3  GLN  15           1HB      GLN  15  -4.371   5.280   1.527
  102    HG2  GLN  15           2HG      GLN  15  -6.067   7.668   0.760
  103    HG3  GLN  15           1HG      GLN  15  -6.539   6.519   2.012
  104   HE21  GLN  15          1HE2      GLN  15  -4.163   6.023   3.357
  105   HE22  GLN  15          2HE2      GLN  15  -3.539   7.461   4.008
  106    H    LEU  16           H        LEU  16  -3.607   4.307  -1.293
  107    HA   LEU  16           HA       LEU  16  -1.538   2.950  -0.131
  108    HG   LEU  16           HG       LEU  16  -1.817   0.650  -2.811
  109    HB2  LEU  16           2HB      LEU  16  -2.903   2.793  -2.524
  110    HB3  LEU  16           1HB      LEU  16  -1.247   3.071  -3.059
  111   HD11  LEU  16          1HD1      LEU  16   0.399   0.496  -2.504
  112   HD12  LEU  16          2HD1      LEU  16   0.142   0.654  -0.767
  113   HD13  LEU  16          3HD1      LEU  16   0.427   2.089  -1.752
  114   HD21  LEU  16          3HD2      LEU  16  -2.987   0.018  -1.003
  115   HD22  LEU  16          1HD2      LEU  16  -2.822   1.627  -0.301
  116   HD23  LEU  16          2HD2      LEU  16  -1.588   0.403   0.000
  117    H    GLU  17           H        GLU  17  -1.210   5.664  -2.384
  118    HA   GLU  17           HA       GLU  17   1.687   5.524  -2.448
  119    HB2  GLU  17           2HB      GLU  17   0.657   6.511  -4.343
  120    HB3  GLU  17           1HB      GLU  17  -0.320   7.588  -3.348
  121    HG2  GLU  17           2HG      GLU  17   1.658   8.836  -2.669
  122    HG3  GLU  17           1HG      GLU  17   2.707   7.692  -3.509
  123    H    ASN  18           H        ASN  18  -0.645   7.119  -0.410
  124    HA   ASN  18           HA       ASN  18   1.140   9.092   0.697
  125    HB2  ASN  18           2HB      ASN  18  -1.336   9.227   0.881
  126    HB3  ASN  18           1HB      ASN  18  -1.309   7.837   1.968
  127   HD21  ASN  18          1HD2      ASN  18   0.135  11.129   1.652
  128   HD22  ASN  18          2HD2      ASN  18   0.181  11.427   3.323
  129    H    TYR  19           H        TYR  19   1.193   5.730   0.976
  130    HA   TYR  19           HA       TYR  19   2.275   5.831   3.739
  131    HD1  TYR  19           HD2      TYR  19   0.586   4.632   5.301
  132    HD2  TYR  19           HD1      TYR  19  -0.457   3.623   1.256
  133    HE1  TYR  19           HE2      TYR  19  -1.815   4.925   5.849
  134    HE2  TYR  19           HE1      TYR  19  -2.860   3.919   1.803
  135    HH   TYR  19           HH       TYR  19  -3.887   5.111   4.980
  136    HB2  TYR  19           2HB      TYR  19   1.784   3.404   1.983
  137    HB3  TYR  19           1HB      TYR  19   2.170   3.401   3.702
  138    H    CYS  20           H        CYS  20   3.728   7.011   1.463
  139    HA   CYS  20           HA       CYS  20   6.060   5.161   1.282
  140    HB2  CYS  20           2HB      CYS  20   4.959   6.431  -0.758
  141    HB3  CYS  20           1HB      CYS  20   5.959   7.759  -0.214
  142    H    ASN  21           H        ASN  21   8.132   6.862   1.000
  143    HA   ASN  21           HA       ASN  21   8.309   8.097   3.686
  144    HB2  ASN  21           2HB      ASN  21  10.126   6.615   3.209
  145    HB3  ASN  21           1HB      ASN  21  10.372   7.322   1.612
  146   HD21  ASN  21          1HD2      ASN  21  11.748   9.142   1.461
  147   HD22  ASN  21          2HD2      ASN  21  12.450   9.908   2.803
  148    HA   PHE   1           HA       PHE   1  -9.895   5.538 -11.352
  149    HD1  PHE   1           HD1      PHE   1  -7.011   7.079  -9.774
  150    HD2  PHE   1           HD2      PHE   1  -7.762   5.656 -13.758
  151    HE1  PHE   1           HE1      PHE   1  -6.310   9.274 -10.689
  152    HE2  PHE   1           HE2      PHE   1  -7.060   7.853 -14.675
  153    HZ   PHE   1           HZ       PHE   1  -6.333   9.662 -13.140
  154    H1   PHE   1           1H       PHE   1  -9.258   6.740  -9.501
  155    H2   PHE   1           2H       PHE   1  -8.480   5.420  -8.768
  156    H3   PHE   1           3H       PHE   1 -10.177   5.489  -8.816
  157    HB2  PHE   1           2HB      PHE   1  -7.204   4.613 -10.338
  158    HB3  PHE   1           1HB      PHE   1  -7.807   4.146 -11.929
  159    H    VAL   2           H        VAL   2  -8.080   2.850  -9.995
  160    HA   VAL   2           HA       VAL   2 -10.600   1.239 -10.006
  161    HB   VAL   2           HB       VAL   2  -7.862   0.219 -10.808
  162   HG11  VAL   2          1HG1      VAL   2  -9.458  -1.469  -9.979
  163   HG12  VAL   2          2HG1      VAL   2  -9.190  -1.660 -11.712
  164   HG13  VAL   2          3HG1      VAL   2 -10.667  -0.893 -11.128
  165   HG21  VAL   2          3HG2      VAL   2  -9.159   0.194 -13.122
  166   HG22  VAL   2          1HG2      VAL   2  -8.313   1.647 -12.589
  167   HG23  VAL   2          2HG2      VAL   2 -10.061   1.518 -12.383
  168    H    ASN   3           H        ASN   3 -10.916   0.008  -8.197
  169    HA   ASN   3           HA       ASN   3  -9.087   0.356  -5.951
  170    HB2  ASN   3           2HB      ASN   3 -11.433  -1.536  -6.017
  171    HB3  ASN   3           1HB      ASN   3 -10.778  -0.641  -4.647
  172   HD21  ASN   3          1HD2      ASN   3 -13.448  -0.269  -4.963
  173   HD22  ASN   3          2HD2      ASN   3 -13.791   1.236  -5.670
  174    H    GLN   4           H        GLN   4  -7.666  -1.174  -5.124
  175    HA   GLN   4           HA       GLN   4  -7.593  -3.838  -6.473
  176    HB2  GLN   4           2HB      GLN   4  -5.869  -2.787  -7.638
  177    HB3  GLN   4           1HB      GLN   4  -5.454  -1.740  -6.287
  178    HG2  GLN   4           2HG      GLN   4  -3.916  -3.205  -5.509
  179    HG3  GLN   4           1HG      GLN   4  -5.031  -4.565  -5.652
  180   HE21  GLN   4          1HE2      GLN   4  -3.023  -5.727  -6.500
  181   HE22  GLN   4          2HE2      GLN   4  -2.640  -5.558  -8.145
  182    H    HIS   5           H        HIS   5  -7.213  -5.527  -5.075
  183    HA   HIS   5           HA       HIS   5  -7.292  -5.083  -2.233
  184    HD2  HIS   5           HD2      HIS   5  -9.142  -6.433  -0.919
  185    HE1  HIS   5           HE1      HIS   5 -11.518  -7.940  -4.071
  186    HE2  HIS   5           HE2      HIS   5 -11.558  -6.995  -1.701
  187    HB2  HIS   5           2HB      HIS   5  -6.816  -7.491  -3.981
  188    HB3  HIS   5           1HB      HIS   5  -6.650  -7.606  -2.229
  189    H    LEU   6           H        LEU   6  -5.619  -5.296  -0.686
  190    HA   LEU   6           HA       LEU   6  -2.846  -5.600  -1.716
  191    HG   LEU   6           HG       LEU   6  -3.021  -2.577  -2.454
  192    HB2  LEU   6           2HB      LEU   6  -4.085  -3.219  -0.509
  193    HB3  LEU   6           1HB      LEU   6  -2.603  -3.711   0.279
  194   HD11  LEU   6          1HD1      LEU   6  -0.423  -2.421  -1.069
  195   HD12  LEU   6          2HD1      LEU   6  -1.780  -1.792  -0.135
  196   HD13  LEU   6          3HD1      LEU   6  -1.429  -1.134  -1.733
  197   HD21  LEU   6          3HD2      LEU   6  -1.150  -4.856  -1.826
  198   HD22  LEU   6          1HD2      LEU   6  -0.609  -3.585  -2.920
  199   HD23  LEU   6          2HD2      LEU   6  -2.045  -4.532  -3.311
  200    H    CYS   7           H        CYS   7  -1.541  -6.795  -0.406
  201    HA   CYS   7           HA       CYS   7  -2.135  -7.027   2.460
  202    HB2  CYS   7           2HB      CYS   7  -2.204  -9.518   0.716
  203    HB3  CYS   7           1HB      CYS   7  -2.420  -9.456   2.463
  204    H    GLY   8           H        GLY   8  -0.286  -7.446   3.574
  205    HA2  GLY   8           2HA      GLY   8   2.116  -7.327   3.714
  206    HA3  GLY   8           1HA      GLY   8   1.810  -9.031   3.410
  207    H    SER   9           H        SER   9   2.941  -9.879   1.765
  208    HA   SER   9           HA       SER   9   4.823  -8.622   0.197
  209    HG   SER   9           HG       SER   9   2.987 -12.127  -0.401
  210    HB2  SER   9           2HB      SER   9   3.896 -10.487  -1.584
  211    HB3  SER   9           1HB      SER   9   4.982 -10.845  -0.244
  212    H    ASP  10           H        ASP  10   1.404  -9.124  -0.765
  213    HA   ASP  10           HA       ASP  10   1.688  -7.641  -3.224
  214    HB2  ASP  10           2HB      ASP  10  -0.655  -8.550  -1.557
  215    HB3  ASP  10           1HB      ASP  10  -0.898  -7.471  -2.927
  216    H    LEU  11           H        LEU  11   1.142  -6.789   0.096
  217    HA   LEU  11           HA       LEU  11   0.021  -4.189  -0.209
  218    HG   LEU  11           HG       LEU  11   1.576  -2.918   2.597
  219    HB2  LEU  11           2HB      LEU  11   0.335  -5.517   1.947
  220    HB3  LEU  11           1HB      LEU  11   2.026  -5.046   1.904
  221   HD11  LEU  11          1HD1      LEU  11   0.472  -2.166   0.597
  222   HD12  LEU  11          2HD1      LEU  11  -0.544  -1.703   1.962
  223   HD13  LEU  11          3HD1      LEU  11  -0.971  -3.104   0.979
  224   HD21  LEU  11          3HD2      LEU  11   0.146  -4.693   3.965
  225   HD22  LEU  11          1HD2      LEU  11  -1.201  -3.768   3.302
  226   HD23  LEU  11          2HD2      LEU  11   0.012  -2.966   4.299
  227    H    VAL  12           H        VAL  12   3.408  -5.283  -0.119
  228    HA   VAL  12           HA       VAL  12   4.459  -2.611  -0.510
  229    HB   VAL  12           HB       VAL  12   6.579  -3.853  -1.080
  230   HG11  VAL  12          1HG1      VAL  12   5.383  -3.389   1.343
  231   HG12  VAL  12          2HG1      VAL  12   7.024  -4.001   1.144
  232   HG13  VAL  12          3HG1      VAL  12   5.694  -5.123   1.429
  233   HG21  VAL  12          3HG2      VAL  12   5.216  -5.864  -1.933
  234   HG22  VAL  12          1HG2      VAL  12   5.042  -6.308  -0.235
  235   HG23  VAL  12          2HG2      VAL  12   6.645  -6.220  -0.963
  236    H    GLU  13           H        GLU  13   3.353  -5.196  -2.601
  237    HA   GLU  13           HA       GLU  13   4.601  -4.450  -5.029
  238    HB2  GLU  13           2HB      GLU  13   3.053  -6.450  -4.604
  239    HB3  GLU  13           1HB      GLU  13   1.709  -5.327  -4.809
  240    HG2  GLU  13           2HG      GLU  13   2.266  -4.884  -7.061
  241    HG3  GLU  13           1HG      GLU  13   3.894  -5.538  -6.877
  242    H    ALA  14           H        ALA  14   1.528  -3.316  -3.622
  243    HA   ALA  14           HA       ALA  14   1.027  -1.331  -5.644
  244    HB1  ALA  14           3HB      ALA  14   0.104  -1.445  -2.761
  245    HB2  ALA  14           1HB      ALA  14  -0.733  -2.180  -4.127
  246    HB3  ALA  14           2HB      ALA  14  -0.595  -0.426  -4.018
  247    H    LEU  15           H        LEU  15   2.601  -1.274  -2.484
  248    HA   LEU  15           HA       LEU  15   3.164   1.562  -2.473
  249    HG   LEU  15           HG       LEU  15   2.154  -0.413  -0.277
  250    HB2  LEU  15           2HB      LEU  15   4.462  -0.774  -1.021
  251    HB3  LEU  15           1HB      LEU  15   4.863   0.907  -0.711
  252   HD11  LEU  15          1HD1      LEU  15   2.649  -0.340   1.978
  253   HD12  LEU  15          2HD1      LEU  15   3.771   1.009   1.799
  254   HD13  LEU  15          3HD1      LEU  15   4.262  -0.617   1.321
  255   HD21  LEU  15          3HD2      LEU  15   1.355   1.728   0.454
  256   HD22  LEU  15          1HD2      LEU  15   2.136   2.034  -1.094
  257   HD23  LEU  15          2HD2      LEU  15   2.972   2.428   0.404
  258    H    TYR  16           H        TYR  16   4.699  -1.218  -3.915
  259    HA   TYR  16           HA       TYR  16   7.318  -0.083  -4.243
  260    HD1  TYR  16           HD2      TYR  16   9.364  -1.228  -5.735
  261    HD2  TYR  16           HD1      TYR  16   6.809  -3.690  -3.311
  262    HE1  TYR  16           HE2      TYR  16  11.354  -2.137  -4.562
  263    HE2  TYR  16           HE1      TYR  16   8.796  -4.598  -2.138
  264    HH   TYR  16           HH       TYR  16  11.003  -4.381  -1.828
  265    HB2  TYR  16           2HB      TYR  16   5.886  -2.469  -5.088
  266    HB3  TYR  16           1HB      TYR  16   6.920  -1.850  -6.374
  267    H    LEU  17           H        LEU  17   4.646  -0.439  -6.615
  268    HA   LEU  17           HA       LEU  17   5.948   1.096  -8.640
  269    HG   LEU  17           HG       LEU  17   2.989   0.306  -6.887
  270    HB2  LEU  17           2HB      LEU  17   3.627   1.341  -9.602
  271    HB3  LEU  17           1HB      LEU  17   4.111  -0.320  -9.264
  272   HD11  LEU  17          1HD1      LEU  17   1.369   1.912  -6.981
  273   HD12  LEU  17          2HD1      LEU  17   0.996   1.582  -8.673
  274   HD13  LEU  17          3HD1      LEU  17   2.400   2.564  -8.254
  275   HD21  LEU  17          3HD2      LEU  17   2.388  -1.645  -8.186
  276   HD22  LEU  17          1HD2      LEU  17   1.625  -0.645  -9.423
  277   HD23  LEU  17          2HD2      LEU  17   0.902  -0.771  -7.819
  278    H    VAL  18           H        VAL  18   4.084   2.098  -5.831
  279    HA   VAL  18           HA       VAL  18   3.780   4.836  -6.863
  280    HB   VAL  18           HB       VAL  18   2.794   5.333  -4.676
  281   HG11  VAL  18          1HG1      VAL  18   0.830   4.265  -5.134
  282   HG12  VAL  18          2HG1      VAL  18   1.598   2.679  -5.220
  283   HG13  VAL  18          3HG1      VAL  18   1.691   3.780  -6.595
  284   HG21  VAL  18          3HG2      VAL  18   4.118   4.074  -3.166
  285   HG22  VAL  18          1HG2      VAL  18   3.810   2.573  -4.034
  286   HG23  VAL  18          2HG2      VAL  18   2.521   3.326  -3.100
  287    H    CYS  19           H        CYS  19   5.588   3.220  -4.308
  288    HA   CYS  19           HA       CYS  19   6.985   5.564  -3.421
  289    HB2  CYS  19           2HB      CYS  19   7.343   2.603  -3.078
  290    HB3  CYS  19           1HB      CYS  19   8.643   3.686  -2.592
  291    H    GLY  20           H        GLY  20   8.192   2.755  -5.273
  292    HA2  GLY  20           2HA      GLY  20   9.752   2.720  -7.064
  293    HA3  GLY  20           1HA      GLY  20   9.777   4.487  -7.030
  294    H    GLU  21           H        GLU  21  12.105   4.575  -7.016
  295    HA   GLU  21           HA       GLU  21  13.623   3.154  -4.989
  296    HB2  GLU  21           2HB      GLU  21  14.434   4.129  -7.278
  297    HB3  GLU  21           1HB      GLU  21  14.632   5.628  -6.370
  298    HG2  GLU  21           2HG      GLU  21  16.735   4.444  -6.275
  299    HG3  GLU  21           1HG      GLU  21  15.987   4.326  -4.682
  300    H    ARG  22           H        ARG  22  11.465   5.614  -4.653
  301    HA   ARG  22           HA       ARG  22  12.919   7.403  -2.914
  302    HE   ARG  22           HE       ARG  22  10.574  11.672  -1.878
  303    HB2  ARG  22           2HB      ARG  22  10.827   8.061  -4.075
  304    HB3  ARG  22           1HB      ARG  22   9.934   6.903  -3.088
  305    HG2  ARG  22           2HG      ARG  22  10.247   8.132  -1.124
  306    HG3  ARG  22           1HG      ARG  22  11.662   8.972  -1.760
  307    HD2  ARG  22           2HD      ARG  22   9.356   9.512  -3.418
  308    HD3  ARG  22           1HD      ARG  22   9.004   9.910  -1.736
  309   HH11  ARG  22          1HH2      ARG  22   9.918  10.855  -4.949
  310   HH12  ARG  22          2HH2      ARG  22  11.479  11.198  -5.619
  311   HH21  ARG  22          1HH1      ARG  22  13.028  11.511  -2.533
  312   HH22  ARG  22          2HH1      ARG  22  13.237  11.571  -4.252
  313    H    GLY  23           H        GLY  23  11.572   4.268  -2.494
  314    HA2  GLY  23           2HA      GLY  23  12.041   2.940  -0.529
  315    HA3  GLY  23           1HA      GLY  23  12.237   4.427   0.395
  316    H    PHE  24           H        PHE  24  10.352   1.871   0.399
  317    HA   PHE  24           HA       PHE  24   7.831   3.420   0.835
  318    HD1  PHE  24           HD1      PHE  24   7.385  -0.652   1.808
  319    HD2  PHE  24           HD2      PHE  24   9.656   0.639  -1.605
  320    HE1  PHE  24           HE1      PHE  24   8.665  -2.775   1.855
  321    HE2  PHE  24           HE2      PHE  24  10.937  -1.483  -1.558
  322    HZ   PHE  24           HZ       PHE  24  10.444  -3.191   0.174
  323    HB2  PHE  24           2HB      PHE  24   6.658   1.251   0.439
  324    HB3  PHE  24           1HB      PHE  24   7.598   1.771  -0.959
  325    H    PHE  25           H        PHE  25   6.404   2.472   2.560
  326    HA   PHE  25           HA       PHE  25   7.925   1.053   4.695
  327    HD1  PHE  25           HD2      PHE  25   6.583   0.886   7.035
  328    HD2  PHE  25           HD1      PHE  25   9.126   4.321   6.576
  329    HE1  PHE  25           HE2      PHE  25   7.666   0.376   9.207
  330    HE2  PHE  25           HE1      PHE  25  10.210   3.809   8.746
  331    HZ   PHE  25           HZ       PHE  25   9.479   1.838  10.064
  332    HB2  PHE  25           2HB      PHE  25   7.680   3.730   4.840
  333    HB3  PHE  25           1HB      PHE  25   6.114   3.286   5.515
  334    H    TYR  26           H        TYR  26   6.615  -0.820   4.337
  335    HA   TYR  26           HA       TYR  26   3.686  -0.483   4.477
  336    HD1  TYR  26           HD1      TYR  26   2.812  -4.016   5.125
  337    HD2  TYR  26           HD2      TYR  26   6.965  -3.595   4.086
  338    HE1  TYR  26           HE1      TYR  26   3.321  -6.124   6.315
  339    HE2  TYR  26           HE2      TYR  26   7.469  -5.703   5.283
  340    HH   TYR  26           HH       TYR  26   5.901  -7.018   7.453
  341    HB2  TYR  26           2HB      TYR  26   3.557  -2.456   3.348
  342    HB3  TYR  26           1HB      TYR  26   5.263  -2.199   3.030
  343    H    THR  27           H        THR  27   3.279   0.140   6.644
  344    HA   THR  27           HA       THR  27   4.485  -1.365   8.841
  345    HB   THR  27           HB       THR  27   3.370   0.153  10.260
  346    HG1  THR  27           HG1      THR  27   1.625   0.934   8.198
  347   HG21  THR  27          3HG2      THR  27   4.696   1.101   7.984
  348   HG22  THR  27          1HG2      THR  27   4.389   1.998   9.470
  349   HG23  THR  27          2HG2      THR  27   3.259   2.115   8.121
  350    H    LYS  28           H        LYS  28   2.644  -2.010  10.622
  351    HA   LYS  28           HA       LYS  28   0.209  -3.139   9.654
  352    HB2  LYS  28           2HB      LYS  28   1.074  -5.609  10.047
  353    HB3  LYS  28           1HB      LYS  28   1.249  -4.843   8.471
  354    HG2  LYS  28           2HG      LYS  28   3.413  -5.575   8.745
  355    HG3  LYS  28           1HG      LYS  28   3.563  -4.026   9.567
  356    HD2  LYS  28           2HD      LYS  28   3.464  -5.002  11.701
  357    HD3  LYS  28           1HD      LYS  28   2.709  -6.476  11.092
  358    HE2  LYS  28           2HE      LYS  28   4.707  -7.428  10.626
  359    HE3  LYS  28           1HE      LYS  28   5.310  -5.960   9.857
  360    HZ1  LYS  28           3HZ      LYS  28   6.191  -6.912  12.201
  361    HZ2  LYS  28           1HZ      LYS  28   5.025  -5.799  12.728
  362    HZ3  LYS  28           2HZ      LYS  28   6.299  -5.284  11.730
  363    HA   PRO  29           HA       PRO  29  -0.211  -3.210  14.026
  364    HB2  PRO  29           2HB      PRO  29  -2.681  -4.414  14.123
  365    HB3  PRO  29           1HB      PRO  29  -2.432  -2.714  13.689
  366    HG2  PRO  29           2HG      PRO  29  -3.083  -5.027  11.920
  367    HG3  PRO  29           1HG      PRO  29  -3.438  -3.306  11.696
  368    HD2  PRO  29           2HD      PRO  29  -1.354  -4.737  10.434
  369    HD3  PRO  29           1HD      PRO  29  -1.513  -2.971  10.500
  370    H    THR  30           H        THR  30  -1.544  -5.180  15.501
  371    HA   THR  30           HA       THR  30  -0.984  -7.200  16.580
  372    HB   THR  30           HB       THR  30  -0.889  -9.147  14.898
  373    HG1  THR  30           HG1      THR  30  -1.741  -7.143  13.105
  374   HG21  THR  30          3HG2      THR  30  -3.377  -8.207  14.106
  375   HG22  THR  30          1HG2      THR  30  -3.065  -7.329  15.604
  376   HG23  THR  30          2HG2      THR  30  -3.036  -9.092  15.592
  Start of MODEL    7
    1    H1   GLY   1           1H       GLY   1  -4.396  -1.729  10.435
    2    H2   GLY   1           2H       GLY   1  -5.808  -0.799  10.272
    3    H3   GLY   1           3H       GLY   1  -4.674  -0.420  11.479
    4    HA2  GLY   1           1HA      GLY   1  -4.657   0.872   9.223
    5    HA3  GLY   1           2HA      GLY   1  -3.121   0.554  10.084
    6    H    ILE   2           H        ILE   2  -2.058  -0.533   8.172
    7    HA   ILE   2           HA       ILE   2  -3.516  -0.412   5.599
    8    HB   ILE   2           HB       ILE   2  -1.173   0.551   5.977
    9   HG12  ILE   2          2HG1      ILE   2  -1.664  -1.451   3.751
   10   HG13  ILE   2          1HG1      ILE   2  -2.107   0.255   3.734
   11   HG21  ILE   2          1HG2      ILE   2  -0.435  -1.583   7.185
   12   HG22  ILE   2          2HG2      ILE   2   0.688  -0.892   6.017
   13   HG23  ILE   2          3HG2      ILE   2  -0.285  -2.294   5.578
   14   HD11  ILE   2          3HD1      ILE   2   0.094   0.965   3.466
   15   HD12  ILE   2          1HD1      ILE   2   0.128  -0.553   2.569
   16   HD13  ILE   2          2HD1      ILE   2   0.762  -0.487   4.211
   17    H    THR   3           H        THR   3  -1.787  -2.766   7.631
   18    HA   THR   3           HA       THR   3  -2.282  -4.951   5.760
   19    HB   THR   3           HB       THR   3  -1.299  -4.878   8.625
   20    HG1  THR   3           HG1      THR   3  -0.031  -5.483   6.161
   21   HG21  THR   3          3HG2      THR   3  -2.299  -7.095   7.021
   22   HG22  THR   3          1HG2      THR   3  -1.850  -7.060   8.727
   23   HG23  THR   3          2HG2      THR   3  -0.617  -7.334   7.496
   24    H    GLU   4           H        GLU   4  -4.073  -3.356   8.197
   25    HA   GLU   4           HA       GLU   4  -5.925  -5.681   8.461
   26    HB2  GLU   4           2HB      GLU   4  -4.933  -3.832  10.342
   27    HB3  GLU   4           1HB      GLU   4  -6.626  -3.406  10.104
   28    HG2  GLU   4           2HG      GLU   4  -7.351  -5.626  10.660
   29    HG3  GLU   4           1HG      GLU   4  -5.697  -6.240  10.622
   30    H    GLN   5           H        GLN   5  -5.764  -3.937   6.072
   31    HA   GLN   5           HA       GLN   5  -8.611  -3.403   5.811
   32    HB2  GLN   5           2HB      GLN   5  -7.463  -1.334   7.025
   33    HB3  GLN   5           1HB      GLN   5  -6.939  -0.948   5.384
   34    HG2  GLN   5           2HG      GLN   5  -9.815  -1.510   6.154
   35    HG3  GLN   5           1HG      GLN   5  -9.129   0.109   6.008
   36   HE21  GLN   5          1HE2      GLN   5  -8.251   0.707   3.806
   37   HE22  GLN   5          2HE2      GLN   5  -8.926  -0.022   2.430
   38    H    CYS   6           H        CYS   6  -5.342  -2.832   4.541
   39    HA   CYS   6           HA       CYS   6  -6.295  -2.757   1.784
   40    HB2  CYS   6           2HB      CYS   6  -3.536  -2.879   3.004
   41    HB3  CYS   6           1HB      CYS   6  -3.810  -2.882   1.270
   42    H    CYS   7           H        CYS   7  -5.388  -5.171   4.029
   43    HA   CYS   7           HA       CYS   7  -5.263  -7.136   1.795
   44    HB2  CYS   7           2HB      CYS   7  -3.247  -6.999   3.270
   45    HB3  CYS   7           1HB      CYS   7  -4.261  -7.474   4.622
   46    H    THR   8           H        THR   8  -7.613  -5.950   2.864
   47    HA   THR   8           HA       THR   8  -9.033  -8.418   3.720
   48    HB   THR   8           HB       THR   8  -9.166  -5.673   4.997
   49    HG1  THR   8           HG1      THR   8  -8.976  -8.321   5.991
   50   HG21  THR   8          3HG2      THR   8 -11.453  -6.063   4.676
   51   HG22  THR   8          1HG2      THR   8 -11.167  -6.802   6.252
   52   HG23  THR   8          2HG2      THR   8 -11.272  -7.812   4.809
   53    H    SER   9           H        SER   9  -9.215  -5.098   2.481
   54    HA   SER   9           HA       SER   9 -11.328  -5.991   0.576
   55    HG   SER   9           HG       SER   9 -12.129  -4.293   3.557
   56    HB2  SER   9           2HB      SER   9 -11.314  -3.282   1.933
   57    HB3  SER   9           1HB      SER   9 -12.573  -3.954   0.901
   58    H    ILE  10           H        ILE  10 -11.002  -2.772   0.058
   59    HA   ILE  10           HA       ILE  10  -8.503  -3.073  -1.543
   60    HB   ILE  10           HB       ILE  10 -11.182  -2.001  -2.450
   61   HG12  ILE  10          2HG1      ILE  10  -9.549  -3.872  -4.069
   62   HG13  ILE  10          1HG1      ILE  10 -10.181  -4.529  -2.559
   63   HG21  ILE  10          1HG2      ILE  10  -9.938  -0.461  -3.580
   64   HG22  ILE  10          2HG2      ILE  10  -9.529  -1.820  -4.626
   65   HG23  ILE  10          3HG2      ILE  10  -8.436  -1.347  -3.325
   66   HD11  ILE  10          3HD1      ILE  10 -12.379  -3.228  -3.482
   67   HD12  ILE  10          1HD1      ILE  10 -12.041  -4.927  -3.817
   68   HD13  ILE  10          2HD1      ILE  10 -11.622  -3.693  -5.005
   69    H    CYS  11           H        CYS  11  -7.197  -1.219  -1.567
   70    HA   CYS  11           HA       CYS  11  -8.168   1.015   0.161
   71    HB2  CYS  11           2HB      CYS  11  -5.377   0.062  -0.523
   72    HB3  CYS  11           1HB      CYS  11  -5.695   1.573   0.324
   73    H    SER  12           H        SER  12  -6.764   3.135  -0.510
   74    HA   SER  12           HA       SER  12  -7.287   3.528  -3.433
   75    HG   SER  12           HG       SER  12  -7.026   5.252  -0.301
   76    HB2  SER  12           2HB      SER  12  -7.253   6.048  -2.423
   77    HB3  SER  12           1HB      SER  12  -8.717   5.082  -2.580
   78    H    LEU  13           H        LEU  13  -5.351   3.308  -4.381
   79    HA   LEU  13           HA       LEU  13  -2.761   3.601  -3.589
   80    HG   LEU  13           HG       LEU  13  -4.477   2.528  -5.781
   81    HB2  LEU  13           2HB      LEU  13  -3.148   5.226  -5.989
   82    HB3  LEU  13           1HB      LEU  13  -2.216   3.756  -5.770
   83   HD11  LEU  13          1HD1      LEU  13  -6.298   3.880  -5.859
   84   HD12  LEU  13          2HD1      LEU  13  -5.830   4.277  -7.512
   85   HD13  LEU  13          3HD1      LEU  13  -5.299   5.299  -6.176
   86   HD21  LEU  13          3HD2      LEU  13  -2.713   3.436  -7.806
   87   HD22  LEU  13          1HD2      LEU  13  -4.348   3.526  -8.456
   88   HD23  LEU  13          2HD2      LEU  13  -3.734   1.997  -7.823
   89    H    TYR  14           H        TYR  14  -4.834   6.261  -4.594
   90    HA   TYR  14           HA       TYR  14  -3.152   8.440  -4.296
   91    HD1  TYR  14           HD1      TYR  14  -3.475  10.740  -4.305
   92    HD2  TYR  14           HD2      TYR  14  -7.123   9.675  -2.301
   93    HE1  TYR  14           HE1      TYR  14  -3.549  12.983  -3.246
   94    HE2  TYR  14           HE2      TYR  14  -7.200  11.919  -1.244
   95    HH   TYR  14           HH       TYR  14  -6.161  14.327  -1.971
   96    HB2  TYR  14           2HB      TYR  14  -5.348   8.818  -5.091
   97    HB3  TYR  14           1HB      TYR  14  -6.071   8.096  -3.658
   98    H    GLN  15           H        GLN  15  -5.285   7.330  -1.656
   99    HA   GLN  15           HA       GLN  15  -3.807   8.772   0.369
  100    HB2  GLN  15           2HB      GLN  15  -6.034   6.835   0.298
  101    HB3  GLN  15           1HB      GLN  15  -5.029   6.725   1.741
  102    HG2  GLN  15           2HG      GLN  15  -6.111   9.363   0.730
  103    HG3  GLN  15           1HG      GLN  15  -7.008   8.351   1.862
  104   HE21  GLN  15          1HE2      GLN  15  -4.690  10.830   1.692
  105   HE22  GLN  15          2HE2      GLN  15  -4.074  10.696   3.268
  106    H    LEU  16           H        LEU  16  -3.884   5.452  -0.743
  107    HA   LEU  16           HA       LEU  16  -2.165   4.067   0.902
  108    HG   LEU  16           HG       LEU  16  -0.213   2.941  -0.876
  109    HB2  LEU  16           2HB      LEU  16  -3.207   3.156  -1.144
  110    HB3  LEU  16           1HB      LEU  16  -2.128   4.146  -2.118
  111   HD11  LEU  16          1HD1      LEU  16  -2.592   1.661   0.203
  112   HD12  LEU  16          2HD1      LEU  16  -0.917   1.527   0.739
  113   HD13  LEU  16          3HD1      LEU  16  -1.515   0.491  -0.553
  114   HD21  LEU  16          3HD2      LEU  16  -1.173   2.596  -3.288
  115   HD22  LEU  16          1HD2      LEU  16  -1.836   1.105  -2.618
  116   HD23  LEU  16          2HD2      LEU  16  -0.093   1.376  -2.613
  117    H    GLU  17           H        GLU  17  -1.323   6.561  -1.435
  118    HA   GLU  17           HA       GLU  17   1.517   6.147  -1.297
  119    HB2  GLU  17           2HB      GLU  17   0.812   7.284  -3.217
  120    HB3  GLU  17           1HB      GLU  17  -0.261   8.342  -2.309
  121    HG2  GLU  17           2HG      GLU  17   1.675   9.502  -1.336
  122    HG3  GLU  17           1HG      GLU  17   2.772   8.402  -2.172
  123    H    ASN  18           H        ASN  18  -0.569   7.296   1.047
  124    HA   ASN  18           HA       ASN  18   1.245   9.327   2.111
  125    HB2  ASN  18           2HB      ASN  18  -1.353   9.131   2.444
  126    HB3  ASN  18           1HB      ASN  18  -0.919   8.014   3.740
  127   HD21  ASN  18          1HD2      ASN  18  -1.352   9.343   5.568
  128   HD22  ASN  18          2HD2      ASN  18  -0.573  10.824   5.852
  129    H    TYR  19           H        TYR  19   1.305   5.999   2.002
  130    HA   TYR  19           HA       TYR  19   2.768   5.800   4.590
  131    HD1  TYR  19           HD2      TYR  19   1.119   5.561   5.836
  132    HD2  TYR  19           HD1      TYR  19  -0.364   2.897   2.813
  133    HE1  TYR  19           HE2      TYR  19  -1.182   5.864   6.694
  134    HE2  TYR  19           HE1      TYR  19  -2.665   3.194   3.666
  135    HH   TYR  19           HH       TYR  19  -3.628   5.626   5.548
  136    HB2  TYR  19           2HB      TYR  19   1.869   3.558   2.760
  137    HB3  TYR  19           1HB      TYR  19   2.479   3.403   4.405
  138    H    CYS  20           H        CYS  20   3.469   6.619   1.523
  139    HA   CYS  20           HA       CYS  20   5.681   4.748   1.090
  140    HB2  CYS  20           2HB      CYS  20   5.869   5.653  -0.991
  141    HB3  CYS  20           1HB      CYS  20   4.317   6.299  -0.667
  142    H    ASN  21           H        ASN  21   7.851   6.017   0.527
  143    HA   ASN  21           HA       ASN  21   8.569   7.406   3.069
  144    HB2  ASN  21           2HB      ASN  21   9.900   5.404   2.492
  145    HB3  ASN  21           1HB      ASN  21  10.369   6.160   0.969
  146   HD21  ASN  21          1HD2      ASN  21  12.027   7.767   1.023
  147   HD22  ASN  21          2HD2      ASN  21  12.842   8.209   2.445
  148    HA   PHE   1           HA       PHE   1 -11.519   4.663 -11.140
  149    HD1  PHE   1           HD1      PHE   1  -8.136   2.621 -12.626
  150    HD2  PHE   1           HD2      PHE   1  -8.283   6.884 -12.099
  151    HE1  PHE   1           HE1      PHE   1  -5.666   2.679 -12.400
  152    HE2  PHE   1           HE2      PHE   1  -5.812   6.941 -11.873
  153    HZ   PHE   1           HZ       PHE   1  -4.504   4.838 -12.023
  154    H1   PHE   1           1H       PHE   1  -8.743   4.384 -10.118
  155    H2   PHE   1           2H       PHE   1 -10.146   4.425  -9.163
  156    H3   PHE   1           3H       PHE   1  -9.689   5.791 -10.063
  157    HB2  PHE   1           2HB      PHE   1 -10.144   4.025 -13.309
  158    HB3  PHE   1           1HB      PHE   1 -10.233   5.701 -12.773
  159    H    VAL   2           H        VAL   2  -8.731   2.565 -10.494
  160    HA   VAL   2           HA       VAL   2 -10.524   0.225 -11.027
  161    HB   VAL   2           HB       VAL   2  -7.546   0.551 -11.463
  162   HG11  VAL   2          1HG1      VAL   2  -9.245  -1.953 -11.370
  163   HG12  VAL   2          2HG1      VAL   2  -7.806  -1.597 -10.416
  164   HG13  VAL   2          3HG1      VAL   2  -7.664  -1.891 -12.149
  165   HG21  VAL   2          3HG2      VAL   2  -8.087   0.675 -13.656
  166   HG22  VAL   2          1HG2      VAL   2  -9.758   0.894 -13.135
  167   HG23  VAL   2          2HG2      VAL   2  -9.163  -0.718 -13.536
  168    H    ASN   3           H        ASN   3 -11.188  -0.331  -8.954
  169    HA   ASN   3           HA       ASN   3  -9.902   0.051  -6.524
  170    HB2  ASN   3           2HB      ASN   3 -11.445  -2.429  -7.355
  171    HB3  ASN   3           1HB      ASN   3 -11.121  -1.935  -5.693
  172   HD21  ASN   3          1HD2      ASN   3 -13.801  -2.171  -6.465
  173   HD22  ASN   3          2HD2      ASN   3 -14.500  -0.630  -6.605
  174    H    GLN   4           H        GLN   4  -8.143  -0.898  -5.471
  175    HA   GLN   4           HA       GLN   4  -6.788  -3.104  -6.964
  176    HB2  GLN   4           2HB      GLN   4  -5.338  -1.314  -7.334
  177    HB3  GLN   4           1HB      GLN   4  -5.711  -0.559  -5.788
  178    HG2  GLN   4           2HG      GLN   4  -4.033  -1.657  -4.735
  179    HG3  GLN   4           1HG      GLN   4  -4.461  -3.197  -5.479
  180   HE21  GLN   4          1HE2      GLN   4  -1.767  -2.717  -5.324
  181   HE22  GLN   4          2HE2      GLN   4  -1.132  -2.285  -6.838
  182    H    HIS   5           H        HIS   5  -6.322  -4.890  -5.781
  183    HA   HIS   5           HA       HIS   5  -6.980  -4.883  -2.901
  184    HD2  HIS   5           HD2      HIS   5  -9.624  -6.013  -4.478
  185    HE1  HIS   5           HE1      HIS   5  -8.313  -7.461  -8.229
  186    HE2  HIS   5           HE2      HIS   5 -10.296  -6.498  -6.944
  187    HB2  HIS   5           2HB      HIS   5  -5.873  -7.329  -4.182
  188    HB3  HIS   5           1HB      HIS   5  -7.249  -7.161  -3.094
  189    H    LEU   6           H        LEU   6  -5.396  -5.650  -1.315
  190    HA   LEU   6           HA       LEU   6  -2.570  -5.648  -2.217
  191    HG   LEU   6           HG       LEU   6  -2.802  -2.581  -2.395
  192    HB2  LEU   6           2HB      LEU   6  -3.920  -3.573  -0.617
  193    HB3  LEU   6           1HB      LEU   6  -2.453  -4.188   0.114
  194   HD11  LEU   6          1HD1      LEU   6  -1.661  -2.271   0.136
  195   HD12  LEU   6          2HD1      LEU   6  -1.487  -1.189  -1.240
  196   HD13  LEU   6          3HD1      LEU   6  -0.286  -2.448  -0.955
  197   HD21  LEU   6          3HD2      LEU   6  -1.622  -4.221  -3.543
  198   HD22  LEU   6          1HD2      LEU   6  -0.924  -4.898  -2.072
  199   HD23  LEU   6          2HD2      LEU   6  -0.262  -3.418  -2.757
  200    H    CYS   7           H        CYS   7  -1.303  -7.028  -1.093
  201    HA   CYS   7           HA       CYS   7  -1.914  -7.830   1.634
  202    HB2  CYS   7           2HB      CYS   7  -2.649  -9.623  -0.681
  203    HB3  CYS   7           1HB      CYS   7  -2.084 -10.340   0.822
  204    H    GLY   8           H        GLY   8   0.032  -8.384   2.520
  205    HA2  GLY   8           2HA      GLY   8   2.381  -8.687   2.562
  206    HA3  GLY   8           1HA      GLY   8   1.931 -10.172   1.733
  207    H    SER   9           H        SER   9   3.231 -10.465   0.034
  208    HA   SER   9           HA       SER   9   4.979  -8.767  -1.198
  209    HG   SER   9           HG       SER   9   3.155  -9.899  -3.913
  210    HB2  SER   9           2HB      SER   9   5.101 -10.280  -2.961
  211    HB3  SER   9           1HB      SER   9   4.322 -11.269  -1.728
  212    H    ASP  10           H        ASP  10   1.585  -9.169  -2.298
  213    HA   ASP  10           HA       ASP  10   1.707  -7.154  -4.304
  214    HB2  ASP  10           2HB      ASP  10  -0.640  -8.103  -2.629
  215    HB3  ASP  10           1HB      ASP  10  -0.773  -7.120  -4.082
  216    H    LEU  11           H        LEU  11   1.177  -7.017  -0.847
  217    HA   LEU  11           HA       LEU  11   0.153  -4.420  -0.519
  218    HG   LEU  11           HG       LEU  11   1.894  -3.743   2.334
  219    HB2  LEU  11           2HB      LEU  11   0.590  -6.181   1.263
  220    HB3  LEU  11           1HB      LEU  11   2.281  -5.703   1.218
  221   HD11  LEU  11          1HD1      LEU  11  -0.789  -3.703   0.948
  222   HD12  LEU  11          2HD1      LEU  11   0.573  -2.609   0.703
  223   HD13  LEU  11          3HD1      LEU  11  -0.351  -2.545   2.204
  224   HD21  LEU  11          3HD2      LEU  11   0.403  -4.120   4.113
  225   HD22  LEU  11          1HD2      LEU  11   0.778  -5.746   3.541
  226   HD23  LEU  11          2HD2      LEU  11  -0.744  -4.979   3.085
  227    H    VAL  12           H        VAL  12   3.602  -5.384  -0.599
  228    HA   VAL  12           HA       VAL  12   4.567  -2.685  -0.532
  229    HB   VAL  12           HB       VAL  12   6.680  -3.747  -1.502
  230   HG11  VAL  12          1HG1      VAL  12   6.170  -3.441   0.949
  231   HG12  VAL  12          2HG1      VAL  12   7.232  -4.806   0.602
  232   HG13  VAL  12          3HG1      VAL  12   5.528  -5.084   0.961
  233   HG21  VAL  12          3HG2      VAL  12   6.768  -6.130  -1.693
  234   HG22  VAL  12          1HG2      VAL  12   5.338  -5.624  -2.590
  235   HG23  VAL  12          2HG2      VAL  12   5.167  -6.314  -0.976
  236    H    GLU  13           H        GLU  13   3.404  -4.758  -3.093
  237    HA   GLU  13           HA       GLU  13   4.526  -3.454  -5.345
  238    HB2  GLU  13           2HB      GLU  13   2.666  -5.475  -4.933
  239    HB3  GLU  13           1HB      GLU  13   1.713  -4.206  -5.702
  240    HG2  GLU  13           2HG      GLU  13   3.611  -4.035  -7.419
  241    HG3  GLU  13           1HG      GLU  13   4.209  -5.553  -6.749
  242    H    ALA  14           H        ALA  14   1.492  -2.770  -3.591
  243    HA   ALA  14           HA       ALA  14   0.867  -0.427  -5.154
  244    HB1  ALA  14           3HB      ALA  14  -0.071  -0.815  -2.330
  245    HB2  ALA  14           1HB      ALA  14  -0.671  -1.871  -3.607
  246    HB3  ALA  14           2HB      ALA  14  -0.945  -0.136  -3.703
  247    H    LEU  15           H        LEU  15   2.584  -1.015  -2.138
  248    HA   LEU  15           HA       LEU  15   2.995   1.812  -1.561
  249    HG   LEU  15           HG       LEU  15   2.203  -0.664   0.486
  250    HB2  LEU  15           2HB      LEU  15   4.307  -0.708  -0.505
  251    HB3  LEU  15           1HB      LEU  15   4.724   0.904   0.060
  252   HD11  LEU  15          1HD1      LEU  15   2.688   0.922   2.666
  253   HD12  LEU  15          2HD1      LEU  15   4.317   0.699   2.029
  254   HD13  LEU  15          3HD1      LEU  15   3.338  -0.705   2.457
  255   HD21  LEU  15          3HD2      LEU  15   1.139   1.263  -0.376
  256   HD22  LEU  15          1HD2      LEU  15   2.408   2.342   0.207
  257   HD23  LEU  15          2HD2      LEU  15   1.261   1.633   1.343
  258    H    TYR  16           H        TYR  16   4.310  -0.422  -3.746
  259    HA   TYR  16           HA       TYR  16   7.009   0.660  -3.866
  260    HD1  TYR  16           HD2      TYR  16   8.934  -0.101  -5.656
  261    HD2  TYR  16           HD1      TYR  16   6.491  -3.116  -3.806
  262    HE1  TYR  16           HE2      TYR  16  10.975  -1.268  -4.861
  263    HE2  TYR  16           HE1      TYR  16   8.532  -4.282  -3.012
  264    HH   TYR  16           HH       TYR  16  10.742  -4.262  -2.926
  265    HB2  TYR  16           2HB      TYR  16   5.482  -1.469  -5.145
  266    HB3  TYR  16           1HB      TYR  16   6.453  -0.575  -6.314
  267    H    LEU  17           H        LEU  17   4.013   1.037  -5.784
  268    HA   LEU  17           HA       LEU  17   5.239   2.930  -7.599
  269    HG   LEU  17           HG       LEU  17   2.359   1.819  -5.842
  270    HB2  LEU  17           2HB      LEU  17   2.886   3.449  -8.281
  271    HB3  LEU  17           1HB      LEU  17   3.275   1.732  -8.355
  272   HD11  LEU  17          1HD1      LEU  17   0.506   3.373  -5.622
  273   HD12  LEU  17          2HD1      LEU  17   0.759   3.965  -7.264
  274   HD13  LEU  17          3HD1      LEU  17   1.957   4.294  -6.015
  275   HD21  LEU  17          3HD2      LEU  17   1.526   0.423  -7.728
  276   HD22  LEU  17          1HD2      LEU  17   0.572   1.796  -8.291
  277   HD23  LEU  17          2HD2      LEU  17   0.210   1.050  -6.734
  278    H    VAL  18           H        VAL  18   3.578   3.224  -4.483
  279    HA   VAL  18           HA       VAL  18   3.100   6.031  -4.698
  280    HB   VAL  18           HB       VAL  18   3.037   6.043  -2.207
  281   HG11  VAL  18          1HG1      VAL  18   1.121   4.456  -2.087
  282   HG12  VAL  18          2HG1      VAL  18   1.604   3.804  -3.655
  283   HG13  VAL  18          3HG1      VAL  18   1.062   5.476  -3.524
  284   HG21  VAL  18          3HG2      VAL  18   3.052   3.627  -1.253
  285   HG22  VAL  18          1HG2      VAL  18   4.599   4.428  -1.502
  286   HG23  VAL  18          2HG2      VAL  18   4.018   3.254  -2.674
  287    H    CYS  19           H        CYS  19   5.783   4.478  -2.860
  288    HA   CYS  19           HA       CYS  19   7.237   6.948  -3.589
  289    HB2  CYS  19           2HB      CYS  19   7.413   5.360  -1.146
  290    HB3  CYS  19           1HB      CYS  19   8.978   5.711  -1.856
  291    H    GLY  20           H        GLY  20   7.613   3.422  -3.439
  292    HA2  GLY  20           2HA      GLY  20   8.696   2.072  -5.087
  293    HA3  GLY  20           1HA      GLY  20   9.345   3.537  -5.825
  294    H    GLU  21           H        GLU  21  11.513   2.811  -5.844
  295    HA   GLU  21           HA       GLU  21  12.892   1.562  -3.730
  296    HB2  GLU  21           2HB      GLU  21  13.936   1.776  -5.901
  297    HB3  GLU  21           1HB      GLU  21  13.884   3.537  -5.805
  298    HG2  GLU  21           2HG      GLU  21  15.476   3.565  -4.002
  299    HG3  GLU  21           1HG      GLU  21  15.388   1.812  -3.824
  300    H    ARG  22           H        ARG  22  11.743   4.811  -4.000
  301    HA   ARG  22           HA       ARG  22  13.530   6.157  -2.257
  302    HE   ARG  22           HE       ARG  22   9.745   9.220  -5.160
  303    HB2  ARG  22           2HB      ARG  22  10.540   6.605  -2.488
  304    HB3  ARG  22           1HB      ARG  22  11.740   7.772  -1.929
  305    HG2  ARG  22           2HG      ARG  22  12.816   7.127  -4.327
  306    HG3  ARG  22           1HG      ARG  22  11.107   6.890  -4.692
  307    HD2  ARG  22           2HD      ARG  22  11.183   9.276  -3.234
  308    HD3  ARG  22           1HD      ARG  22  12.576   9.371  -4.311
  309   HH11  ARG  22          1HH2      ARG  22  12.563   7.976  -6.389
  310   HH12  ARG  22          2HH2      ARG  22  12.577   8.922  -7.840
  311   HH21  ARG  22          1HH1      ARG  22   9.991  10.996  -6.834
  312   HH22  ARG  22          2HH1      ARG  22  11.124  10.628  -8.092
  313    H    GLY  23           H        GLY  23  11.237   3.683  -1.614
  314    HA2  GLY  23           2HA      GLY  23  11.520   2.538   0.589
  315    HA3  GLY  23           1HA      GLY  23  11.622   4.141   1.319
  316    H    PHE  24           H        PHE  24   9.694   1.892   1.787
  317    HA   PHE  24           HA       PHE  24   7.202   3.488   1.381
  318    HD1  PHE  24           HD1      PHE  24   8.182  -0.499   2.359
  319    HD2  PHE  24           HD2      PHE  24   8.182   1.110  -1.627
  320    HE1  PHE  24           HE1      PHE  24   9.910  -2.152   1.691
  321    HE2  PHE  24           HE2      PHE  24   9.909  -0.542  -2.293
  322    HZ   PHE  24           HZ       PHE  24  10.773  -2.172  -0.635
  323    HB2  PHE  24           2HB      PHE  24   6.250   0.923   1.393
  324    HB3  PHE  24           1HB      PHE  24   6.569   1.846  -0.074
  325    H    PHE  25           H        PHE  25   5.451   1.923   2.863
  326    HA   PHE  25           HA       PHE  25   6.845   1.469   5.450
  327    HD1  PHE  25           HD2      PHE  25   5.984   0.902   7.264
  328    HD2  PHE  25           HD1      PHE  25   5.526   5.177   7.194
  329    HE1  PHE  25           HE2      PHE  25   6.647   1.012   9.651
  330    HE2  PHE  25           HE1      PHE  25   6.189   5.283   9.581
  331    HZ   PHE  25           HZ       PHE  25   6.749   3.203  10.810
  332    HB2  PHE  25           2HB      PHE  25   5.684   3.844   5.096
  333    HB3  PHE  25           1HB      PHE  25   4.238   2.933   5.532
  334    H    TYR  26           H        TYR  26   6.144  -0.711   4.164
  335    HA   TYR  26           HA       TYR  26   3.365  -1.495   4.631
  336    HD1  TYR  26           HD1      TYR  26   2.300  -3.708   4.534
  337    HD2  TYR  26           HD2      TYR  26   6.315  -5.137   3.949
  338    HE1  TYR  26           HE1      TYR  26   1.603  -5.970   5.260
  339    HE2  TYR  26           HE2      TYR  26   5.611  -7.395   4.678
  340    HH   TYR  26           HH       TYR  26   3.213  -8.668   4.654
  341    HB2  TYR  26           2HB      TYR  26   4.323  -2.646   2.816
  342    HB3  TYR  26           1HB      TYR  26   5.858  -2.866   3.637
  343    H    THR  27           H        THR  27   3.831  -0.599   7.009
  344    HA   THR  27           HA       THR  27   5.295  -2.428   8.748
  345    HB   THR  27           HB       THR  27   5.146  -0.064   9.325
  346    HG1  THR  27           HG1      THR  27   3.429  -1.114  11.221
  347   HG21  THR  27          3HG2      THR  27   2.164  -0.589   9.294
  348   HG22  THR  27          1HG2      THR  27   3.063   0.542   8.282
  349   HG23  THR  27          2HG2      THR  27   2.887   0.851  10.010
  350    H    LYS  28           H        LYS  28   4.033  -3.243  10.777
  351    HA   LYS  28           HA       LYS  28   1.435  -4.432   9.882
  352    HB2  LYS  28           2HB      LYS  28   3.892  -5.691  10.923
  353    HB3  LYS  28           1HB      LYS  28   2.413  -6.222  11.723
  354    HG2  LYS  28           2HG      LYS  28   2.187  -7.642   9.970
  355    HG3  LYS  28           1HG      LYS  28   1.678  -6.218   9.062
  356    HD2  LYS  28           2HD      LYS  28   3.404  -6.909   7.700
  357    HD3  LYS  28           1HD      LYS  28   4.327  -5.907   8.820
  358    HE2  LYS  28           2HE      LYS  28   5.537  -7.931   8.772
  359    HE3  LYS  28           1HE      LYS  28   4.559  -8.070  10.234
  360    HZ1  LYS  28           3HZ      LYS  28   4.548  -9.714   7.948
  361    HZ2  LYS  28           1HZ      LYS  28   3.020  -8.996   8.111
  362    HZ3  LYS  28           2HZ      LYS  28   3.674  -9.898   9.393
  363    HA   PRO  29           HA       PRO  29   0.534  -2.155  13.693
  364    HB2  PRO  29           2HB      PRO  29  -2.084  -1.666  13.015
  365    HB3  PRO  29           1HB      PRO  29  -0.728  -0.647  12.501
  366    HG2  PRO  29           2HG      PRO  29  -2.293  -2.633  10.915
  367    HG3  PRO  29           1HG      PRO  29  -1.432  -1.185  10.366
  368    HD2  PRO  29           2HD      PRO  29  -0.496  -3.834  10.130
  369    HD3  PRO  29           1HD      PRO  29   0.487  -2.368   9.943
  370    H    THR  30           H        THR  30   0.776  -4.472  14.584
  371    HA   THR  30           HA       THR  30  -1.920  -5.679  15.059
  372    HB   THR  30           HB       THR  30   0.829  -6.962  15.112
  373    HG1  THR  30           HG1      THR  30  -0.015  -8.095  13.345
  374   HG21  THR  30          3HG2      THR  30  -0.370  -8.094  16.787
  375   HG22  THR  30          1HG2      THR  30  -0.670  -9.069  15.348
  376   HG23  THR  30          2HG2      THR  30  -1.900  -7.943  15.923
  Start of MODEL    8
    1    H1   GLY   1           1H       GLY   1  -2.494  -2.081  11.929
    2    H2   GLY   1           2H       GLY   1  -3.553  -2.654  10.731
    3    H3   GLY   1           3H       GLY   1  -4.096  -1.524  11.877
    4    HA2  GLY   1           1HA      GLY   1  -3.436   0.092  10.483
    5    HA3  GLY   1           2HA      GLY   1  -1.737  -0.459  10.615
    6    H    ILE   2           H        ILE   2  -1.600  -1.279   8.270
    7    HA   ILE   2           HA       ILE   2  -3.863  -0.450   6.514
    8    HB   ILE   2           HB       ILE   2  -1.567   0.566   6.186
    9   HG12  ILE   2          2HG1      ILE   2  -2.970  -0.998   4.015
   10   HG13  ILE   2          1HG1      ILE   2  -3.054   0.732   4.342
   11   HG21  ILE   2          1HG2      ILE   2   0.259  -0.701   5.629
   12   HG22  ILE   2          2HG2      ILE   2  -0.709  -1.918   4.797
   13   HG23  ILE   2          3HG2      ILE   2  -0.612  -1.922   6.558
   14   HD11  ILE   2          3HD1      ILE   2  -0.503   0.726   3.837
   15   HD12  ILE   2          1HD1      ILE   2  -1.620   0.607   2.477
   16   HD13  ILE   2          2HD1      ILE   2  -0.810  -0.838   3.083
   17    H    THR   3           H        THR   3  -2.461  -3.206   7.839
   18    HA   THR   3           HA       THR   3  -2.813  -4.961   5.534
   19    HB   THR   3           HB       THR   3  -2.420  -5.598   8.471
   20    HG1  THR   3           HG1      THR   3  -0.749  -4.478   7.106
   21   HG21  THR   3          3HG2      THR   3  -1.723  -7.524   6.317
   22   HG22  THR   3          1HG2      THR   3  -3.441  -7.308   6.654
   23   HG23  THR   3          2HG2      THR   3  -2.348  -7.826   7.938
   24    H    GLU   4           H        GLU   4  -4.566  -4.341   8.549
   25    HA   GLU   4           HA       GLU   4  -6.744  -6.144   7.762
   26    HB2  GLU   4           2HB      GLU   4  -6.130  -5.884  10.148
   27    HB3  GLU   4           1HB      GLU   4  -6.571  -4.177  10.065
   28    HG2  GLU   4           2HG      GLU   4  -8.697  -4.747  10.537
   29    HG3  GLU   4           1HG      GLU   4  -8.766  -5.608   8.999
   30    H    GLN   5           H        GLN   5  -6.429  -4.274   5.773
   31    HA   GLN   5           HA       GLN   5  -9.052  -3.057   5.684
   32    HB2  GLN   5           2HB      GLN   5  -7.585  -1.462   7.139
   33    HB3  GLN   5           1HB      GLN   5  -6.797  -1.051   5.613
   34    HG2  GLN   5           2HG      GLN   5  -8.581   0.133   4.877
   35    HG3  GLN   5           1HG      GLN   5  -9.730  -1.079   5.446
   36   HE21  GLN   5          1HE2      GLN   5  -7.876   1.788   6.434
   37   HE22  GLN   5          2HE2      GLN   5  -8.767   2.086   7.848
   38    H    CYS   6           H        CYS   6  -5.739  -2.700   4.418
   39    HA   CYS   6           HA       CYS   6  -6.731  -2.359   1.691
   40    HB2  CYS   6           2HB      CYS   6  -4.033  -2.485   2.998
   41    HB3  CYS   6           1HB      CYS   6  -4.150  -2.696   1.260
   42    H    CYS   7           H        CYS   7  -6.265  -4.968   3.729
   43    HA   CYS   7           HA       CYS   7  -5.994  -6.783   1.375
   44    HB2  CYS   7           2HB      CYS   7  -4.058  -6.941   2.880
   45    HB3  CYS   7           1HB      CYS   7  -5.128  -7.266   4.238
   46    H    THR   8           H        THR   8  -7.804  -5.897   4.202
   47    HA   THR   8           HA       THR   8  -9.519  -8.303   4.019
   48    HB   THR   8           HB       THR   8  -9.951  -5.872   5.769
   49    HG1  THR   8           HG1      THR   8  -7.950  -6.557   6.311
   50   HG21  THR   8          3HG2      THR   8 -11.672  -7.065   6.583
   51   HG22  THR   8          1HG2      THR   8 -10.619  -8.446   6.889
   52   HG23  THR   8          2HG2      THR   8 -11.390  -8.256   5.314
   53    H    SER   9           H        SER   9  -9.319  -5.088   2.845
   54    HA   SER   9           HA       SER   9 -11.992  -5.395   1.581
   55    HG   SER   9           HG       SER   9 -13.679  -3.831   2.283
   56    HB2  SER   9           2HB      SER   9 -11.959  -3.842   3.679
   57    HB3  SER   9           1HB      SER   9 -11.094  -2.718   2.637
   58    H    ILE  10           H        ILE  10 -11.231  -2.378   0.778
   59    HA   ILE  10           HA       ILE  10  -9.097  -3.068  -1.172
   60    HB   ILE  10           HB       ILE  10 -11.609  -1.648  -2.057
   61   HG12  ILE  10          2HG1      ILE  10 -12.148  -3.945  -1.180
   62   HG13  ILE  10          1HG1      ILE  10 -12.449  -3.764  -2.908
   63   HG21  ILE  10          1HG2      ILE  10  -9.152  -2.796  -3.320
   64   HG22  ILE  10          2HG2      ILE  10 -10.001  -1.295  -3.685
   65   HG23  ILE  10          3HG2      ILE  10 -10.656  -2.836  -4.240
   66   HD11  ILE  10          3HD1      ILE  10 -10.704  -5.141  -3.499
   67   HD12  ILE  10          1HD1      ILE  10 -11.055  -5.833  -1.915
   68   HD13  ILE  10          2HD1      ILE  10  -9.732  -4.681  -2.101
   69    H    CYS  11           H        CYS  11  -7.776  -1.315  -1.672
   70    HA   CYS  11           HA       CYS  11  -8.508   1.275  -0.360
   71    HB2  CYS  11           2HB      CYS  11  -5.774   0.067  -0.885
   72    HB3  CYS  11           1HB      CYS  11  -6.042   1.682  -0.234
   73    H    SER  12           H        SER  12  -6.472   2.814  -1.622
   74    HA   SER  12           HA       SER  12  -7.055   2.546  -4.527
   75    HG   SER  12           HG       SER  12  -7.302   6.204  -3.044
   76    HB2  SER  12           2HB      SER  12  -7.611   4.937  -4.678
   77    HB3  SER  12           1HB      SER  12  -8.730   4.111  -3.596
   78    H    LEU  13           H        LEU  13  -5.181   2.674  -5.610
   79    HA   LEU  13           HA       LEU  13  -2.637   3.011  -4.657
   80    HG   LEU  13           HG       LEU  13  -4.957   4.343  -6.856
   81    HB2  LEU  13           2HB      LEU  13  -2.063   4.006  -6.921
   82    HB3  LEU  13           1HB      LEU  13  -2.907   2.464  -6.936
   83   HD11  LEU  13          1HD1      LEU  13  -4.368   6.189  -8.021
   84   HD12  LEU  13          2HD1      LEU  13  -3.521   5.234  -9.239
   85   HD13  LEU  13          3HD1      LEU  13  -2.695   5.699  -7.751
   86   HD21  LEU  13          3HD2      LEU  13  -5.142   2.335  -8.101
   87   HD22  LEU  13          1HD2      LEU  13  -3.705   2.704  -9.054
   88   HD23  LEU  13          2HD2      LEU  13  -5.187   3.629  -9.298
   89    H    TYR  14           H        TYR  14  -4.916   5.513  -5.509
   90    HA   TYR  14           HA       TYR  14  -3.354   7.825  -5.376
   91    HD1  TYR  14           HD1      TYR  14  -4.822   9.007  -7.355
   92    HD2  TYR  14           HD2      TYR  14  -5.725  10.126  -3.305
   93    HE1  TYR  14           HE1      TYR  14  -4.572  11.402  -7.961
   94    HE2  TYR  14           HE2      TYR  14  -5.474  12.519  -3.910
   95    HH   TYR  14           HH       TYR  14  -5.075  13.541  -7.243
   96    HB2  TYR  14           2HB      TYR  14  -5.964   7.437  -5.713
   97    HB3  TYR  14           1HB      TYR  14  -6.005   7.872  -4.008
   98    H    GLN  15           H        GLN  15  -5.359   6.883  -2.605
   99    HA   GLN  15           HA       GLN  15  -3.743   8.320  -0.725
  100    HB2  GLN  15           2HB      GLN  15  -5.952   6.328  -0.565
  101    HB3  GLN  15           1HB      GLN  15  -4.962   6.551   0.878
  102    HG2  GLN  15           2HG      GLN  15  -5.892   9.015  -0.516
  103    HG3  GLN  15           1HG      GLN  15  -7.103   8.090   0.374
  104   HE21  GLN  15          1HE2      GLN  15  -3.781   9.429   0.826
  105   HE22  GLN  15          2HE2      GLN  15  -3.988   9.774   2.475
  106    H    LEU  16           H        LEU  16  -3.881   4.997  -1.775
  107    HA   LEU  16           HA       LEU  16  -2.241   3.598  -0.064
  108    HG   LEU  16           HG       LEU  16  -0.232   2.514  -1.755
  109    HB2  LEU  16           2HB      LEU  16  -3.212   2.586  -2.050
  110    HB3  LEU  16           1HB      LEU  16  -2.244   3.628  -3.084
  111   HD11  LEU  16          1HD1      LEU  16  -2.306   0.311  -1.754
  112   HD12  LEU  16          2HD1      LEU  16  -1.904   1.247  -0.314
  113   HD13  LEU  16          3HD1      LEU  16  -0.673   0.251  -1.091
  114   HD21  LEU  16          3HD2      LEU  16  -1.748   1.021  -3.913
  115   HD22  LEU  16          1HD2      LEU  16  -0.018   0.931  -3.583
  116   HD23  LEU  16          2HD2      LEU  16  -0.718   2.420  -4.217
  117    H    GLU  17           H        GLU  17  -1.264   6.010  -2.441
  118    HA   GLU  17           HA       GLU  17   1.569   5.521  -2.188
  119    HB2  GLU  17           2HB      GLU  17   0.971   6.583  -4.181
  120    HB3  GLU  17           1HB      GLU  17  -0.127   7.698  -3.374
  121    HG2  GLU  17           2HG      GLU  17   1.719   8.950  -2.443
  122    HG3  GLU  17           1HG      GLU  17   2.881   7.744  -2.996
  123    H    ASN  18           H        ASN  18  -0.719   7.325  -0.307
  124    HA   ASN  18           HA       ASN  18   1.113   9.194   0.886
  125    HB2  ASN  18           2HB      ASN  18  -1.495   9.127   0.953
  126    HB3  ASN  18           1HB      ASN  18  -1.264   8.097   2.364
  127   HD21  ASN  18          1HD2      ASN  18   0.758   9.173   3.782
  128   HD22  ASN  18          2HD2      ASN  18   0.490  10.809   4.146
  129    H    TYR  19           H        TYR  19   0.977   5.836   1.135
  130    HA   TYR  19           HA       TYR  19   1.940   5.782   3.931
  131    HD1  TYR  19           HD2      TYR  19   0.501   4.032   5.493
  132    HD2  TYR  19           HD1      TYR  19  -0.806   4.077   1.402
  133    HE1  TYR  19           HE2      TYR  19  -1.854   4.176   6.247
  134    HE2  TYR  19           HE1      TYR  19  -3.162   4.220   2.151
  135    HH   TYR  19           HH       TYR  19  -4.382   3.429   4.548
  136    HB2  TYR  19           2HB      TYR  19   1.458   3.554   1.929
  137    HB3  TYR  19           1HB      TYR  19   1.982   3.309   3.594
  138    H    CYS  20           H        CYS  20   3.518   7.113   1.826
  139    HA   CYS  20           HA       CYS  20   5.859   5.274   1.677
  140    HB2  CYS  20           2HB      CYS  20   4.809   6.675  -0.337
  141    HB3  CYS  20           1HB      CYS  20   5.908   7.894   0.263
  142    H    ASN  21           H        ASN  21   7.954   6.753   1.600
  143    HA   ASN  21           HA       ASN  21   7.967   8.207   4.203
  144    HB2  ASN  21           2HB      ASN  21   9.553   6.263   3.809
  145    HB3  ASN  21           1HB      ASN  21  10.356   7.264   2.599
  146   HD21  ASN  21          1HD2      ASN  21  11.089   6.287   5.510
  147   HD22  ASN  21          2HD2      ASN  21  11.670   7.705   6.240
  148    HA   PHE   1           HA       PHE   1  -9.033   5.848  -6.656
  149    HD1  PHE   1           HD2      PHE   1  -7.059   8.087  -9.082
  150    HD2  PHE   1           HD1      PHE   1 -10.426   6.069 -10.831
  151    HE1  PHE   1           HE2      PHE   1  -6.006   8.271 -11.321
  152    HE2  PHE   1           HE1      PHE   1  -9.373   6.254 -13.071
  153    HZ   PHE   1           HZ       PHE   1  -7.163   7.355 -13.315
  154    H1   PHE   1           1H       PHE   1  -7.032   4.816  -7.468
  155    H2   PHE   1           2H       PHE   1  -6.947   6.491  -7.741
  156    H3   PHE   1           3H       PHE   1  -7.292   5.434  -9.026
  157    HB2  PHE   1           2HB      PHE   1 -10.518   6.848  -8.558
  158    HB3  PHE   1           1HB      PHE   1  -9.232   7.845  -7.878
  159    H    VAL   2           H        VAL   2  -7.904   3.554  -8.627
  160    HA   VAL   2           HA       VAL   2 -10.539   2.445  -9.425
  161    HB   VAL   2           HB       VAL   2  -9.008   0.623 -10.430
  162   HG11  VAL   2          1HG1      VAL   2  -8.984   3.515 -11.323
  163   HG12  VAL   2          2HG1      VAL   2 -10.053   2.226 -11.874
  164   HG13  VAL   2          3HG1      VAL   2  -8.346   2.207 -12.317
  165   HG21  VAL   2          3HG2      VAL   2  -6.708   0.998 -10.534
  166   HG22  VAL   2          1HG2      VAL   2  -7.075   1.599  -8.917
  167   HG23  VAL   2          2HG2      VAL   2  -6.875   2.731 -10.255
  168    H    ASN   3           H        ASN   3 -10.535  -0.123  -9.093
  169    HA   ASN   3           HA       ASN   3 -10.317  -0.501  -6.179
  170    HB2  ASN   3           2HB      ASN   3 -11.085  -2.818  -7.848
  171    HB3  ASN   3           1HB      ASN   3 -11.880  -2.143  -6.428
  172   HD21  ASN   3          1HD2      ASN   3 -12.524  -2.713  -9.580
  173   HD22  ASN   3          2HD2      ASN   3 -13.525  -1.389  -9.938
  174    H    GLN   4           H        GLN   4  -8.551  -1.429  -5.252
  175    HA   GLN   4           HA       GLN   4  -6.980  -3.378  -6.848
  176    HB2  GLN   4           2HB      GLN   4  -5.719  -1.394  -7.202
  177    HB3  GLN   4           1HB      GLN   4  -5.947  -0.859  -5.538
  178    HG2  GLN   4           2HG      GLN   4  -3.701  -1.700  -5.711
  179    HG3  GLN   4           1HG      GLN   4  -4.630  -2.890  -4.801
  180   HE21  GLN   4          1HE2      GLN   4  -3.385  -4.747  -5.464
  181   HE22  GLN   4          2HE2      GLN   4  -3.350  -5.295  -7.071
  182    H    HIS   5           H        HIS   5  -6.583  -5.158  -5.640
  183    HA   HIS   5           HA       HIS   5  -7.173  -5.092  -2.750
  184    HD2  HIS   5           HD2      HIS   5  -7.826  -6.296  -6.594
  185    HE1  HIS   5           HE1      HIS   5 -11.463  -7.397  -4.740
  186    HE2  HIS   5           HE2      HIS   5 -10.389  -6.606  -6.915
  187    HB2  HIS   5           2HB      HIS   5  -6.222  -7.468  -4.369
  188    HB3  HIS   5           1HB      HIS   5  -7.129  -7.482  -2.856
  189    H    LEU   6           H        LEU   6  -5.590  -5.628  -1.145
  190    HA   LEU   6           HA       LEU   6  -2.783  -5.831  -2.075
  191    HG   LEU   6           HG       LEU   6  -2.914  -2.751  -2.533
  192    HB2  LEU   6           2HB      LEU   6  -4.041  -3.562  -0.687
  193    HB3  LEU   6           1HB      LEU   6  -2.587  -4.147   0.090
  194   HD11  LEU   6          1HD1      LEU   6  -0.352  -2.772  -1.094
  195   HD12  LEU   6          2HD1      LEU   6  -1.720  -2.234  -0.118
  196   HD13  LEU   6          3HD1      LEU   6  -1.338  -1.413  -1.629
  197   HD21  LEU   6          3HD2      LEU   6  -1.946  -4.631  -3.555
  198   HD22  LEU   6          1HD2      LEU   6  -1.092  -5.114  -2.090
  199   HD23  LEU   6          2HD2      LEU   6  -0.507  -3.751  -3.039
  200    H    CYS   7           H        CYS   7  -1.592  -7.204  -0.920
  201    HA   CYS   7           HA       CYS   7  -2.179  -7.711   1.906
  202    HB2  CYS   7           2HB      CYS   7  -2.467  -9.946  -0.145
  203    HB3  CYS   7           1HB      CYS   7  -2.506 -10.158   1.601
  204    H    GLY   8           H        GLY   8  -0.290  -8.238   2.914
  205    HA2  GLY   8           2HA      GLY   8   2.090  -8.348   3.037
  206    HA3  GLY   8           1HA      GLY   8   1.709  -9.957   2.438
  207    H    SER   9           H        SER   9   2.950 -10.507   0.755
  208    HA   SER   9           HA       SER   9   4.781  -9.023  -0.632
  209    HG   SER   9           HG       SER   9   4.984 -10.306  -3.205
  210    HB2  SER   9           2HB      SER   9   4.030 -11.547  -0.877
  211    HB3  SER   9           1HB      SER   9   3.125 -10.922  -2.253
  212    H    ASP  10           H        ASP  10   1.375  -9.412  -1.699
  213    HA   ASP  10           HA       ASP  10   1.642  -7.625  -3.928
  214    HB2  ASP  10           2HB      ASP  10  -0.736  -8.559  -2.309
  215    HB3  ASP  10           1HB      ASP  10  -0.897  -7.472  -3.684
  216    H    LEU  11           H        LEU  11   1.039  -7.171  -0.527
  217    HA   LEU  11           HA       LEU  11   0.000  -4.545  -0.495
  218    HG   LEU  11           HG       LEU  11   1.697  -3.612   2.317
  219    HB2  LEU  11           2HB      LEU  11   0.306  -6.103   1.476
  220    HB3  LEU  11           1HB      LEU  11   2.019  -5.711   1.445
  221   HD11  LEU  11          1HD1      LEU  11  -0.553  -2.406   2.041
  222   HD12  LEU  11          2HD1      LEU  11  -0.937  -3.650   0.851
  223   HD13  LEU  11          3HD1      LEU  11   0.442  -2.579   0.595
  224   HD21  LEU  11          3HD2      LEU  11   0.425  -3.917   4.178
  225   HD22  LEU  11          1HD2      LEU  11   0.255  -5.556   3.548
  226   HD23  LEU  11          2HD2      LEU  11  -1.006  -4.360   3.246
  227    H    VAL  12           H        VAL  12   3.415  -5.616  -0.482
  228    HA   VAL  12           HA       VAL  12   4.455  -2.925  -0.574
  229    HB   VAL  12           HB       VAL  12   6.582  -4.127  -1.368
  230   HG11  VAL  12          1HG1      VAL  12   7.127  -4.527   0.827
  231   HG12  VAL  12          2HG1      VAL  12   5.650  -5.439   1.138
  232   HG13  VAL  12          3HG1      VAL  12   5.606  -3.677   1.096
  233   HG21  VAL  12          3HG2      VAL  12   5.255  -6.085  -2.294
  234   HG22  VAL  12          1HG2      VAL  12   4.973  -6.581  -0.626
  235   HG23  VAL  12          2HG2      VAL  12   6.615  -6.525  -1.262
  236    H    GLU  13           H        GLU  13   3.559  -5.299  -3.040
  237    HA   GLU  13           HA       GLU  13   4.743  -4.134  -5.312
  238    HB2  GLU  13           2HB      GLU  13   3.379  -6.252  -5.286
  239    HB3  GLU  13           1HB      GLU  13   1.927  -5.255  -5.188
  240    HG2  GLU  13           2HG      GLU  13   2.502  -4.165  -7.310
  241    HG3  GLU  13           1HG      GLU  13   3.991  -5.107  -7.406
  242    H    ALA  14           H        ALA  14   1.430  -3.491  -4.115
  243    HA   ALA  14           HA       ALA  14   0.865  -1.297  -5.787
  244    HB1  ALA  14           3HB      ALA  14  -0.779  -2.424  -4.284
  245    HB2  ALA  14           1HB      ALA  14  -0.811  -0.669  -4.133
  246    HB3  ALA  14           2HB      ALA  14  -0.002  -1.642  -2.906
  247    H    LEU  15           H        LEU  15   2.149  -1.225  -2.458
  248    HA   LEU  15           HA       LEU  15   2.643   1.564  -2.354
  249    HG   LEU  15           HG       LEU  15   1.882  -0.840  -0.295
  250    HB2  LEU  15           2HB      LEU  15   4.145  -0.690  -0.995
  251    HB3  LEU  15           1HB      LEU  15   4.253   1.011  -0.552
  252   HD11  LEU  15          1HD1      LEU  15   2.014   0.482   2.000
  253   HD12  LEU  15          2HD1      LEU  15   3.680   0.754   1.490
  254   HD13  LEU  15          3HD1      LEU  15   3.076  -0.891   1.690
  255   HD21  LEU  15          3HD2      LEU  15   0.563   1.175   0.340
  256   HD22  LEU  15          1HD2      LEU  15   1.072   1.239  -1.347
  257   HD23  LEU  15          2HD2      LEU  15   1.919   2.198  -0.134
  258    H    TYR  16           H        TYR  16   4.498  -1.060  -3.779
  259    HA   TYR  16           HA       TYR  16   6.995   0.295  -4.008
  260    HD1  TYR  16           HD2      TYR  16   9.027  -0.228  -5.370
  261    HD2  TYR  16           HD1      TYR  16   7.036  -3.625  -3.648
  262    HE1  TYR  16           HE2      TYR  16  11.162  -0.957  -4.338
  263    HE2  TYR  16           HE1      TYR  16   9.172  -4.354  -2.617
  264    HH   TYR  16           HH       TYR  16  12.113  -2.375  -2.887
  265    HB2  TYR  16           2HB      TYR  16   5.816  -2.153  -4.971
  266    HB3  TYR  16           1HB      TYR  16   6.712  -1.367  -6.273
  267    H    LEU  17           H        LEU  17   4.602  -0.220  -6.630
  268    HA   LEU  17           HA       LEU  17   5.800   1.552  -8.461
  269    HG   LEU  17           HG       LEU  17   2.927   0.456  -6.831
  270    HB2  LEU  17           2HB      LEU  17   3.407   1.800  -9.387
  271    HB3  LEU  17           1HB      LEU  17   4.104   0.182  -9.337
  272   HD11  LEU  17          1HD1      LEU  17   1.176   1.700  -8.964
  273   HD12  LEU  17          2HD1      LEU  17   1.740   2.467  -7.479
  274   HD13  LEU  17          3HD1      LEU  17   0.584   1.137  -7.401
  275   HD21  LEU  17          3HD2      LEU  17   1.395  -1.240  -7.644
  276   HD22  LEU  17          1HD2      LEU  17   2.961  -1.510  -8.410
  277   HD23  LEU  17          2HD2      LEU  17   1.659  -0.737  -9.314
  278    H    VAL  18           H        VAL  18   3.983   2.332  -5.589
  279    HA   VAL  18           HA       VAL  18   3.577   5.120  -6.514
  280    HB   VAL  18           HB       VAL  18   2.526   5.453  -4.286
  281   HG11  VAL  18          1HG1      VAL  18   1.301   4.521  -6.321
  282   HG12  VAL  18          2HG1      VAL  18   0.552   4.216  -4.752
  283   HG13  VAL  18          3HG1      VAL  18   1.462   2.938  -5.559
  284   HG21  VAL  18          3HG2      VAL  18   3.118   2.511  -3.945
  285   HG22  VAL  18          1HG2      VAL  18   2.153   3.492  -2.847
  286   HG23  VAL  18          2HG2      VAL  18   3.874   3.817  -3.033
  287    H    CYS  19           H        CYS  19   5.321   3.308  -4.085
  288    HA   CYS  19           HA       CYS  19   6.672   5.619  -2.968
  289    HB2  CYS  19           2HB      CYS  19   6.799   2.657  -2.631
  290    HB3  CYS  19           1HB      CYS  19   8.220   3.581  -2.160
  291    H    GLY  20           H        GLY  20   8.035   2.757  -4.573
  292    HA2  GLY  20           2HA      GLY  20   9.636   2.748  -6.374
  293    HA3  GLY  20           1HA      GLY  20   9.852   4.490  -6.154
  294    H    GLU  21           H        GLU  21  12.211   4.026  -6.053
  295    HA   GLU  21           HA       GLU  21  13.258   2.386  -3.911
  296    HB2  GLU  21           2HB      GLU  21  15.315   2.830  -4.808
  297    HB3  GLU  21           1HB      GLU  21  14.354   3.381  -6.176
  298    HG2  GLU  21           2HG      GLU  21  15.683   5.248  -5.892
  299    HG3  GLU  21           1HG      GLU  21  14.383   5.670  -4.776
  300    H    ARG  22           H        ARG  22  11.573   5.205  -3.678
  301    HA   ARG  22           HA       ARG  22  13.190   6.673  -1.792
  302    HE   ARG  22           HE       ARG  22  12.168  11.416  -2.687
  303    HB2  ARG  22           2HB      ARG  22  10.253   6.733  -2.499
  304    HB3  ARG  22           1HB      ARG  22  10.943   7.778  -1.256
  305    HG2  ARG  22           2HG      ARG  22  12.726   8.236  -3.215
  306    HG3  ARG  22           1HG      ARG  22  11.324   7.842  -4.210
  307    HD2  ARG  22           2HD      ARG  22  10.710   9.999  -3.915
  308    HD3  ARG  22           1HD      ARG  22  10.256   9.514  -2.282
  309   HH11  ARG  22          1HH2      ARG  22  11.694   9.631  -0.143
  310   HH12  ARG  22          2HH2      ARG  22  13.336   9.216   0.221
  311   HH21  ARG  22          1HH1      ARG  22  14.558  10.229  -2.859
  312   HH22  ARG  22          2HH1      ARG  22  14.954   9.549  -1.317
  313    H    GLY  23           H        GLY  23  11.286   3.823  -1.512
  314    HA2  GLY  23           2HA      GLY  23  11.428   2.462   0.507
  315    HA3  GLY  23           1HA      GLY  23  11.669   3.935   1.442
  316    H    PHE  24           H        PHE  24   9.575   1.624   1.411
  317    HA   PHE  24           HA       PHE  24   7.156   3.387   1.388
  318    HD1  PHE  24           HD2      PHE  24   8.731   1.223  -1.233
  319    HD2  PHE  24           HD1      PHE  24   7.229  -1.009   2.119
  320    HE1  PHE  24           HE2      PHE  24  10.332  -0.605  -1.732
  321    HE2  PHE  24           HE1      PHE  24   8.829  -2.836   1.619
  322    HZ   PHE  24           HZ       PHE  24  10.381  -2.635  -0.306
  323    HB2  PHE  24           2HB      PHE  24   6.056   0.938   1.326
  324    HB3  PHE  24           1HB      PHE  24   6.548   1.768  -0.147
  325    H    PHE  25           H        PHE  25   5.387   1.936   2.840
  326    HA   PHE  25           HA       PHE  25   6.709   1.785   5.517
  327    HD1  PHE  25           HD2      PHE  25   6.307   1.937   7.518
  328    HD2  PHE  25           HD1      PHE  25   4.166   5.194   5.704
  329    HE1  PHE  25           HE2      PHE  25   7.125   3.462   9.292
  330    HE2  PHE  25           HE1      PHE  25   4.987   6.717   7.479
  331    HZ   PHE  25           HZ       PHE  25   6.465   5.853   9.272
  332    HB2  PHE  25           2HB      PHE  25   4.326   3.113   4.575
  333    HB3  PHE  25           1HB      PHE  25   3.883   1.927   5.799
  334    H    TYR  26           H        TYR  26   3.539   0.531   4.471
  335    HA   TYR  26           HA       TYR  26   2.618  -1.613   4.723
  336    HD1  TYR  26           HD1      TYR  26   2.310  -3.558   5.327
  337    HD2  TYR  26           HD2      TYR  26   6.022  -4.663   3.459
  338    HE1  TYR  26           HE1      TYR  26   1.876  -5.935   5.873
  339    HE2  TYR  26           HE2      TYR  26   5.586  -7.039   4.007
  340    HH   TYR  26           HH       TYR  26   4.097  -8.240   5.940
  341    HB2  TYR  26           2HB      TYR  26   4.176  -2.301   3.011
  342    HB3  TYR  26           1HB      TYR  26   5.512  -2.292   4.149
  343    H    THR  27           H        THR  27   2.980  -0.294   7.077
  344    HA   THR  27           HA       THR  27   4.578  -1.878   8.948
  345    HB   THR  27           HB       THR  27   4.141  -0.207  10.467
  346    HG1  THR  27           HG1      THR  27   1.576   0.084   9.295
  347   HG21  THR  27          3HG2      THR  27   2.967   1.496   8.339
  348   HG22  THR  27          1HG2      THR  27   4.513   0.737   7.956
  349   HG23  THR  27          2HG2      THR  27   4.370   1.787   9.367
  350    H    LYS  28           H        LYS  28   3.835  -3.469  10.317
  351    HA   LYS  28           HA       LYS  28   1.012  -3.890  10.835
  352    HB2  LYS  28           2HB      LYS  28   0.794  -6.061   9.725
  353    HB3  LYS  28           1HB      LYS  28   1.186  -4.818   8.540
  354    HG2  LYS  28           2HG      LYS  28   3.261  -6.622   9.821
  355    HG3  LYS  28           1HG      LYS  28   2.498  -6.957   8.271
  356    HD2  LYS  28           2HD      LYS  28   4.099  -5.696   7.319
  357    HD3  LYS  28           1HD      LYS  28   3.344  -4.295   8.077
  358    HE2  LYS  28           2HE      LYS  28   5.398  -4.063   9.058
  359    HE3  LYS  28           1HE      LYS  28   4.756  -5.259  10.181
  360    HZ1  LYS  28           3HZ      LYS  28   6.715  -5.582   8.039
  361    HZ2  LYS  28           1HZ      LYS  28   5.662  -6.880   8.329
  362    HZ3  LYS  28           2HZ      LYS  28   6.658  -6.301   9.578
  363    HA   PRO  29           HA       PRO  29   4.248  -5.777  13.664
  364    HB2  PRO  29           2HB      PRO  29   4.099  -3.907  15.672
  365    HB3  PRO  29           1HB      PRO  29   5.264  -3.824  14.339
  366    HG2  PRO  29           2HG      PRO  29   2.759  -2.246  14.750
  367    HG3  PRO  29           1HG      PRO  29   4.248  -1.788  13.904
  368    HD2  PRO  29           2HD      PRO  29   1.870  -2.618  12.660
  369    HD3  PRO  29           1HD      PRO  29   3.473  -2.571  11.902
  370    H    THR  30           H        THR  30   2.235  -3.895  15.814
  371    HA   THR  30           HA       THR  30   0.120  -5.867  16.079
  372    HB   THR  30           HB       THR  30   1.972  -7.074  17.199
  373    HG1  THR  30           HG1      THR  30  -0.383  -6.584  18.151
  374   HG21  THR  30          3HG2      THR  30   3.455  -6.009  18.507
  375   HG22  THR  30          1HG2      THR  30   2.167  -5.373  19.530
  376   HG23  THR  30          2HG2      THR  30   2.656  -4.495  18.081
  Start of MODEL    9
    1    H1   GLY   1           1H       GLY   1  -3.292  -3.858  10.970
    2    H2   GLY   1           2H       GLY   1  -2.595  -2.912  12.196
    3    H3   GLY   1           3H       GLY   1  -1.779  -4.282  11.611
    4    HA2  GLY   1           1HA      GLY   1  -1.860  -1.676  10.459
    5    HA3  GLY   1           2HA      GLY   1  -0.579  -2.916  10.306
    6    H    ILE   2           H        ILE   2  -0.790  -2.816   7.951
    7    HA   ILE   2           HA       ILE   2  -3.276  -1.694   6.746
    8    HB   ILE   2           HB       ILE   2  -1.312  -0.441   6.128
    9   HG12  ILE   2          2HG1      ILE   2  -2.312  -2.316   3.974
   10   HG13  ILE   2          1HG1      ILE   2  -2.811  -0.654   4.282
   11   HG21  ILE   2          1HG2      ILE   2   0.376  -2.124   6.676
   12   HG22  ILE   2          2HG2      ILE   2   0.618  -1.544   5.029
   13   HG23  ILE   2          3HG2      ILE   2  -0.139  -3.112   5.310
   14   HD11  ILE   2          3HD1      ILE   2  -0.086  -1.548   3.297
   15   HD12  ILE   2          1HD1      ILE   2  -0.524   0.118   3.678
   16   HD13  ILE   2          2HD1      ILE   2  -1.319  -0.720   2.345
   17    H    THR   3           H        THR   3  -1.358  -4.570   6.991
   18    HA   THR   3           HA       THR   3  -2.269  -5.859   4.578
   19    HB   THR   3           HB       THR   3  -1.249  -6.996   7.197
   20    HG1  THR   3           HG1      THR   3  -0.053  -6.725   4.641
   21   HG21  THR   3          3HG2      THR   3  -0.852  -9.052   5.713
   22   HG22  THR   3          1HG2      THR   3  -1.989  -8.317   4.583
   23   HG23  THR   3          2HG2      THR   3  -2.516  -8.749   6.209
   24    H    GLU   4           H        GLU   4  -3.925  -4.952   7.367
   25    HA   GLU   4           HA       GLU   4  -5.898  -7.168   7.095
   26    HB2  GLU   4           2HB      GLU   4  -4.884  -6.299   9.368
   27    HB3  GLU   4           1HB      GLU   4  -6.085  -5.020   9.187
   28    HG2  GLU   4           2HG      GLU   4  -7.413  -6.540  10.277
   29    HG3  GLU   4           1HG      GLU   4  -7.641  -7.152   8.638
   30    H    GLN   5           H        GLN   5  -5.858  -5.377   4.971
   31    HA   GLN   5           HA       GLN   5  -8.557  -4.566   4.749
   32    HB2  GLN   5           2HB      GLN   5  -7.404  -2.858   6.487
   33    HB3  GLN   5           1HB      GLN   5  -6.955  -2.063   4.977
   34    HG2  GLN   5           2HG      GLN   5  -9.068  -1.356   4.615
   35    HG3  GLN   5           1HG      GLN   5  -9.733  -2.954   4.956
   36   HE21  GLN   5          1HE2      GLN   5 -11.466  -2.044   6.290
   37   HE22  GLN   5          2HE2      GLN   5 -11.145  -1.406   7.830
   38    H    CYS   6           H        CYS   6  -5.272  -3.459   3.905
   39    HA   CYS   6           HA       CYS   6  -5.912  -2.679   1.218
   40    HB2  CYS   6           2HB      CYS   6  -3.450  -3.223   2.790
   41    HB3  CYS   6           1HB      CYS   6  -3.293  -3.368   1.044
   42    H    CYS   7           H        CYS   7  -5.756  -5.719   2.685
   43    HA   CYS   7           HA       CYS   7  -5.523  -7.011   0.001
   44    HB2  CYS   7           2HB      CYS   7  -3.632  -7.636   1.374
   45    HB3  CYS   7           1HB      CYS   7  -4.679  -8.023   2.731
   46    H    THR   8           H        THR   8  -7.147  -7.060   3.164
   47    HA   THR   8           HA       THR   8  -9.036  -9.125   2.435
   48    HB   THR   8           HB       THR   8  -9.180  -6.893   4.490
   49    HG1  THR   8           HG1      THR   8  -7.696  -8.884   4.521
   50   HG21  THR   8          3HG2      THR   8 -10.952  -8.699   5.383
   51   HG22  THR   8          1HG2      THR   8 -11.137  -8.974   3.651
   52   HG23  THR   8          2HG2      THR   8 -11.420  -7.369   4.324
   53    H    SER   9           H        SER   9  -8.665  -5.785   1.718
   54    HA   SER   9           HA       SER   9 -11.029  -5.848  -0.038
   55    HG   SER   9           HG       SER   9 -13.077  -4.326   0.703
   56    HB2  SER   9           2HB      SER   9 -10.961  -4.416   2.509
   57    HB3  SER   9           1HB      SER   9 -11.233  -3.328   1.152
   58    H    ILE  10           H        ILE  10 -11.009  -3.244  -0.920
   59    HA   ILE  10           HA       ILE  10  -8.243  -3.023  -1.987
   60    HB   ILE  10           HB       ILE  10 -10.855  -1.791  -2.894
   61   HG12  ILE  10          2HG1      ILE  10  -9.013  -3.724  -4.323
   62   HG13  ILE  10          1HG1      ILE  10 -10.349  -4.268  -3.309
   63   HG21  ILE  10          1HG2      ILE  10  -8.102  -0.999  -3.362
   64   HG22  ILE  10          2HG2      ILE  10  -9.588  -0.217  -3.902
   65   HG23  ILE  10          3HG2      ILE  10  -8.868  -1.506  -4.867
   66   HD11  ILE  10          3HD1      ILE  10 -10.564  -3.677  -5.977
   67   HD12  ILE  10          1HD1      ILE  10 -11.082  -2.167  -5.229
   68   HD13  ILE  10          2HD1      ILE  10 -11.911  -3.674  -4.837
   69    H    CYS  11           H        CYS  11  -6.941  -1.305  -1.454
   70    HA   CYS  11           HA       CYS  11  -7.906   0.537   0.627
   71    HB2  CYS  11           2HB      CYS  11  -5.259  -0.127  -0.600
   72    HB3  CYS  11           1HB      CYS  11  -5.441   1.435   0.197
   73    H    SER  12           H        SER  12  -7.071   2.922   0.302
   74    HA   SER  12           HA       SER  12  -8.034   3.827  -2.381
   75    HG   SER  12           HG       SER  12  -7.518   4.899   1.033
   76    HB2  SER  12           2HB      SER  12  -8.054   6.065  -0.808
   77    HB3  SER  12           1HB      SER  12  -9.447   5.014  -1.049
   78    H    LEU  13           H        LEU  13  -6.224   4.013  -3.592
   79    HA   LEU  13           HA       LEU  13  -3.604   4.385  -3.222
   80    HG   LEU  13           HG       LEU  13  -5.622   3.899  -5.343
   81    HB2  LEU  13           2HB      LEU  13  -4.521   6.662  -4.823
   82    HB3  LEU  13           1HB      LEU  13  -3.493   5.315  -5.277
   83   HD11  LEU  13          1HD1      LEU  13  -7.533   4.892  -4.665
   84   HD12  LEU  13          2HD1      LEU  13  -7.383   6.031  -6.003
   85   HD13  LEU  13          3HD1      LEU  13  -6.682   6.418  -4.432
   86   HD21  LEU  13          3HD2      LEU  13  -4.455   5.749  -7.181
   87   HD22  LEU  13          1HD2      LEU  13  -6.197   5.713  -7.451
   88   HD23  LEU  13          2HD2      LEU  13  -5.261   4.219  -7.528
   89    H    TYR  14           H        TYR  14  -5.915   7.011  -2.849
   90    HA   TYR  14           HA       TYR  14  -4.275   9.123  -2.111
   91    HD1  TYR  14           HD2      TYR  14  -6.687   8.461   1.273
   92    HD2  TYR  14           HD1      TYR  14  -5.780  11.717  -1.380
   93    HE1  TYR  14           HE2      TYR  14  -6.619  10.015   3.207
   94    HE2  TYR  14           HE1      TYR  14  -5.713  13.273   0.553
   95    HH   TYR  14           HH       TYR  14  -6.433  13.469   2.782
   96    HB2  TYR  14           2HB      TYR  14  -6.580   9.586  -2.235
   97    HB3  TYR  14           1HB      TYR  14  -6.992   8.254  -1.160
   98    H    GLN  15           H        GLN  15  -5.721   6.831   0.195
   99    HA   GLN  15           HA       GLN  15  -3.899   7.594   2.324
  100    HB2  GLN  15           2HB      GLN  15  -6.020   5.542   1.937
  101    HB3  GLN  15           1HB      GLN  15  -4.782   5.177   3.135
  102    HG2  GLN  15           2HG      GLN  15  -5.688   6.626   4.600
  103    HG3  GLN  15           1HG      GLN  15  -5.643   7.925   3.407
  104   HE21  GLN  15          1HE2      GLN  15  -7.735   5.780   5.104
  105   HE22  GLN  15          2HE2      GLN  15  -9.155   6.123   4.240
  106    H    LEU  16           H        LEU  16  -4.148   4.999  -0.012
  107    HA   LEU  16           HA       LEU  16  -2.135   3.235   0.694
  108    HG   LEU  16           HG       LEU  16  -2.243   1.802  -2.580
  109    HB2  LEU  16           2HB      LEU  16  -3.639   3.526  -1.502
  110    HB3  LEU  16           1HB      LEU  16  -2.139   4.213  -2.125
  111   HD11  LEU  16          1HD1      LEU  16  -0.247   2.321  -0.372
  112   HD12  LEU  16          2HD1      LEU  16  -0.081   3.011  -1.987
  113   HD13  LEU  16          3HD1      LEU  16  -0.061   1.262  -1.767
  114   HD21  LEU  16          3HD2      LEU  16  -3.636   1.509  -0.368
  115   HD22  LEU  16          1HD2      LEU  16  -2.049   1.279   0.366
  116   HD23  LEU  16          2HD2      LEU  16  -2.589   0.204  -0.924
  117    H    GLU  17           H        GLU  17  -1.819   6.448  -0.709
  118    HA   GLU  17           HA       GLU  17   1.048   6.264  -1.102
  119    HB2  GLU  17           2HB      GLU  17  -0.244   7.773  -2.480
  120    HB3  GLU  17           1HB      GLU  17  -0.861   8.612  -1.059
  121    HG2  GLU  17           2HG      GLU  17   1.588   9.135  -0.496
  122    HG3  GLU  17           1HG      GLU  17   1.967   8.593  -2.131
  123    H    ASN  18           H        ASN  18  -0.952   6.937   1.617
  124    HA   ASN  18           HA       ASN  18   1.048   8.526   3.027
  125    HB2  ASN  18           2HB      ASN  18  -1.407   8.702   3.497
  126    HB3  ASN  18           1HB      ASN  18  -1.355   7.071   4.168
  127   HD21  ASN  18          1HD2      ASN  18   0.102  10.331   4.587
  128   HD22  ASN  18          2HD2      ASN  18   0.408  10.148   6.247
  129    H    TYR  19           H        TYR  19   0.631   5.211   2.385
  130    HA   TYR  19           HA       TYR  19   2.170   4.419   4.796
  131    HD1  TYR  19           HD2      TYR  19   0.296   2.825   6.165
  132    HD2  TYR  19           HD1      TYR  19  -0.999   3.415   2.117
  133    HE1  TYR  19           HE2      TYR  19  -2.034   3.110   6.956
  134    HE2  TYR  19           HE1      TYR  19  -3.332   3.702   2.899
  135    HH   TYR  19           HH       TYR  19  -4.306   2.927   6.094
  136    HB2  TYR  19           2HB      TYR  19   1.196   2.621   2.567
  137    HB3  TYR  19           1HB      TYR  19   1.690   2.152   4.192
  138    H    CYS  20           H        CYS  20   2.928   5.765   1.924
  139    HA   CYS  20           HA       CYS  20   5.014   3.901   1.090
  140    HB2  CYS  20           2HB      CYS  20   5.472   5.366  -0.645
  141    HB3  CYS  20           1HB      CYS  20   3.815   5.743  -0.364
  142    H    ASN  21           H        ASN  21   7.257   5.363   0.756
  143    HA   ASN  21           HA       ASN  21   8.502   5.302   3.306
  144    HB2  ASN  21           2HB      ASN  21   9.857   5.239   1.292
  145    HB3  ASN  21           1HB      ASN  21   9.294   6.838   0.814
  146   HD21  ASN  21          1HD2      ASN  21  11.747   7.304   0.883
  147   HD22  ASN  21          2HD2      ASN  21  12.413   7.755   2.377
  148    HA   PHE   1           HA       PHE   1  -8.385   5.158  -9.192
  149    HD1  PHE   1           HD1      PHE   1  -7.128   6.773  -9.089
  150    HD2  PHE   1           HD2      PHE   1 -10.494   8.856 -10.764
  151    HE1  PHE   1           HE1      PHE   1  -6.362   8.874  -8.016
  152    HE2  PHE   1           HE2      PHE   1  -9.728  10.956  -9.691
  153    HZ   PHE   1           HZ       PHE   1  -7.664  10.966  -8.317
  154    H1   PHE   1           1H       PHE   1  -6.368   5.180 -10.115
  155    H2   PHE   1           2H       PHE   1  -6.964   6.427 -11.103
  156    H3   PHE   1           3H       PHE   1  -6.954   4.825 -11.666
  157    HB2  PHE   1           2HB      PHE   1  -9.319   6.527 -11.732
  158    HB3  PHE   1           1HB      PHE   1 -10.355   6.197 -10.346
  159    H    VAL   2           H        VAL   2  -7.866   2.796  -9.699
  160    HA   VAL   2           HA       VAL   2 -10.135   1.667 -11.223
  161    HB   VAL   2           HB       VAL   2  -7.356   0.605 -11.684
  162   HG11  VAL   2          1HG1      VAL   2  -9.950  -0.281 -12.265
  163   HG12  VAL   2          2HG1      VAL   2  -8.450  -0.902 -12.954
  164   HG13  VAL   2          3HG1      VAL   2  -9.345   0.369 -13.788
  165   HG21  VAL   2          3HG2      VAL   2  -7.455   2.986 -12.379
  166   HG22  VAL   2          1HG2      VAL   2  -8.884   2.630 -13.349
  167   HG23  VAL   2          2HG2      VAL   2  -7.330   1.908 -13.770
  168    H    ASN   3           H        ASN   3  -9.579   1.843  -8.497
  169    HA   ASN   3           HA       ASN   3  -9.595   0.518  -6.548
  170    HB2  ASN   3           2HB      ASN   3 -10.428  -1.451  -8.679
  171    HB3  ASN   3           1HB      ASN   3 -10.296  -1.922  -6.984
  172   HD21  ASN   3          1HD2      ASN   3 -11.273   0.338  -5.666
  173   HD22  ASN   3          2HD2      ASN   3 -12.892   0.607  -6.099
  174    H    GLN   4           H        GLN   4  -7.695   0.067  -5.537
  175    HA   GLN   4           HA       GLN   4  -5.659  -1.487  -7.037
  176    HB2  GLN   4           2HB      GLN   4  -5.277   0.915  -6.093
  177    HB3  GLN   4           1HB      GLN   4  -5.162   0.113  -4.529
  178    HG2  GLN   4           2HG      GLN   4  -2.946   0.419  -5.600
  179    HG3  GLN   4           1HG      GLN   4  -3.336  -1.281  -5.338
  180   HE21  GLN   4          1HE2      GLN   4  -2.450  -2.367  -7.127
  181   HE22  GLN   4          2HE2      GLN   4  -2.702  -1.920  -8.745
  182    H    HIS   5           H        HIS   5  -5.587  -3.606  -6.433
  183    HA   HIS   5           HA       HIS   5  -6.482  -4.410  -3.731
  184    HD2  HIS   5           HD2      HIS   5  -7.064  -4.428  -7.726
  185    HE1  HIS   5           HE1      HIS   5 -10.630  -6.209  -6.314
  186    HE2  HIS   5           HE2      HIS   5  -9.615  -4.739  -8.136
  187    HB2  HIS   5           2HB      HIS   5  -5.385  -6.146  -5.966
  188    HB3  HIS   5           1HB      HIS   5  -6.270  -6.689  -4.544
  189    H    LEU   6           H        LEU   6  -5.019  -4.721  -2.077
  190    HA   LEU   6           HA       LEU   6  -2.142  -4.946  -2.851
  191    HG   LEU   6           HG       LEU   6  -2.418  -1.858  -2.378
  192    HB2  LEU   6           2HB      LEU   6  -3.545  -3.223  -0.890
  193    HB3  LEU   6           1HB      LEU   6  -2.083  -3.973  -0.290
  194   HD11  LEU   6          1HD1      LEU   6   0.122  -2.131  -0.977
  195   HD12  LEU   6          2HD1      LEU   6  -1.250  -2.106   0.133
  196   HD13  LEU   6          3HD1      LEU   6  -1.007  -0.779  -1.003
  197   HD21  LEU   6          3HD2      LEU   6  -0.555  -4.199  -2.637
  198   HD22  LEU   6          1HD2      LEU   6   0.081  -2.603  -3.008
  199   HD23  LEU   6          2HD2      LEU   6  -1.306  -3.224  -3.898
  200    H    CYS   7           H        CYS   7  -0.943  -6.542  -1.926
  201    HA   CYS   7           HA       CYS   7  -1.596  -7.816   0.539
  202    HB2  CYS   7           2HB      CYS   7  -3.471  -8.544  -1.165
  203    HB3  CYS   7           1HB      CYS   7  -2.231  -9.640  -1.767
  204    H    GLY   8           H        GLY   8   0.354  -8.552   1.151
  205    HA2  GLY   8           2HA      GLY   8   2.584  -9.289   1.008
  206    HA3  GLY   8           1HA      GLY   8   1.918 -10.478  -0.109
  207    H    SER   9           H        SER   9   3.152 -10.512  -1.894
  208    HA   SER   9           HA       SER   9   5.014  -8.725  -2.824
  209    HG   SER   9           HG       SER   9   5.971  -9.675  -4.491
  210    HB2  SER   9           2HB      SER   9   4.146 -11.002  -3.825
  211    HB3  SER   9           1HB      SER   9   3.166  -9.952  -4.846
  212    H    ASP  10           H        ASP  10   1.564  -8.654  -3.797
  213    HA   ASP  10           HA       ASP  10   1.785  -6.271  -5.349
  214    HB2  ASP  10           2HB      ASP  10  -0.615  -7.365  -3.850
  215    HB3  ASP  10           1HB      ASP  10  -0.665  -6.169  -5.141
  216    H    LEU  11           H        LEU  11   1.302  -6.814  -1.909
  217    HA   LEU  11           HA       LEU  11   0.400  -4.281  -1.086
  218    HG   LEU  11           HG       LEU  11   2.396  -4.176   1.698
  219    HB2  LEU  11           2HB      LEU  11   0.694  -6.260   0.402
  220    HB3  LEU  11           1HB      LEU  11   2.438  -6.033   0.323
  221   HD11  LEU  11          1HD1      LEU  11  -0.316  -3.666   0.495
  222   HD12  LEU  11          2HD1      LEU  11   1.116  -2.635   0.474
  223   HD13  LEU  11          3HD1      LEU  11   0.192  -2.831   1.963
  224   HD21  LEU  11          3HD2      LEU  11   1.373  -6.064   2.926
  225   HD22  LEU  11          1HD2      LEU  11  -0.223  -5.524   2.406
  226   HD23  LEU  11          2HD2      LEU  11   0.742  -4.512   3.480
  227    H    VAL  12           H        VAL  12   3.805  -5.321  -1.530
  228    HA   VAL  12           HA       VAL  12   4.828  -2.683  -0.931
  229    HB   VAL  12           HB       VAL  12   6.910  -3.622  -2.158
  230   HG11  VAL  12          1HG1      VAL  12   5.654  -4.457   0.394
  231   HG12  VAL  12          2HG1      VAL  12   7.243  -3.751   0.098
  232   HG13  VAL  12          3HG1      VAL  12   6.980  -5.474  -0.171
  233   HG21  VAL  12          3HG2      VAL  12   5.401  -6.216  -1.815
  234   HG22  VAL  12          1HG2      VAL  12   6.929  -5.945  -2.651
  235   HG23  VAL  12          2HG2      VAL  12   5.427  -5.346  -3.349
  236    H    GLU  13           H        GLU  13   3.585  -4.237  -3.799
  237    HA   GLU  13           HA       GLU  13   4.736  -2.589  -5.799
  238    HB2  GLU  13           2HB      GLU  13   3.287  -4.648  -6.146
  239    HB3  GLU  13           1HB      GLU  13   1.890  -3.626  -5.804
  240    HG2  GLU  13           2HG      GLU  13   1.937  -3.285  -8.060
  241    HG3  GLU  13           1HG      GLU  13   3.158  -2.084  -7.633
  242    H    ALA  14           H        ALA  14   1.548  -2.206  -4.197
  243    HA   ALA  14           HA       ALA  14   0.965   0.370  -5.227
  244    HB1  ALA  14           3HB      ALA  14   0.254  -0.647  -2.465
  245    HB2  ALA  14           1HB      ALA  14  -0.607  -1.119  -3.928
  246    HB3  ALA  14           2HB      ALA  14  -0.617   0.564  -3.405
  247    H    LEU  15           H        LEU  15   2.483  -0.522  -2.127
  248    HA   LEU  15           HA       LEU  15   3.105   2.101  -1.257
  249    HG   LEU  15           HG       LEU  15   2.511  -0.820   0.321
  250    HB2  LEU  15           2HB      LEU  15   4.526  -0.516  -0.754
  251    HB3  LEU  15           1HB      LEU  15   4.881   0.979   0.104
  252   HD11  LEU  15          1HD1      LEU  15   4.328   0.796   2.070
  253   HD12  LEU  15          2HD1      LEU  15   3.928  -0.920   2.157
  254   HD13  LEU  15          3HD1      LEU  15   2.757   0.287   2.689
  255   HD21  LEU  15          3HD2      LEU  15   1.518   1.336  -0.479
  256   HD22  LEU  15          1HD2      LEU  15   2.340   2.175   0.837
  257   HD23  LEU  15          2HD2      LEU  15   1.089   0.985   1.195
  258    H    TYR  16           H        TYR  16   4.642  -0.008  -3.572
  259    HA   TYR  16           HA       TYR  16   7.192   1.314  -3.700
  260    HD1  TYR  16           HD2      TYR  16   9.043   1.069  -5.496
  261    HD2  TYR  16           HD1      TYR  16   7.124  -2.566  -4.241
  262    HE1  TYR  16           HE2      TYR  16  11.259   0.075  -4.989
  263    HE2  TYR  16           HE1      TYR  16   9.341  -3.560  -3.733
  264    HH   TYR  16           HH       TYR  16  11.566  -3.310  -3.977
  265    HB2  TYR  16           2HB      TYR  16   5.822  -0.823  -5.077
  266    HB3  TYR  16           1HB      TYR  16   6.582   0.248  -6.251
  267    H    LEU  17           H        LEU  17   4.547   1.394  -6.107
  268    HA   LEU  17           HA       LEU  17   5.533   3.592  -7.562
  269    HG   LEU  17           HG       LEU  17   2.853   1.969  -6.032
  270    HB2  LEU  17           2HB      LEU  17   3.012   4.004  -8.100
  271    HB3  LEU  17           1HB      LEU  17   3.777   2.516  -8.643
  272   HD11  LEU  17          1HD1      LEU  17   1.050   3.798  -7.558
  273   HD12  LEU  17          2HD1      LEU  17   1.280   3.645  -5.816
  274   HD13  LEU  17          3HD1      LEU  17   0.317   2.452  -6.687
  275   HD21  LEU  17          3HD2      LEU  17   1.739   1.295  -8.777
  276   HD22  LEU  17          1HD2      LEU  17   1.249   0.489  -7.287
  277   HD23  LEU  17          2HD2      LEU  17   2.912   0.352  -7.857
  278    H    VAL  18           H        VAL  18   3.214   3.687  -4.816
  279    HA   VAL  18           HA       VAL  18   2.731   6.426  -4.776
  280    HB   VAL  18           HB       VAL  18   2.801   6.152  -2.180
  281   HG11  VAL  18          1HG1      VAL  18   0.693   4.681  -2.372
  282   HG12  VAL  18          2HG1      VAL  18   1.006   4.677  -4.108
  283   HG13  VAL  18          3HG1      VAL  18   0.695   6.198  -3.272
  284   HG21  VAL  18          3HG2      VAL  18   3.911   3.674  -3.096
  285   HG22  VAL  18          1HG2      VAL  18   2.370   3.357  -2.308
  286   HG23  VAL  18          2HG2      VAL  18   3.648   4.209  -1.439
  287    H    CYS  19           H        CYS  19   5.184   5.200  -2.459
  288    HA   CYS  19           HA       CYS  19   6.538   7.758  -2.730
  289    HB2  CYS  19           2HB      CYS  19   7.001   5.396  -1.049
  290    HB3  CYS  19           1HB      CYS  19   8.467   6.194  -1.580
  291    H    GLY  20           H        GLY  20   7.608   4.429  -3.433
  292    HA2  GLY  20           2HA      GLY  20   8.432   4.115  -5.845
  293    HA3  GLY  20           1HA      GLY  20   9.412   5.551  -5.536
  294    H    GLU  21           H        GLU  21  11.192   3.923  -6.076
  295    HA   GLU  21           HA       GLU  21  11.804   1.759  -4.306
  296    HB2  GLU  21           2HB      GLU  21  13.971   1.738  -5.321
  297    HB3  GLU  21           1HB      GLU  21  12.848   2.232  -6.589
  298    HG2  GLU  21           2HG      GLU  21  13.644   4.593  -5.217
  299    HG3  GLU  21           1HG      GLU  21  15.110   3.668  -5.545
  300    H    ARG  22           H        ARG  22  11.873   5.121  -3.805
  301    HA   ARG  22           HA       ARG  22  14.095   5.500  -2.117
  302    HE   ARG  22           HE       ARG  22  11.678   9.510  -0.269
  303    HB2  ARG  22           2HB      ARG  22  11.518   6.829  -2.566
  304    HB3  ARG  22           1HB      ARG  22  12.131   7.028  -0.924
  305    HG2  ARG  22           2HG      ARG  22  14.404   7.417  -2.416
  306    HG3  ARG  22           1HG      ARG  22  13.165   8.121  -3.458
  307    HD2  ARG  22           2HD      ARG  22  13.914   8.890  -0.641
  308    HD3  ARG  22           1HD      ARG  22  13.791   9.918  -2.068
  309   HH11  ARG  22          1HH2      ARG  22  12.332  10.194  -3.510
  310   HH12  ARG  22          2HH2      ARG  22  10.698  10.007  -4.052
  311   HH21  ARG  22          1HH1      ARG  22   9.543   8.809  -1.012
  312   HH22  ARG  22          2HH1      ARG  22   9.121   9.222  -2.640
  313    H    GLY  23           H        GLY  23  11.213   3.673  -1.568
  314    HA2  GLY  23           2HA      GLY  23  11.737   2.015   0.382
  315    HA3  GLY  23           1HA      GLY  23  11.844   3.491   1.340
  316    H    PHE  24           H        PHE  24  10.004   1.781   2.224
  317    HA   PHE  24           HA       PHE  24   7.503   3.226   1.811
  318    HD1  PHE  24           HD1      PHE  24   8.608  -0.401   2.541
  319    HD2  PHE  24           HD2      PHE  24   8.065   0.595  -1.604
  320    HE1  PHE  24           HE1      PHE  24  10.214  -2.182   1.902
  321    HE2  PHE  24           HE2      PHE  24   9.667  -1.185  -2.240
  322    HZ   PHE  24           HZ       PHE  24  10.744  -2.574  -0.489
  323    HB2  PHE  24           2HB      PHE  24   6.382   0.851   1.344
  324    HB3  PHE  24           1HB      PHE  24   6.975   1.855   0.021
  325    H    PHE  25           H        PHE  25   5.714   1.598   3.057
  326    HA   PHE  25           HA       PHE  25   7.071   1.062   5.662
  327    HD1  PHE  25           HD2      PHE  25   6.041  -0.024   7.468
  328    HD2  PHE  25           HD1      PHE  25   4.607   4.021   7.202
  329    HE1  PHE  25           HE2      PHE  25   6.467   0.287   9.890
  330    HE2  PHE  25           HE1      PHE  25   5.035   4.329   9.624
  331    HZ   PHE  25           HZ       PHE  25   5.963   2.463  10.969
  332    HB2  PHE  25           2HB      PHE  25   4.998   2.755   5.212
  333    HB3  PHE  25           1HB      PHE  25   4.105   1.274   5.555
  334    H    TYR  26           H        TYR  26   3.980  -0.085   4.258
  335    HA   TYR  26           HA       TYR  26   3.106  -2.262   4.152
  336    HD1  TYR  26           HD1      TYR  26   2.815  -4.266   4.474
  337    HD2  TYR  26           HD2      TYR  26   6.678  -5.030   2.744
  338    HE1  TYR  26           HE1      TYR  26   2.390  -6.702   4.601
  339    HE2  TYR  26           HE2      TYR  26   6.247  -7.466   2.871
  340    HH   TYR  26           HH       TYR  26   3.211  -8.775   3.393
  341    HB2  TYR  26           2HB      TYR  26   4.861  -2.653   2.526
  342    HB3  TYR  26           1HB      TYR  26   6.066  -2.802   3.795
  343    H    THR  27           H        THR  27   3.238  -1.244   6.691
  344    HA   THR  27           HA       THR  27   4.643  -3.150   8.443
  345    HB   THR  27           HB       THR  27   4.435  -0.716   9.003
  346    HG1  THR  27           HG1      THR  27   3.495  -1.206  11.173
  347   HG21  THR  27          3HG2      THR  27   2.423   0.337   9.213
  348   HG22  THR  27          1HG2      THR  27   1.640  -1.084   9.904
  349   HG23  THR  27          2HG2      THR  27   1.863  -0.961   8.158
  350    H    LYS  28           H        LYS  28   3.715  -4.995   9.189
  351    HA   LYS  28           HA       LYS  28   0.940  -5.595   8.502
  352    HB2  LYS  28           2HB      LYS  28   3.170  -7.163   8.891
  353    HB3  LYS  28           1HB      LYS  28   2.267  -7.426  10.384
  354    HG2  LYS  28           2HG      LYS  28   0.539  -8.475   9.318
  355    HG3  LYS  28           1HG      LYS  28   0.678  -7.467   7.878
  356    HD2  LYS  28           2HD      LYS  28   1.588  -9.326   6.935
  357    HD3  LYS  28           1HD      LYS  28   3.046  -8.837   7.800
  358    HE2  LYS  28           2HE      LYS  28   1.873 -10.167   9.791
  359    HE3  LYS  28           1HE      LYS  28   1.093 -11.004   8.449
  360    HZ1  LYS  28           3HZ      LYS  28   4.018 -10.672   8.834
  361    HZ2  LYS  28           1HZ      LYS  28   3.286 -11.442   7.512
  362    HZ3  LYS  28           2HZ      LYS  28   3.136 -12.105   9.070
  363    HA   PRO  29           HA       PRO  29   0.457  -5.411  13.238
  364    HB2  PRO  29           2HB      PRO  29   2.534  -4.354  14.695
  365    HB3  PRO  29           1HB      PRO  29   2.358  -6.082  14.343
  366    HG2  PRO  29           2HG      PRO  29   4.239  -4.107  13.149
  367    HG3  PRO  29           1HG      PRO  29   4.405  -5.864  13.302
  368    HD2  PRO  29           2HD      PRO  29   3.677  -4.454  10.960
  369    HD3  PRO  29           1HD      PRO  29   3.552  -6.206  11.206
  370    H    THR  30           H        THR  30   0.726  -3.363  15.033
  371    HA   THR  30           HA       THR  30  -0.391  -1.097  13.569
  372    HB   THR  30           HB       THR  30   0.382  -0.977  16.470
  373    HG1  THR  30           HG1      THR  30  -1.296  -2.252  17.004
  374   HG21  THR  30          3HG2      THR  30  -1.582   0.269  14.618
  375   HG22  THR  30          1HG2      THR  30  -0.698   0.982  15.967
  376   HG23  THR  30          2HG2      THR  30  -2.122  -0.013  16.274
  Start of MODEL   10
    1    H1   GLY   1           1H       GLY   1  -3.474   0.832  11.840
    2    H2   GLY   1           2H       GLY   1  -2.545   1.456  10.562
    3    H3   GLY   1           3H       GLY   1  -1.801   0.548  11.790
    4    HA2  GLY   1           1HA      GLY   1  -2.099  -0.901   9.950
    5    HA3  GLY   1           2HA      GLY   1  -3.288  -1.426  11.173
    6    H    ILE   2           H        ILE   2  -1.875  -1.268   8.153
    7    HA   ILE   2           HA       ILE   2  -4.223  -0.205   6.657
    8    HB   ILE   2           HB       ILE   2  -1.795   0.585   6.227
    9   HG12  ILE   2          2HG1      ILE   2  -3.634  -0.422   4.038
   10   HG13  ILE   2          1HG1      ILE   2  -3.604   1.194   4.743
   11   HG21  ILE   2          1HG2      ILE   2  -0.558  -0.825   4.608
   12   HG22  ILE   2          2HG2      ILE   2  -1.773  -2.088   4.801
   13   HG23  ILE   2          3HG2      ILE   2  -0.751  -1.631   6.165
   14   HD11  ILE   2          3HD1      ILE   2  -0.993   0.862   3.902
   15   HD12  ILE   2          1HD1      ILE   2  -2.242   1.732   3.011
   16   HD13  ILE   2          2HD1      ILE   2  -1.910   0.041   2.638
   17    H    THR   3           H        THR   3  -2.633  -3.112   7.547
   18    HA   THR   3           HA       THR   3  -3.440  -4.727   5.292
   19    HB   THR   3           HB       THR   3  -2.629  -5.385   8.132
   20    HG1  THR   3           HG1      THR   3  -0.948  -4.783   6.830
   21   HG21  THR   3          3HG2      THR   3  -2.505  -7.772   7.246
   22   HG22  THR   3          1HG2      THR   3  -3.500  -7.225   5.896
   23   HG23  THR   3          2HG2      THR   3  -4.129  -7.152   7.542
   24    H    GLU   4           H        GLU   4  -5.037  -3.523   8.114
   25    HA   GLU   4           HA       GLU   4  -7.284  -5.429   7.828
   26    HB2  GLU   4           2HB      GLU   4  -6.694  -3.192   9.783
   27    HB3  GLU   4           1HB      GLU   4  -8.230  -4.059   9.763
   28    HG2  GLU   4           2HG      GLU   4  -6.992  -5.284  11.330
   29    HG3  GLU   4           1HG      GLU   4  -6.733  -6.201   9.846
   30    H    GLN   5           H        GLN   5  -6.834  -3.820   5.577
   31    HA   GLN   5           HA       GLN   5  -9.435  -2.687   5.171
   32    HB2  GLN   5           2HB      GLN   5  -7.920  -0.952   6.621
   33    HB3  GLN   5           1HB      GLN   5  -7.461  -0.477   4.984
   34    HG2  GLN   5           2HG      GLN   5  -9.364   0.737   4.940
   35    HG3  GLN   5           1HG      GLN   5 -10.222  -0.801   4.828
   36   HE21  GLN   5          1HE2      GLN   5 -10.954   1.775   6.304
   37   HE22  GLN   5          2HE2      GLN   5 -11.239   1.280   7.902
   38    H    CYS   6           H        CYS   6  -6.005  -2.463   4.208
   39    HA   CYS   6           HA       CYS   6  -6.701  -2.072   1.405
   40    HB2  CYS   6           2HB      CYS   6  -4.237  -2.178   3.005
   41    HB3  CYS   6           1HB      CYS   6  -4.073  -2.873   1.392
   42    H    CYS   7           H        CYS   7  -6.451  -4.733   3.490
   43    HA   CYS   7           HA       CYS   7  -6.281  -6.558   1.135
   44    HB2  CYS   7           2HB      CYS   7  -4.458  -6.792   2.830
   45    HB3  CYS   7           1HB      CYS   7  -5.675  -7.190   4.028
   46    H    THR   8           H        THR   8  -8.108  -5.656   4.003
   47    HA   THR   8           HA       THR   8 -10.007  -7.867   3.749
   48    HB   THR   8           HB       THR   8 -11.203  -5.628   5.064
   49    HG1  THR   8           HG1      THR   8  -9.512  -4.625   5.761
   50   HG21  THR   8          3HG2      THR   8 -11.769  -7.672   5.961
   51   HG22  THR   8          1HG2      THR   8 -10.492  -7.219   7.089
   52   HG23  THR   8          2HG2      THR   8 -10.145  -8.328   5.763
   53    H    SER   9           H        SER   9  -9.513  -4.709   2.467
   54    HA   SER   9           HA       SER   9 -11.722  -5.080   0.541
   55    HG   SER   9           HG       SER   9 -13.928  -2.954   1.701
   56    HB2  SER   9           2HB      SER   9 -11.709  -3.100   2.719
   57    HB3  SER   9           1HB      SER   9 -11.914  -2.377   1.126
   58    H    ILE  10           H        ILE  10 -11.371  -3.474  -1.317
   59    HA   ILE  10           HA       ILE  10  -8.493  -3.274  -1.785
   60    HB   ILE  10           HB       ILE  10  -8.966  -2.808  -4.020
   61   HG12  ILE  10          2HG1      ILE  10 -11.296  -1.953  -4.728
   62   HG13  ILE  10          1HG1      ILE  10 -11.525  -1.548  -3.025
   63   HG21  ILE  10          1HG2      ILE  10 -11.081  -4.509  -2.782
   64   HG22  ILE  10          2HG2      ILE  10  -9.814  -4.939  -3.927
   65   HG23  ILE  10          3HG2      ILE  10 -11.249  -4.080  -4.483
   66   HD11  ILE  10          3HD1      ILE  10 -10.251   0.276  -3.241
   67   HD12  ILE  10          1HD1      ILE  10 -10.159  -0.043  -4.974
   68   HD13  ILE  10          2HD1      ILE  10  -8.924  -0.687  -3.891
   69    H    CYS  11           H        CYS  11  -7.374  -1.240  -2.249
   70    HA   CYS  11           HA       CYS  11  -8.737   1.093  -0.950
   71    HB2  CYS  11           2HB      CYS  11  -6.054   1.658  -0.684
   72    HB3  CYS  11           1HB      CYS  11  -7.074   0.984   0.581
   73    H    SER  12           H        SER  12  -6.850   3.054  -1.563
   74    HA   SER  12           HA       SER  12  -6.959   3.094  -4.554
   75    HG   SER  12           HG       SER  12  -7.455   6.470  -2.396
   76    HB2  SER  12           2HB      SER  12  -7.267   5.533  -4.369
   77    HB3  SER  12           1HB      SER  12  -8.557   4.661  -3.546
   78    H    LEU  13           H        LEU  13  -5.071   3.312  -5.559
   79    HA   LEU  13           HA       LEU  13  -2.529   3.325  -4.427
   80    HG   LEU  13           HG       LEU  13  -0.812   3.752  -6.803
   81    HB2  LEU  13           2HB      LEU  13  -2.990   2.872  -6.749
   82    HB3  LEU  13           1HB      LEU  13  -3.742   4.437  -6.965
   83   HD11  LEU  13          1HD1      LEU  13  -2.141   3.732  -8.901
   84   HD12  LEU  13          2HD1      LEU  13  -0.870   4.956  -8.918
   85   HD13  LEU  13          3HD1      LEU  13  -2.546   5.425  -8.626
   86   HD21  LEU  13          3HD2      LEU  13  -2.114   6.460  -6.352
   87   HD22  LEU  13          1HD2      LEU  13  -0.485   6.301  -7.004
   88   HD23  LEU  13          2HD2      LEU  13  -0.846   5.697  -5.390
   89    H    TYR  14           H        TYR  14  -4.561   6.008  -5.493
   90    HA   TYR  14           HA       TYR  14  -3.016   8.226  -5.102
   91    HD1  TYR  14           HD2      TYR  14  -3.788  10.161  -3.124
   92    HD2  TYR  14           HD1      TYR  14  -6.078   9.883  -6.749
   93    HE1  TYR  14           HE2      TYR  14  -3.533  12.605  -3.474
   94    HE2  TYR  14           HE1      TYR  14  -5.824  12.325  -7.099
   95    HH   TYR  14           HH       TYR  14  -4.801  14.183  -6.402
   96    HB2  TYR  14           2HB      TYR  14  -5.575   7.944  -5.583
   97    HB3  TYR  14           1HB      TYR  14  -5.728   8.193  -3.852
   98    H    GLN  15           H        GLN  15  -4.982   6.935  -2.436
   99    HA   GLN  15           HA       GLN  15  -3.439   8.374  -0.452
  100    HB2  GLN  15           2HB      GLN  15  -4.867   7.392   1.146
  101    HB3  GLN  15           1HB      GLN  15  -5.867   7.575  -0.288
  102    HG2  GLN  15           2HG      GLN  15  -5.424   5.219  -0.895
  103    HG3  GLN  15           1HG      GLN  15  -4.457   5.037   0.568
  104   HE21  GLN  15          1HE2      GLN  15  -7.502   6.898   0.332
  105   HE22  GLN  15          2HE2      GLN  15  -8.378   5.903   1.392
  106    H    LEU  16           H        LEU  16  -3.658   5.017  -1.465
  107    HA   LEU  16           HA       LEU  16  -1.932   3.696   0.241
  108    HG   LEU  16           HG       LEU  16  -1.838   1.721  -0.149
  109    HB2  LEU  16           2HB      LEU  16  -3.065   3.158  -2.210
  110    HB3  LEU  16           1HB      LEU  16  -1.353   3.203  -2.617
  111   HD11  LEU  16          1HD1      LEU  16  -3.952   1.381  -1.734
  112   HD12  LEU  16          2HD1      LEU  16  -3.236   0.030  -0.856
  113   HD13  LEU  16          3HD1      LEU  16  -2.848   0.280  -2.558
  114   HD21  LEU  16          3HD2      LEU  16  -0.811   0.504  -2.677
  115   HD22  LEU  16          1HD2      LEU  16  -0.201   0.338  -1.033
  116   HD23  LEU  16          2HD2      LEU  16   0.125   1.807  -1.955
  117    H    GLU  17           H        GLU  17  -1.182   6.166  -2.105
  118    HA   GLU  17           HA       GLU  17   1.683   5.690  -2.166
  119    HB2  GLU  17           2HB      GLU  17   0.804   6.829  -4.040
  120    HB3  GLU  17           1HB      GLU  17  -0.094   7.965  -3.036
  121    HG2  GLU  17           2HG      GLU  17   1.970   9.022  -2.297
  122    HG3  GLU  17           1HG      GLU  17   2.933   7.812  -3.146
  123    H    ASN  18           H        ASN  18  -0.437   7.490  -0.072
  124    HA   ASN  18           HA       ASN  18   1.506   9.291   1.018
  125    HB2  ASN  18           2HB      ASN  18  -1.240   8.619   1.511
  126    HB3  ASN  18           1HB      ASN  18  -0.372   8.670   3.044
  127   HD21  ASN  18          1HD2      ASN  18  -2.330  10.678   2.118
  128   HD22  ASN  18          2HD2      ASN  18  -1.493  12.150   2.006
  129    H    TYR  19           H        TYR  19   1.374   5.915   1.283
  130    HA   TYR  19           HA       TYR  19   2.541   5.989   4.012
  131    HD1  TYR  19           HD2      TYR  19   1.429   4.292   5.899
  132    HD2  TYR  19           HD1      TYR  19  -0.571   4.370   2.098
  133    HE1  TYR  19           HE2      TYR  19  -0.742   4.617   7.045
  134    HE2  TYR  19           HE1      TYR  19  -2.741   4.699   3.240
  135    HH   TYR  19           HH       TYR  19  -3.099   4.314   6.646
  136    HB2  TYR  19           2HB      TYR  19   1.715   3.672   2.246
  137    HB3  TYR  19           1HB      TYR  19   2.517   3.477   3.807
  138    H    CYS  20           H        CYS  20   4.023   7.125   1.761
  139    HA   CYS  20           HA       CYS  20   6.230   5.150   1.474
  140    HB2  CYS  20           2HB      CYS  20   5.209   6.722  -0.429
  141    HB3  CYS  20           1HB      CYS  20   6.426   7.822   0.176
  142    H    ASN  21           H        ASN  21   8.424   6.557   1.326
  143    HA   ASN  21           HA       ASN  21   8.870   7.459   4.073
  144    HB2  ASN  21           2HB      ASN  21  10.517   6.080   2.725
  145    HB3  ASN  21           1HB      ASN  21  10.818   7.521   1.753
  146   HD21  ASN  21          1HD2      ASN  21  11.505   9.530   3.078
  147   HD22  ASN  21          2HD2      ASN  21  12.485   9.264   4.438
  148    HA   PHE   1           HA       PHE   1  -9.410   5.098 -11.794
  149    HD1  PHE   1           HD1      PHE   1  -9.090   6.938 -11.242
  150    HD2  PHE   1           HD2      PHE   1  -5.309   5.061 -10.430
  151    HE1  PHE   1           HE1      PHE   1  -7.909   8.938 -12.112
  152    HE2  PHE   1           HE2      PHE   1  -4.129   7.061 -11.301
  153    HZ   PHE   1           HZ       PHE   1  -5.429   9.001 -12.142
  154    H1   PHE   1           1H       PHE   1 -10.365   6.209 -10.031
  155    H2   PHE   1           2H       PHE   1 -10.122   4.928  -8.941
  156    H3   PHE   1           3H       PHE   1 -11.329   4.816 -10.132
  157    HB2  PHE   1           2HB      PHE   1  -8.071   4.716  -9.173
  158    HB3  PHE   1           1HB      PHE   1  -7.434   3.761 -10.511
  159    H    VAL   2           H        VAL   2  -8.815   2.512  -9.449
  160    HA   VAL   2           HA       VAL   2 -10.605   0.668 -10.906
  161    HB   VAL   2           HB       VAL   2  -8.619  -0.957 -11.146
  162   HG11  VAL   2          1HG1      VAL   2  -8.181  -0.182 -13.340
  163   HG12  VAL   2          2HG1      VAL   2  -8.371   1.508 -12.871
  164   HG13  VAL   2          3HG1      VAL   2  -9.784   0.457 -12.974
  165   HG21  VAL   2          3HG2      VAL   2  -7.025   1.613 -11.083
  166   HG22  VAL   2          1HG2      VAL   2  -6.415  -0.040 -11.154
  167   HG23  VAL   2          2HG2      VAL   2  -7.163   0.562  -9.674
  168    H    ASN   3           H        ASN   3 -10.994  -1.289  -9.683
  169    HA   ASN   3           HA       ASN   3 -10.458  -0.940  -6.802
  170    HB2  ASN   3           2HB      ASN   3 -12.006  -3.214  -8.040
  171    HB3  ASN   3           1HB      ASN   3 -12.184  -2.512  -6.432
  172   HD21  ASN   3          1HD2      ASN   3 -14.164  -2.763  -8.790
  173   HD22  ASN   3          2HD2      ASN   3 -14.751  -1.185  -8.998
  174    H    GLN   4           H        GLN   4  -8.450  -1.680  -6.185
  175    HA   GLN   4           HA       GLN   4  -7.742  -4.443  -7.030
  176    HB2  GLN   4           2HB      GLN   4  -6.101  -3.453  -8.254
  177    HB3  GLN   4           1HB      GLN   4  -6.249  -1.928  -7.394
  178    HG2  GLN   4           2HG      GLN   4  -5.039  -4.138  -5.829
  179    HG3  GLN   4           1HG      GLN   4  -4.095  -3.574  -7.204
  180   HE21  GLN   4          1HE2      GLN   4  -3.915  -3.106  -4.110
  181   HE22  GLN   4          2HE2      GLN   4  -3.707  -1.425  -3.999
  182    H    HIS   5           H        HIS   5  -7.495  -5.731  -5.363
  183    HA   HIS   5           HA       HIS   5  -7.585  -4.839  -2.616
  184    HD2  HIS   5           HD2      HIS   5  -9.149  -5.391  -1.127
  185    HE1  HIS   5           HE1      HIS   5 -12.011  -7.987  -2.840
  186    HE2  HIS   5           HE2      HIS   5 -11.644  -6.134  -1.124
  187    HB2  HIS   5           2HB      HIS   5  -7.472  -7.435  -4.073
  188    HB3  HIS   5           1HB      HIS   5  -6.947  -7.449  -2.392
  189    H    LEU   6           H        LEU   6  -5.935  -5.069  -1.013
  190    HA   LEU   6           HA       LEU   6  -3.152  -5.423  -2.044
  191    HG   LEU   6           HG       LEU   6  -3.343  -2.339  -2.438
  192    HB2  LEU   6           2HB      LEU   6  -4.400  -3.198  -0.577
  193    HB3  LEU   6           1HB      LEU   6  -2.914  -3.778   0.140
  194   HD11  LEU   6          1HD1      LEU   6  -2.179  -1.690  -0.122
  195   HD12  LEU   6          2HD1      LEU   6  -1.611  -1.055  -1.666
  196   HD13  LEU   6          3HD1      LEU   6  -0.786  -2.421  -0.919
  197   HD21  LEU   6          3HD2      LEU   6  -2.377  -4.185  -3.524
  198   HD22  LEU   6          1HD2      LEU   6  -1.476  -4.678  -2.090
  199   HD23  LEU   6          2HD2      LEU   6  -0.937  -3.295  -3.032
  200    H    CYS   7           H        CYS   7  -1.868  -6.770  -0.909
  201    HA   CYS   7           HA       CYS   7  -2.461  -7.325   1.915
  202    HB2  CYS   7           2HB      CYS   7  -2.509  -9.602  -0.102
  203    HB3  CYS   7           1HB      CYS   7  -2.749  -9.733   1.637
  204    H    GLY   8           H        GLY   8  -0.573  -7.775   2.962
  205    HA2  GLY   8           2HA      GLY   8   1.832  -7.668   3.074
  206    HA3  GLY   8           1HA      GLY   8   1.525  -9.343   2.641
  207    H    SER   9           H        SER   9   2.637 -10.052   0.911
  208    HA   SER   9           HA       SER   9   4.483  -8.649  -0.571
  209    HG   SER   9           HG       SER   9   5.004  -9.578  -2.545
  210    HB2  SER   9           2HB      SER   9   3.724 -11.186  -0.657
  211    HB3  SER   9           1HB      SER   9   2.806 -10.639  -2.057
  212    H    ASP  10           H        ASP  10   1.058  -9.096  -1.520
  213    HA   ASP  10           HA       ASP  10   1.275  -7.381  -3.834
  214    HB2  ASP  10           2HB      ASP  10  -1.006  -8.519  -2.231
  215    HB3  ASP  10           1HB      ASP  10  -1.314  -7.316  -3.480
  216    H    LEU  11           H        LEU  11   0.786  -6.859  -0.450
  217    HA   LEU  11           HA       LEU  11  -0.411  -4.244  -0.564
  218    HG   LEU  11           HG       LEU  11   1.385  -3.345   2.191
  219    HB2  LEU  11           2HB      LEU  11  -0.447  -5.613   1.468
  220    HB3  LEU  11           1HB      LEU  11   1.309  -5.591   1.545
  221   HD11  LEU  11          1HD1      LEU  11  -1.262  -3.220   0.816
  222   HD12  LEU  11          2HD1      LEU  11   0.116  -2.126   0.691
  223   HD13  LEU  11          3HD1      LEU  11  -0.937  -2.062   2.104
  224   HD21  LEU  11          3HD2      LEU  11   0.263  -3.443   4.178
  225   HD22  LEU  11          1HD2      LEU  11  -0.063  -5.094   3.650
  226   HD23  LEU  11          2HD2      LEU  11  -1.273  -3.835   3.403
  227    H    VAL  12           H        VAL  12   2.949  -5.376  -0.441
  228    HA   VAL  12           HA       VAL  12   4.017  -2.664  -0.415
  229    HB   VAL  12           HB       VAL  12   6.197  -3.903  -0.924
  230   HG11  VAL  12          1HG1      VAL  12   4.484  -4.447   1.501
  231   HG12  VAL  12          2HG1      VAL  12   5.809  -3.295   1.334
  232   HG13  VAL  12          3HG1      VAL  12   6.148  -5.024   1.400
  233   HG21  VAL  12          3HG2      VAL  12   4.929  -5.881  -1.919
  234   HG22  VAL  12          1HG2      VAL  12   4.518  -6.329  -0.264
  235   HG23  VAL  12          2HG2      VAL  12   6.206  -6.289  -0.773
  236    H    GLU  13           H        GLU  13   3.073  -5.011  -2.810
  237    HA   GLU  13           HA       GLU  13   4.565  -4.031  -5.041
  238    HB2  GLU  13           2HB      GLU  13   3.249  -6.148  -5.065
  239    HB3  GLU  13           1HB      GLU  13   1.761  -5.200  -5.028
  240    HG2  GLU  13           2HG      GLU  13   2.320  -4.156  -7.159
  241    HG3  GLU  13           1HG      GLU  13   3.883  -4.974  -7.183
  242    H    ALA  14           H        ALA  14   1.224  -3.262  -3.999
  243    HA   ALA  14           HA       ALA  14   0.788  -1.150  -5.852
  244    HB1  ALA  14           3HB      ALA  14  -0.950  -0.387  -4.287
  245    HB2  ALA  14           1HB      ALA  14  -0.280  -1.425  -3.029
  246    HB3  ALA  14           2HB      ALA  14  -1.008  -2.138  -4.469
  247    H    LEU  15           H        LEU  15   1.943  -1.044  -2.486
  248    HA   LEU  15           HA       LEU  15   2.517   1.744  -2.406
  249    HG   LEU  15           HG       LEU  15   1.533  -0.482  -0.430
  250    HB2  LEU  15           2HB      LEU  15   3.944  -0.543  -1.003
  251    HB3  LEU  15           1HB      LEU  15   4.099   1.154  -0.578
  252   HD11  LEU  15          1HD1      LEU  15   1.880  -0.569   1.866
  253   HD12  LEU  15          2HD1      LEU  15   2.997   0.797   1.851
  254   HD13  LEU  15          3HD1      LEU  15   3.517  -0.775   1.243
  255   HD21  LEU  15          3HD2      LEU  15   1.563   2.169  -0.887
  256   HD22  LEU  15          1HD2      LEU  15   1.921   2.217   0.836
  257   HD23  LEU  15          2HD2      LEU  15   0.435   1.464   0.271
  258    H    TYR  16           H        TYR  16   4.298  -1.021  -3.671
  259    HA   TYR  16           HA       TYR  16   6.837   0.187  -3.988
  260    HD1  TYR  16           HD2      TYR  16   8.861  -0.618  -4.943
  261    HD2  TYR  16           HD1      TYR  16   6.265  -3.792  -3.654
  262    HE1  TYR  16           HE2      TYR  16  10.727  -1.617  -3.649
  263    HE2  TYR  16           HE1      TYR  16   8.132  -4.791  -2.360
  264    HH   TYR  16           HH       TYR  16  11.315  -3.990  -2.808
  265    HB2  TYR  16           2HB      TYR  16   5.428  -2.140  -5.079
  266    HB3  TYR  16           1HB      TYR  16   6.593  -1.445  -6.207
  267    H    LEU  17           H        LEU  17   4.516  -0.281  -6.687
  268    HA   LEU  17           HA       LEU  17   5.717   1.437  -8.503
  269    HG   LEU  17           HG       LEU  17   2.862   0.415  -6.811
  270    HB2  LEU  17           2HB      LEU  17   3.239   2.010  -9.208
  271    HB3  LEU  17           1HB      LEU  17   3.886   0.391  -9.445
  272   HD11  LEU  17          1HD1      LEU  17   1.596   2.431  -7.286
  273   HD12  LEU  17          2HD1      LEU  17   0.486   1.061  -7.244
  274   HD13  LEU  17          3HD1      LEU  17   0.993   1.739  -8.791
  275   HD21  LEU  17          3HD2      LEU  17   0.951  -0.844  -8.362
  276   HD22  LEU  17          1HD2      LEU  17   2.437  -1.599  -7.779
  277   HD23  LEU  17          2HD2      LEU  17   2.378  -0.900  -9.397
  278    H    VAL  18           H        VAL  18   3.639   2.390  -5.769
  279    HA   VAL  18           HA       VAL  18   3.714   5.201  -6.557
  280    HB   VAL  18           HB       VAL  18   2.682   5.630  -4.357
  281   HG11  VAL  18          1HG1      VAL  18   1.360   3.171  -5.455
  282   HG12  VAL  18          2HG1      VAL  18   1.439   4.645  -6.421
  283   HG13  VAL  18          3HG1      VAL  18   0.616   4.654  -4.861
  284   HG21  VAL  18          3HG2      VAL  18   3.885   3.910  -3.067
  285   HG22  VAL  18          1HG2      VAL  18   3.020   2.660  -3.958
  286   HG23  VAL  18          2HG2      VAL  18   2.142   3.742  -2.884
  287    H    CYS  19           H        CYS  19   5.264   3.229  -4.084
  288    HA   CYS  19           HA       CYS  19   6.840   5.401  -3.027
  289    HB2  CYS  19           2HB      CYS  19   6.675   2.471  -2.635
  290    HB3  CYS  19           1HB      CYS  19   8.265   3.164  -2.348
  291    H    GLY  20           H        GLY  20   7.911   2.486  -4.759
  292    HA2  GLY  20           2HA      GLY  20   9.504   2.329  -6.526
  293    HA3  GLY  20           1HA      GLY  20   9.722   4.081  -6.448
  294    H    GLU  21           H        GLU  21  12.038   3.883  -6.349
  295    HA   GLU  21           HA       GLU  21  13.334   2.269  -4.324
  296    HB2  GLU  21           2HB      GLU  21  14.258   3.323  -6.575
  297    HB3  GLU  21           1HB      GLU  21  14.670   4.669  -5.512
  298    HG2  GLU  21           2HG      GLU  21  15.474   2.436  -4.068
  299    HG3  GLU  21           1HG      GLU  21  15.914   2.034  -5.728
  300    H    ARG  22           H        ARG  22  11.449   4.964  -3.962
  301    HA   ARG  22           HA       ARG  22  13.051   6.487  -2.094
  302    HE   ARG  22           HE       ARG  22  10.531   9.620  -1.567
  303    HB2  ARG  22           2HB      ARG  22  10.060   6.406  -2.574
  304    HB3  ARG  22           1HB      ARG  22  10.866   7.573  -1.524
  305    HG2  ARG  22           2HG      ARG  22  12.330   8.148  -3.555
  306    HG3  ARG  22           1HG      ARG  22  11.160   7.245  -4.516
  307    HD2  ARG  22           2HD      ARG  22  10.512   9.575  -4.559
  308    HD3  ARG  22           1HD      ARG  22   9.349   8.704  -3.559
  309   HH11  ARG  22          1HH2      ARG  22  13.054  10.432  -3.034
  310   HH12  ARG  22          2HH2      ARG  22  12.855  12.150  -3.137
  311   HH21  ARG  22          1HH1      ARG  22   9.465  12.068  -2.410
  312   HH22  ARG  22          2HH1      ARG  22  10.823  13.076  -2.785
  313    H    GLY  23           H        GLY  23  11.392   3.508  -1.832
  314    HA2  GLY  23           2HA      GLY  23  11.506   2.092   0.109
  315    HA3  GLY  23           1HA      GLY  23  11.893   3.507   1.088
  316    H    PHE  24           H        PHE  24   9.753   1.393   1.421
  317    HA   PHE  24           HA       PHE  24   7.407   3.250   1.440
  318    HD1  PHE  24           HD2      PHE  24   8.884   1.098  -1.038
  319    HD2  PHE  24           HD1      PHE  24   7.145  -1.250   2.115
  320    HE1  PHE  24           HE2      PHE  24  10.378  -0.796  -1.622
  321    HE2  PHE  24           HE1      PHE  24   8.640  -3.141   1.531
  322    HZ   PHE  24           HZ       PHE  24  10.256  -2.915  -0.337
  323    HB2  PHE  24           2HB      PHE  24   6.202   0.844   1.566
  324    HB3  PHE  24           1HB      PHE  24   6.591   1.626   0.035
  325    H    PHE  25           H        PHE  25   5.681   1.925   3.073
  326    HA   PHE  25           HA       PHE  25   7.176   1.838   5.662
  327    HD1  PHE  25           HD1      PHE  25   7.698   3.790   6.098
  328    HD2  PHE  25           HD2      PHE  25   3.853   3.256   7.947
  329    HE1  PHE  25           HE1      PHE  25   8.515   4.946   8.133
  330    HE2  PHE  25           HE2      PHE  25   4.675   4.410   9.981
  331    HZ   PHE  25           HZ       PHE  25   7.004   5.256  10.075
  332    HB2  PHE  25           2HB      PHE  25   5.056   3.477   4.864
  333    HB3  PHE  25           1HB      PHE  25   4.286   2.249   5.863
  334    H    TYR  26           H        TYR  26   3.871   0.762   4.796
  335    HA   TYR  26           HA       TYR  26   2.765  -1.227   5.395
  336    HD1  TYR  26           HD1      TYR  26   1.847  -3.116   5.158
  337    HD2  TYR  26           HD2      TYR  26   5.830  -4.632   4.583
  338    HE1  TYR  26           HE1      TYR  26   1.076  -5.382   5.795
  339    HE2  TYR  26           HE2      TYR  26   5.054  -6.897   5.219
  340    HH   TYR  26           HH       TYR  26   3.247  -8.180   5.608
  341    HB2  TYR  26           2HB      TYR  26   4.005  -2.089   3.474
  342    HB3  TYR  26           1HB      TYR  26   5.438  -2.308   4.457
  343    H    THR  27           H        THR  27   3.722   0.099   7.604
  344    HA   THR  27           HA       THR  27   5.377  -1.665   9.244
  345    HB   THR  27           HB       THR  27   5.538   0.679   9.705
  346    HG1  THR  27           HG1      THR  27   4.477   0.732  11.871
  347   HG21  THR  27          3HG2      THR  27   2.527   0.545   9.702
  348   HG22  THR  27          1HG2      THR  27   3.580   1.582   8.741
  349   HG23  THR  27          2HG2      THR  27   3.379   1.887  10.466
  350    H    LYS  28           H        LYS  28   4.647  -3.299  10.526
  351    HA   LYS  28           HA       LYS  28   2.123  -3.283  11.868
  352    HB2  LYS  28           2HB      LYS  28   0.830  -4.857  10.618
  353    HB3  LYS  28           1HB      LYS  28   1.379  -3.645   9.465
  354    HG2  LYS  28           2HG      LYS  28   2.448  -5.211   8.253
  355    HG3  LYS  28           1HG      LYS  28   3.339  -5.765   9.670
  356    HD2  LYS  28           2HD      LYS  28   0.756  -6.708  10.106
  357    HD3  LYS  28           1HD      LYS  28   0.999  -6.940   8.375
  358    HE2  LYS  28           2HE      LYS  28   2.821  -8.373   8.688
  359    HE3  LYS  28           1HE      LYS  28   3.151  -7.761  10.308
  360    HZ1  LYS  28           3HZ      LYS  28   0.665  -9.220   9.630
  361    HZ2  LYS  28           1HZ      LYS  28   1.285  -8.874  11.170
  362    HZ3  LYS  28           2HZ      LYS  28   2.067 -10.009  10.177
  363    HA   PRO  29           HA       PRO  29   5.329  -6.457  13.048
  364    HB2  PRO  29           2HB      PRO  29   6.318  -5.149  15.253
  365    HB3  PRO  29           1HB      PRO  29   7.002  -4.987  13.627
  366    HG2  PRO  29           2HG      PRO  29   5.327  -3.057  15.157
  367    HG3  PRO  29           1HG      PRO  29   6.510  -2.749  13.875
  368    HD2  PRO  29           2HD      PRO  29   3.696  -2.771  13.566
  369    HD3  PRO  29           1HD      PRO  29   4.898  -2.779  12.264
  370    H    THR  30           H        THR  30   5.641  -6.764  15.863
  371    HA   THR  30           HA       THR  30   3.194  -8.041  16.597
  372    HB   THR  30           HB       THR  30   5.563  -7.138  18.259
  373    HG1  THR  30           HG1      THR  30   6.227  -9.174  17.977
  374   HG21  THR  30          3HG2      THR  30   4.374  -7.598  20.107
  375   HG22  THR  30          1HG2      THR  30   4.110  -9.237  19.513
  376   HG23  THR  30          2HG2      THR  30   2.957  -7.961  19.122
  Start of MODEL   11
    1    H1   GLY   1           1H       GLY   1   0.096  -1.673  10.264
    2    H2   GLY   1           2H       GLY   1  -0.368  -0.197  10.964
    3    H3   GLY   1           3H       GLY   1  -0.309  -0.356   9.274
    4    HA2  GLY   1           1HA      GLY   1  -2.056  -2.259   9.995
    5    HA3  GLY   1           2HA      GLY   1  -2.451  -0.973  11.174
    6    H    ILE   2           H        ILE   2  -1.213  -1.730   7.790
    7    HA   ILE   2           HA       ILE   2  -3.819  -0.851   6.643
    8    HB   ILE   2           HB       ILE   2  -1.414   0.096   6.000
    9   HG12  ILE   2          2HG1      ILE   2  -3.704  -0.534   4.121
   10   HG13  ILE   2          1HG1      ILE   2  -3.425   0.960   5.014
   11   HG21  ILE   2          1HG2      ILE   2  -1.701  -2.026   3.883
   12   HG22  ILE   2          2HG2      ILE   2  -0.766  -2.345   5.343
   13   HG23  ILE   2          3HG2      ILE   2  -0.299  -1.028   4.268
   14   HD11  ILE   2          3HD1      ILE   2  -2.628   1.541   2.903
   15   HD12  ILE   2          1HD1      ILE   2  -2.009  -0.079   2.581
   16   HD13  ILE   2          2HD1      ILE   2  -1.150   0.988   3.690
   17    H    THR   3           H        THR   3  -1.617  -3.565   6.894
   18    HA   THR   3           HA       THR   3  -2.602  -5.178   4.781
   19    HB   THR   3           HB       THR   3  -1.560  -6.002   7.505
   20    HG1  THR   3           HG1      THR   3  -0.239  -4.781   5.904
   21   HG21  THR   3          3HG2      THR   3  -2.660  -7.922   6.721
   22   HG22  THR   3          1HG2      THR   3  -1.018  -8.140   6.118
   23   HG23  THR   3          2HG2      THR   3  -2.285  -7.562   5.036
   24    H    GLU   4           H        GLU   4  -3.957  -4.410   7.896
   25    HA   GLU   4           HA       GLU   4  -6.080  -6.452   7.581
   26    HB2  GLU   4           2HB      GLU   4  -5.024  -5.968   9.828
   27    HB3  GLU   4           1HB      GLU   4  -5.776  -4.374   9.769
   28    HG2  GLU   4           2HG      GLU   4  -7.408  -5.555  10.918
   29    HG3  GLU   4           1HG      GLU   4  -7.961  -5.787   9.259
   30    H    GLN   5           H        GLN   5  -6.093  -4.602   5.529
   31    HA   GLN   5           HA       GLN   5  -8.770  -3.577   5.650
   32    HB2  GLN   5           2HB      GLN   5  -7.100  -1.911   7.018
   33    HB3  GLN   5           1HB      GLN   5  -6.944  -1.254   5.387
   34    HG2  GLN   5           2HG      GLN   5  -9.673  -1.889   6.470
   35    HG3  GLN   5           1HG      GLN   5  -8.871  -0.392   6.953
   36   HE21  GLN   5          1HE2      GLN   5  -9.149   1.344   5.542
   37   HE22  GLN   5          2HE2      GLN   5  -9.619   1.211   3.917
   38    H    CYS   6           H        CYS   6  -5.573  -2.877   4.191
   39    HA   CYS   6           HA       CYS   6  -6.712  -2.328   1.585
   40    HB2  CYS   6           2HB      CYS   6  -4.015  -2.484   2.763
   41    HB3  CYS   6           1HB      CYS   6  -4.100  -2.975   1.070
   42    H    CYS   7           H        CYS   7  -6.452  -5.158   3.280
   43    HA   CYS   7           HA       CYS   7  -6.227  -6.735   0.757
   44    HB2  CYS   7           2HB      CYS   7  -4.433  -7.180   2.423
   45    HB3  CYS   7           1HB      CYS   7  -5.662  -7.647   3.589
   46    H    THR   8           H        THR   8  -7.937  -6.433   3.865
   47    HA   THR   8           HA       THR   8  -9.898  -8.465   3.257
   48    HB   THR   8           HB       THR   8  -9.400  -7.467   5.558
   49    HG1  THR   8           HG1      THR   8 -12.126  -7.261   4.878
   50   HG21  THR   8          3HG2      THR   8  -9.886  -5.307   6.022
   51   HG22  THR   8          1HG2      THR   8 -11.418  -5.375   5.150
   52   HG23  THR   8          2HG2      THR   8  -9.916  -5.084   4.273
   53    H    SER   9           H        SER   9  -9.297  -5.374   2.015
   54    HA   SER   9           HA       SER   9 -11.764  -5.456   0.426
   55    HG   SER   9           HG       SER   9 -13.757  -3.973   1.862
   56    HB2  SER   9           2HB      SER   9 -11.199  -3.332   2.490
   57    HB3  SER   9           1HB      SER   9 -12.124  -2.943   1.043
   58    H    ILE  10           H        ILE  10 -11.556  -2.909  -0.718
   59    HA   ILE  10           HA       ILE  10  -8.827  -3.061  -1.924
   60    HB   ILE  10           HB       ILE  10 -11.415  -1.995  -3.080
   61   HG12  ILE  10          2HG1      ILE  10  -9.828  -4.239  -4.249
   62   HG13  ILE  10          1HG1      ILE  10 -10.782  -4.576  -2.805
   63   HG21  ILE  10          1HG2      ILE  10 -10.159  -0.909  -4.598
   64   HG22  ILE  10          2HG2      ILE  10  -9.329  -2.413  -5.001
   65   HG23  ILE  10          3HG2      ILE  10  -8.706  -1.380  -3.715
   66   HD11  ILE  10          3HD1      ILE  10 -11.734  -4.526  -5.418
   67   HD12  ILE  10          1HD1      ILE  10 -12.265  -2.987  -4.741
   68   HD13  ILE  10          2HD1      ILE  10 -12.717  -4.499  -3.953
   69    H    CYS  11           H        CYS  11  -7.609  -1.123  -2.127
   70    HA   CYS  11           HA       CYS  11  -8.827   1.243  -0.741
   71    HB2  CYS  11           2HB      CYS  11  -6.124   1.660  -0.485
   72    HB3  CYS  11           1HB      CYS  11  -7.156   0.971   0.764
   73    H    SER  12           H        SER  12  -7.513   3.329  -1.367
   74    HA   SER  12           HA       SER  12  -7.254   3.294  -4.345
   75    HG   SER  12           HG       SER  12  -7.704   6.614  -2.232
   76    HB2  SER  12           2HB      SER  12  -7.644   5.773  -4.136
   77    HB3  SER  12           1HB      SER  12  -8.999   4.789  -3.589
   78    H    LEU  13           H        LEU  13  -5.184   3.343  -5.049
   79    HA   LEU  13           HA       LEU  13  -2.876   3.597  -3.607
   80    HG   LEU  13           HG       LEU  13  -2.680   6.174  -6.029
   81    HB2  LEU  13           2HB      LEU  13  -1.785   3.828  -5.628
   82    HB3  LEU  13           1HB      LEU  13  -3.340   3.215  -6.172
   83   HD11  LEU  13          1HD1      LEU  13  -2.226   4.090  -8.113
   84   HD12  LEU  13          2HD1      LEU  13  -1.197   5.442  -7.638
   85   HD13  LEU  13          3HD1      LEU  13  -2.642   5.729  -8.610
   86   HD21  LEU  13          3HD2      LEU  13  -5.132   5.107  -6.200
   87   HD22  LEU  13          1HD2      LEU  13  -4.672   4.949  -7.895
   88   HD23  LEU  13          2HD2      LEU  13  -4.685   6.537  -7.130
   89    H    TYR  14           H        TYR  14  -4.948   6.221  -4.710
   90    HA   TYR  14           HA       TYR  14  -3.385   8.475  -4.414
   91    HD1  TYR  14           HD1      TYR  14  -3.987  10.606  -5.053
   92    HD2  TYR  14           HD2      TYR  14  -6.671   9.847  -1.787
   93    HE1  TYR  14           HE1      TYR  14  -3.795  12.980  -4.346
   94    HE2  TYR  14           HE2      TYR  14  -6.483  12.219  -1.078
   95    HH   TYR  14           HH       TYR  14  -5.880  14.488  -2.400
   96    HB2  TYR  14           2HB      TYR  14  -5.802   8.596  -4.910
   97    HB3  TYR  14           1HB      TYR  14  -6.157   8.126  -3.251
   98    H    GLN  15           H        GLN  15  -5.289   7.262  -1.677
   99    HA   GLN  15           HA       GLN  15  -3.662   8.610   0.281
  100    HB2  GLN  15           2HB      GLN  15  -5.879   6.632   0.318
  101    HB3  GLN  15           1HB      GLN  15  -4.846   6.677   1.746
  102    HG2  GLN  15           2HG      GLN  15  -6.044   9.182   0.554
  103    HG3  GLN  15           1HG      GLN  15  -6.884   8.229   1.779
  104   HE21  GLN  15          1HE2      GLN  15  -6.436  10.574   2.848
  105   HE22  GLN  15          2HE2      GLN  15  -5.028  10.651   3.794
  106    H    LEU  16           H        LEU  16  -3.810   5.334  -0.964
  107    HA   LEU  16           HA       LEU  16  -2.098   3.892   0.647
  108    HG   LEU  16           HG       LEU  16  -0.795   1.976  -0.705
  109    HB2  LEU  16           2HB      LEU  16  -3.204   3.465  -1.778
  110    HB3  LEU  16           1HB      LEU  16  -1.529   3.718  -2.266
  111   HD11  LEU  16          1HD1      LEU  16  -3.665   2.162   0.085
  112   HD12  LEU  16          2HD1      LEU  16  -2.237   1.928   1.095
  113   HD13  LEU  16          3HD1      LEU  16  -2.891   0.580   0.164
  114   HD21  LEU  16          3HD2      LEU  16  -1.174   0.497  -2.349
  115   HD22  LEU  16          1HD2      LEU  16  -2.358   1.605  -3.038
  116   HD23  LEU  16          2HD2      LEU  16  -2.871   0.368  -1.889
  117    H    GLU  17           H        GLU  17  -1.229   6.405  -1.660
  118    HA   GLU  17           HA       GLU  17   1.617   5.925  -1.530
  119    HB2  GLU  17           2HB      GLU  17   0.900   7.062  -3.455
  120    HB3  GLU  17           1HB      GLU  17  -0.114   8.173  -2.537
  121    HG2  GLU  17           2HG      GLU  17   1.869   9.270  -1.614
  122    HG3  GLU  17           1HG      GLU  17   2.919   8.107  -2.424
  123    H    ASN  18           H        ASN  18  -0.604   7.502   0.578
  124    HA   ASN  18           HA       ASN  18   1.218   9.402   1.769
  125    HB2  ASN  18           2HB      ASN  18  -1.494   8.421   2.264
  126    HB3  ASN  18           1HB      ASN  18  -0.609   8.756   3.750
  127   HD21  ASN  18          1HD2      ASN  18  -2.857  10.332   2.462
  128   HD22  ASN  18          2HD2      ASN  18  -2.234  11.898   2.263
  129    H    TYR  19           H        TYR  19   1.301   6.065   1.796
  130    HA   TYR  19           HA       TYR  19   2.326   5.906   4.575
  131    HD1  TYR  19           HD1      TYR  19  -0.525   4.653   2.207
  132    HD2  TYR  19           HD2      TYR  19   1.003   3.669   6.102
  133    HE1  TYR  19           HE1      TYR  19  -2.829   4.710   3.122
  134    HE2  TYR  19           HE2      TYR  19  -1.302   3.726   7.017
  135    HH   TYR  19           HH       TYR  19  -3.523   4.911   6.338
  136    HB2  TYR  19           2HB      TYR  19   1.754   3.770   2.504
  137    HB3  TYR  19           1HB      TYR  19   2.394   3.442   4.114
  138    H    CYS  20           H        CYS  20   3.799   7.264   2.310
  139    HA   CYS  20           HA       CYS  20   6.128   5.433   2.053
  140    HB2  CYS  20           2HB      CYS  20   5.044   6.984   0.159
  141    HB3  CYS  20           1HB      CYS  20   6.203   8.129   0.798
  142    H    ASN  21           H        ASN  21   8.232   6.986   1.942
  143    HA   ASN  21           HA       ASN  21   8.451   8.059   4.696
  144    HB2  ASN  21           2HB      ASN  21  10.128   6.401   3.775
  145    HB3  ASN  21           1HB      ASN  21  10.653   7.657   2.654
  146   HD21  ASN  21          1HD2      ASN  21  11.837   6.315   5.281
  147   HD22  ASN  21          2HD2      ASN  21  12.427   7.659   6.132
  148    HA   PHE   1           HA       PHE   1  -7.286   4.616 -10.478
  149    HD1  PHE   1           HD2      PHE   1  -6.771   6.451 -10.423
  150    HD2  PHE   1           HD1      PHE   1  -5.017   5.727 -14.279
  151    HE1  PHE   1           HE2      PHE   1  -5.210   8.347 -10.069
  152    HE2  PHE   1           HE1      PHE   1  -3.456   7.623 -13.925
  153    HZ   PHE   1           HZ       PHE   1  -3.553   8.933 -11.821
  154    H1   PHE   1           1H       PHE   1  -4.972   3.818 -11.600
  155    H2   PHE   1           2H       PHE   1  -5.752   2.332 -11.337
  156    H3   PHE   1           3H       PHE   1  -5.485   3.395 -10.040
  157    HB2  PHE   1           2HB      PHE   1  -6.586   4.196 -13.399
  158    HB3  PHE   1           1HB      PHE   1  -7.925   5.195 -12.834
  159    H    VAL   2           H        VAL   2  -7.307   1.797 -10.026
  160    HA   VAL   2           HA       VAL   2 -10.003   1.193 -11.022
  161    HB   VAL   2           HB       VAL   2  -8.548   0.336 -12.840
  162   HG11  VAL   2          1HG1      VAL   2  -7.422  -1.732 -11.003
  163   HG12  VAL   2          2HG1      VAL   2  -6.694  -0.126 -10.965
  164   HG13  VAL   2          3HG1      VAL   2  -6.733  -1.041 -12.472
  165   HG21  VAL   2          3HG2      VAL   2  -9.489  -2.062 -11.279
  166   HG22  VAL   2          1HG2      VAL   2  -9.612  -1.750 -13.011
  167   HG23  VAL   2          2HG2      VAL   2 -10.657  -0.887 -11.884
  168    H    ASN   3           H        ASN   3 -10.971  -0.574  -9.803
  169    HA   ASN   3           HA       ASN   3 -10.365  -0.659  -7.073
  170    HB2  ASN   3           2HB      ASN   3 -11.444  -3.092  -8.492
  171    HB3  ASN   3           1HB      ASN   3 -11.875  -2.466  -6.900
  172   HD21  ASN   3          1HD2      ASN   3 -13.914  -1.513  -6.931
  173   HD22  ASN   3          2HD2      ASN   3 -14.569  -0.648  -8.236
  174    H    GLN   4           H        GLN   4  -8.312  -1.140  -6.326
  175    HA   GLN   4           HA       GLN   4  -7.038  -3.601  -7.431
  176    HB2  GLN   4           2HB      GLN   4  -5.500  -1.986  -8.024
  177    HB3  GLN   4           1HB      GLN   4  -5.972  -0.904  -6.720
  178    HG2  GLN   4           2HG      GLN   4  -4.696  -3.429  -5.840
  179    HG3  GLN   4           1HG      GLN   4  -3.647  -2.338  -6.744
  180   HE21  GLN   4          1HE2      GLN   4  -2.408  -1.446  -5.037
  181   HE22  GLN   4          2HE2      GLN   4  -3.084  -0.588  -3.737
  182    H    HIS   5           H        HIS   5  -6.503  -5.182  -6.016
  183    HA   HIS   5           HA       HIS   5  -7.251  -4.837  -3.173
  184    HD2  HIS   5           HD2      HIS   5  -8.862  -5.695  -1.917
  185    HE1  HIS   5           HE1      HIS   5 -11.480  -8.042  -4.264
  186    HE2  HIS   5           HE2      HIS   5 -11.310  -6.521  -2.223
  187    HB2  HIS   5           2HB      HIS   5  -6.907  -7.106  -5.062
  188    HB3  HIS   5           1HB      HIS   5  -6.487  -7.435  -3.383
  189    H    LEU   6           H        LEU   6  -5.730  -5.349  -1.458
  190    HA   LEU   6           HA       LEU   6  -2.888  -5.537  -2.308
  191    HG   LEU   6           HG       LEU   6  -3.026  -2.429  -2.592
  192    HB2  LEU   6           2HB      LEU   6  -4.217  -3.356  -0.846
  193    HB3  LEU   6           1HB      LEU   6  -2.787  -3.967  -0.044
  194   HD11  LEU   6          1HD1      LEU   6  -0.501  -2.508  -1.106
  195   HD12  LEU   6          2HD1      LEU   6  -1.886  -2.086  -0.098
  196   HD13  LEU   6          3HD1      LEU   6  -1.515  -1.131  -1.532
  197   HD21  LEU   6          3HD2      LEU   6  -0.597  -3.396  -3.067
  198   HD22  LEU   6          1HD2      LEU   6  -2.014  -4.238  -3.693
  199   HD23  LEU   6          2HD2      LEU   6  -1.217  -4.813  -2.228
  200    H    CYS   7           H        CYS   7  -1.700  -6.943  -1.169
  201    HA   CYS   7           HA       CYS   7  -2.417  -7.632   1.591
  202    HB2  CYS   7           2HB      CYS   7  -2.403  -9.812  -0.529
  203    HB3  CYS   7           1HB      CYS   7  -2.743 -10.012   1.187
  204    H    GLY   8           H        GLY   8  -0.639  -8.417   2.685
  205    HA2  GLY   8           2HA      GLY   8   1.761  -8.304   2.951
  206    HA3  GLY   8           1HA      GLY   8   1.483  -9.902   2.276
  207    H    SER   9           H        SER   9   2.777 -10.364   0.599
  208    HA   SER   9           HA       SER   9   4.663  -8.754  -0.597
  209    HG   SER   9           HG       SER   9   4.818 -12.069  -0.931
  210    HB2  SER   9           2HB      SER   9   3.108 -11.104  -1.626
  211    HB3  SER   9           1HB      SER   9   4.204 -10.256  -2.713
  212    H    ASP  10           H        ASP  10   1.324  -9.201  -1.822
  213    HA   ASP  10           HA       ASP  10   1.608  -7.359  -3.999
  214    HB2  ASP  10           2HB      ASP  10  -0.772  -8.404  -2.454
  215    HB3  ASP  10           1HB      ASP  10  -0.953  -7.260  -3.780
  216    H    LEU  11           H        LEU  11   1.060  -6.981  -0.607
  217    HA   LEU  11           HA       LEU  11  -0.078  -4.377  -0.511
  218    HG   LEU  11           HG       LEU  11   1.435  -3.558   2.472
  219    HB2  LEU  11           2HB      LEU  11   0.298  -6.056   1.392
  220    HB3  LEU  11           1HB      LEU  11   1.966  -5.509   1.425
  221   HD11  LEU  11          1HD1      LEU  11  -0.680  -2.296   2.045
  222   HD12  LEU  11          2HD1      LEU  11  -1.153  -3.552   0.900
  223   HD13  LEU  11          3HD1      LEU  11   0.274  -2.563   0.585
  224   HD21  LEU  11          3HD2      LEU  11  -1.055  -3.915   3.519
  225   HD22  LEU  11          1HD2      LEU  11   0.393  -4.712   4.134
  226   HD23  LEU  11          2HD2      LEU  11  -0.670  -5.559   3.011
  227    H    VAL  12           H        VAL  12   3.353  -5.382  -0.417
  228    HA   VAL  12           HA       VAL  12   4.353  -2.681  -0.459
  229    HB   VAL  12           HB       VAL  12   6.504  -3.838  -1.184
  230   HG11  VAL  12          1HG1      VAL  12   5.065  -3.892   1.290
  231   HG12  VAL  12          2HG1      VAL  12   6.812  -3.898   1.046
  232   HG13  VAL  12          3HG1      VAL  12   5.927  -5.422   1.121
  233   HG21  VAL  12          3HG2      VAL  12   5.134  -5.746  -2.251
  234   HG22  VAL  12          1HG2      VAL  12   4.942  -6.358  -0.608
  235   HG23  VAL  12          2HG2      VAL  12   6.553  -6.208  -1.311
  236    H    GLU  13           H        GLU  13   3.368  -4.957  -2.939
  237    HA   GLU  13           HA       GLU  13   4.648  -3.823  -5.196
  238    HB2  GLU  13           2HB      GLU  13   3.097  -5.923  -4.991
  239    HB3  GLU  13           1HB      GLU  13   1.798  -4.779  -5.330
  240    HG2  GLU  13           2HG      GLU  13   2.464  -4.456  -7.493
  241    HG3  GLU  13           1HG      GLU  13   4.177  -4.594  -7.093
  242    H    ALA  14           H        ALA  14   1.472  -3.024  -3.763
  243    HA   ALA  14           HA       ALA  14   0.943  -0.830  -5.547
  244    HB1  ALA  14           3HB      ALA  14  -0.798  -1.977  -4.176
  245    HB2  ALA  14           1HB      ALA  14  -0.808  -0.229  -3.968
  246    HB3  ALA  14           2HB      ALA  14  -0.086  -1.258  -2.730
  247    H    LEU  15           H        LEU  15   2.128  -0.942  -2.194
  248    HA   LEU  15           HA       LEU  15   2.627   1.828  -1.866
  249    HG   LEU  15           HG       LEU  15   1.849  -0.612   0.091
  250    HB2  LEU  15           2HB      LEU  15   4.076  -0.580  -0.719
  251    HB3  LEU  15           1HB      LEU  15   4.339   1.075  -0.178
  252   HD11  LEU  15          1HD1      LEU  15   2.538   1.023   2.334
  253   HD12  LEU  15          2HD1      LEU  15   4.002   0.219   1.765
  254   HD13  LEU  15          3HD1      LEU  15   2.585  -0.735   2.207
  255   HD21  LEU  15          3HD2      LEU  15   1.011   1.482  -0.762
  256   HD22  LEU  15          1HD2      LEU  15   2.136   2.408   0.233
  257   HD23  LEU  15          2HD2      LEU  15   0.802   1.536   0.988
  258    H    TYR  16           H        TYR  16   4.583  -0.739  -3.322
  259    HA   TYR  16           HA       TYR  16   7.026   0.641  -3.585
  260    HD1  TYR  16           HD2      TYR  16   9.118  -0.176  -5.422
  261    HD2  TYR  16           HD1      TYR  16   6.902  -2.970  -3.024
  262    HE1  TYR  16           HE2      TYR  16  11.237  -1.010  -4.441
  263    HE2  TYR  16           HE1      TYR  16   9.023  -3.806  -2.042
  264    HH   TYR  16           HH       TYR  16  12.172  -2.471  -3.065
  265    HB2  TYR  16           2HB      TYR  16   5.798  -1.719  -4.720
  266    HB3  TYR  16           1HB      TYR  16   6.721  -0.854  -5.948
  267    H    LEU  17           H        LEU  17   4.675   0.247  -6.274
  268    HA   LEU  17           HA       LEU  17   5.801   2.148  -7.975
  269    HG   LEU  17           HG       LEU  17   2.988   0.837  -6.403
  270    HB2  LEU  17           2HB      LEU  17   3.326   2.567  -8.730
  271    HB3  LEU  17           1HB      LEU  17   4.067   0.991  -8.986
  272   HD11  LEU  17          1HD1      LEU  17   0.907   1.995  -8.263
  273   HD12  LEU  17          2HD1      LEU  17   1.740   2.961  -7.044
  274   HD13  LEU  17          3HD1      LEU  17   0.730   1.602  -6.552
  275   HD21  LEU  17          3HD2      LEU  17   2.136  -0.148  -9.127
  276   HD22  LEU  17          1HD2      LEU  17   1.227  -0.579  -7.679
  277   HD23  LEU  17          2HD2      LEU  17   2.919  -1.052  -7.831
  278    H    VAL  18           H        VAL  18   3.385   2.810  -5.406
  279    HA   VAL  18           HA       VAL  18   3.275   5.631  -5.932
  280    HB   VAL  18           HB       VAL  18   2.380   5.811  -3.614
  281   HG11  VAL  18          1HG1      VAL  18   0.868   3.497  -4.349
  282   HG12  VAL  18          2HG1      VAL  18   1.319   4.377  -5.810
  283   HG13  VAL  18          3HG1      VAL  18   0.432   5.197  -4.523
  284   HG21  VAL  18          3HG2      VAL  18   2.056   3.695  -2.348
  285   HG22  VAL  18          1HG2      VAL  18   3.760   4.107  -2.533
  286   HG23  VAL  18          2HG2      VAL  18   3.036   2.858  -3.548
  287    H    CYS  19           H        CYS  19   5.147   3.719  -3.648
  288    HA   CYS  19           HA       CYS  19   6.571   5.970  -2.538
  289    HB2  CYS  19           2HB      CYS  19   6.741   3.007  -2.379
  290    HB3  CYS  19           1HB      CYS  19   8.229   3.886  -2.041
  291    H    GLY  20           H        GLY  20   7.745   3.303  -4.592
  292    HA2  GLY  20           2HA      GLY  20   9.182   3.468  -6.496
  293    HA3  GLY  20           1HA      GLY  20   9.369   5.196  -6.173
  294    H    GLU  21           H        GLU  21  11.746   4.396  -6.559
  295    HA   GLU  21           HA       GLU  21  12.991   2.910  -4.408
  296    HB2  GLU  21           2HB      GLU  21  15.091   3.440  -5.466
  297    HB3  GLU  21           1HB      GLU  21  13.926   3.105  -6.746
  298    HG2  GLU  21           2HG      GLU  21  13.976   5.929  -5.933
  299    HG3  GLU  21           1HG      GLU  21  15.511   5.363  -6.592
  300    H    ARG  22           H        ARG  22  11.501   4.814  -3.159
  301    HA   ARG  22           HA       ARG  22  13.542   6.724  -2.130
  302    HE   ARG  22           HE       ARG  22   9.717   9.817  -3.273
  303    HB2  ARG  22           2HB      ARG  22  10.572   7.024  -2.572
  304    HB3  ARG  22           1HB      ARG  22  11.406   8.012  -1.371
  305    HG2  ARG  22           2HG      ARG  22  13.062   8.184  -3.589
  306    HG3  ARG  22           1HG      ARG  22  11.444   8.210  -4.292
  307    HD2  ARG  22           2HD      ARG  22  12.443  10.015  -2.068
  308    HD3  ARG  22           1HD      ARG  22  12.167  10.495  -3.743
  309   HH11  ARG  22          1HH2      ARG  22  11.446   9.701  -0.429
  310   HH12  ARG  22          2HH2      ARG  22  10.456  10.828   0.438
  311   HH21  ARG  22          1HH1      ARG  22   8.649  11.795  -2.358
  312   HH22  ARG  22          2HH1      ARG  22   8.879  12.020  -0.656
  313    H    GLY  23           H        GLY  23  11.503   4.058  -1.506
  314    HA2  GLY  23           2HA      GLY  23  11.879   2.796   0.566
  315    HA3  GLY  23           1HA      GLY  23  12.123   4.326   1.403
  316    H    PHE  24           H        PHE  24  10.041   1.873   1.271
  317    HA   PHE  24           HA       PHE  24   7.627   3.605   1.639
  318    HD1  PHE  24           HD2      PHE  24   9.367   1.079  -0.879
  319    HD2  PHE  24           HD1      PHE  24   7.081  -0.654   2.322
  320    HE1  PHE  24           HE2      PHE  24  10.685  -1.011  -1.070
  321    HE2  PHE  24           HE1      PHE  24   8.400  -2.744   2.130
  322    HZ   PHE  24           HZ       PHE  24  10.203  -2.925   0.436
  323    HB2  PHE  24           2HB      PHE  24   6.371   1.402   1.284
  324    HB3  PHE  24           1HB      PHE  24   7.193   2.040  -0.136
  325    H    PHE  25           H        PHE  25   6.023   2.339   3.263
  326    HA   PHE  25           HA       PHE  25   7.614   1.095   5.445
  327    HD1  PHE  25           HD2      PHE  25   6.291   0.736   7.700
  328    HD2  PHE  25           HD1      PHE  25   8.432   4.456   7.451
  329    HE1  PHE  25           HE2      PHE  25   7.347   0.277   9.897
  330    HE2  PHE  25           HE1      PHE  25   9.486   3.994   9.647
  331    HZ   PHE  25           HZ       PHE  25   8.944   1.906  10.870
  332    HB2  PHE  25           2HB      PHE  25   7.163   3.731   5.613
  333    HB3  PHE  25           1HB      PHE  25   5.613   3.172   6.237
  334    H    TYR  26           H        TYR  26   6.295  -0.765   4.475
  335    HA   TYR  26           HA       TYR  26   3.422  -0.688   5.049
  336    HD1  TYR  26           HD1      TYR  26   2.695  -4.262   5.225
  337    HD2  TYR  26           HD2      TYR  26   6.748  -3.596   3.945
  338    HE1  TYR  26           HE1      TYR  26   3.327  -6.506   6.058
  339    HE2  TYR  26           HE2      TYR  26   7.373  -5.845   4.777
  340    HH   TYR  26           HH       TYR  26   5.130  -7.813   6.633
  341    HB2  TYR  26           2HB      TYR  26   3.286  -2.449   3.623
  342    HB3  TYR  26           1HB      TYR  26   4.962  -2.104   3.239
  343    H    THR  27           H        THR  27   3.533  -0.215   7.339
  344    HA   THR  27           HA       THR  27   4.850  -2.182   9.086
  345    HB   THR  27           HB       THR  27   4.883   0.172   9.734
  346    HG1  THR  27           HG1      THR  27   3.012  -0.834  11.519
  347   HG21  THR  27          3HG2      THR  27   2.942   1.066   8.705
  348   HG22  THR  27          1HG2      THR  27   2.624   1.179  10.437
  349   HG23  THR  27          2HG2      THR  27   1.888  -0.113   9.487
  350    H    LYS  28           H        LYS  28   3.663  -3.380  10.731
  351    HA   LYS  28           HA       LYS  28   0.786  -3.830  10.066
  352    HB2  LYS  28           2HB      LYS  28   2.442  -6.137  11.003
  353    HB3  LYS  28           1HB      LYS  28   1.039  -6.126   9.935
  354    HG2  LYS  28           2HG      LYS  28   2.661  -6.507   8.350
  355    HG3  LYS  28           1HG      LYS  28   2.739  -4.745   8.382
  356    HD2  LYS  28           2HD      LYS  28   4.974  -5.210   8.703
  357    HD3  LYS  28           1HD      LYS  28   4.440  -5.232  10.385
  358    HE2  LYS  28           2HE      LYS  28   4.153  -7.677  10.270
  359    HE3  LYS  28           1HE      LYS  28   4.669  -7.663   8.582
  360    HZ1  LYS  28           3HZ      LYS  28   6.770  -6.602   9.393
  361    HZ2  LYS  28           1HZ      LYS  28   6.551  -8.215   9.868
  362    HZ3  LYS  28           2HZ      LYS  28   6.269  -6.959  10.976
  363    HA   PRO  29           HA       PRO  29   0.317  -3.291  14.392
  364    HB2  PRO  29           2HB      PRO  29  -2.192  -4.392  14.644
  365    HB3  PRO  29           1HB      PRO  29  -1.886  -2.779  13.978
  366    HG2  PRO  29           2HG      PRO  29  -2.600  -5.298  12.545
  367    HG3  PRO  29           1HG      PRO  29  -2.914  -3.616  12.084
  368    HD2  PRO  29           2HD      PRO  29  -0.873  -5.249  11.026
  369    HD3  PRO  29           1HD      PRO  29  -0.967  -3.484  10.875
  370    H    THR  30           H        THR  30  -0.511  -6.488  13.050
  371    HA   THR  30           HA       THR  30   0.804  -7.708  15.433
  372    HB   THR  30           HB       THR  30  -1.733  -8.801  14.191
  373    HG1  THR  30           HG1      THR  30  -1.462  -7.418  16.645
  374   HG21  THR  30          3HG2      THR  30  -0.085  -9.452  16.638
  375   HG22  THR  30          1HG2      THR  30  -0.509 -10.520  15.299
  376   HG23  THR  30          2HG2      THR  30  -1.747 -10.009  16.446
  Start of MODEL   12
    1    H1   GLY   1           1H       GLY   1  -5.309   0.263  11.424
    2    H2   GLY   1           2H       GLY   1  -5.945   0.859   9.966
    3    H3   GLY   1           3H       GLY   1  -5.009   1.868  10.962
    4    HA2  GLY   1           1HA      GLY   1  -3.321   1.211   9.627
    5    HA3  GLY   1           2HA      GLY   1  -3.315  -0.300  10.586
    6    H    ILE   2           H        ILE   2  -1.949   0.087   8.286
    7    HA   ILE   2           HA       ILE   2  -3.535   0.410   5.850
    8    HB   ILE   2           HB       ILE   2  -1.223   1.185   5.858
    9   HG12  ILE   2          2HG1      ILE   2  -1.726  -1.253   4.128
   10   HG13  ILE   2          1HG1      ILE   2  -2.082   0.423   3.715
   11   HG21  ILE   2          1HG2      ILE   2  -0.424  -1.703   6.222
   12   HG22  ILE   2          2HG2      ILE   2  -0.400  -0.503   7.514
   13   HG23  ILE   2          3HG2      ILE   2   0.648  -0.309   6.110
   14   HD11  ILE   2          3HD1      ILE   2   0.495  -1.028   3.647
   15   HD12  ILE   2          1HD1      ILE   2   0.575   0.607   4.302
   16   HD13  ILE   2          2HD1      ILE   2  -0.053   0.339   2.676
   17    H    THR   3           H        THR   3  -1.748  -2.296   7.363
   18    HA   THR   3           HA       THR   3  -2.575  -4.229   5.418
   19    HB   THR   3           HB       THR   3  -1.623  -4.472   8.280
   20    HG1  THR   3           HG1      THR   3   0.221  -4.495   7.313
   21   HG21  THR   3          3HG2      THR   3  -3.051  -6.383   7.924
   22   HG22  THR   3          1HG2      THR   3  -1.382  -6.927   7.751
   23   HG23  THR   3          2HG2      THR   3  -2.373  -6.653   6.319
   24    H    GLU   4           H        GLU   4  -4.074  -2.914   8.283
   25    HA   GLU   4           HA       GLU   4  -6.267  -4.905   8.170
   26    HB2  GLU   4           2HB      GLU   4  -5.225  -4.017  10.356
   27    HB3  GLU   4           1HB      GLU   4  -6.111  -2.528  10.026
   28    HG2  GLU   4           2HG      GLU   4  -7.367  -4.119  11.503
   29    HG3  GLU   4           1HG      GLU   4  -8.225  -3.724  10.014
   30    H    GLN   5           H        GLN   5  -5.860  -3.013   5.972
   31    HA   GLN   5           HA       GLN   5  -8.600  -2.068   5.741
   32    HB2  GLN   5           2HB      GLN   5  -7.245  -0.273   7.120
   33    HB3  GLN   5           1HB      GLN   5  -6.555   0.138   5.548
   34    HG2  GLN   5           2HG      GLN   5  -8.627   0.788   4.665
   35    HG3  GLN   5           1HG      GLN   5  -9.536  -0.128   5.868
   36   HE21  GLN   5          1HE2      GLN   5 -10.502   1.230   7.375
   37   HE22  GLN   5          2HE2      GLN   5  -9.850   2.694   7.934
   38    H    CYS   6           H        CYS   6  -5.270  -1.959   4.569
   39    HA   CYS   6           HA       CYS   6  -6.242  -1.768   1.775
   40    HB2  CYS   6           2HB      CYS   6  -3.528  -1.543   3.075
   41    HB3  CYS   6           1HB      CYS   6  -3.702  -1.729   1.332
   42    H    CYS   7           H        CYS   7  -5.416  -4.079   4.099
   43    HA   CYS   7           HA       CYS   7  -5.088  -6.127   1.959
   44    HB2  CYS   7           2HB      CYS   7  -2.952  -5.899   3.092
   45    HB3  CYS   7           1HB      CYS   7  -3.731  -6.024   4.664
   46    H    THR   8           H        THR   8  -7.480  -5.902   2.290
   47    HA   THR   8           HA       THR   8  -8.454  -8.168   3.793
   48    HB   THR   8           HB       THR   8  -9.127  -5.373   4.771
   49    HG1  THR   8           HG1      THR   8  -8.502  -6.594   6.783
   50   HG21  THR   8          3HG2      THR   8 -10.521  -8.003   5.070
   51   HG22  THR   8          1HG2      THR   8 -11.203  -6.384   4.922
   52   HG23  THR   8          2HG2      THR   8 -10.493  -6.906   6.450
   53    H    SER   9           H        SER   9  -9.141  -5.119   2.152
   54    HA   SER   9           HA       SER   9 -11.258  -6.509   0.588
   55    HG   SER   9           HG       SER   9 -13.620  -4.630   0.520
   56    HB2  SER   9           2HB      SER   9 -12.494  -5.176   2.180
   57    HB3  SER   9           1HB      SER   9 -11.449  -3.785   1.909
   58    H    ILE  10           H        ILE  10 -10.392  -3.094   0.471
   59    HA   ILE  10           HA       ILE  10  -8.647  -3.552  -1.874
   60    HB   ILE  10           HB       ILE  10 -10.884  -1.548  -2.116
   61   HG12  ILE  10          2HG1      ILE  10 -11.812  -3.869  -1.629
   62   HG13  ILE  10          1HG1      ILE  10 -12.290  -3.187  -3.185
   63   HG21  ILE  10          1HG2      ILE  10 -10.461  -2.222  -4.575
   64   HG22  ILE  10          2HG2      ILE  10  -9.004  -3.010  -3.970
   65   HG23  ILE  10          3HG2      ILE  10  -9.214  -1.270  -3.770
   66   HD11  ILE  10          3HD1      ILE  10 -11.068  -4.705  -4.375
   67   HD12  ILE  10          1HD1      ILE  10 -11.235  -5.670  -2.909
   68   HD13  ILE  10          2HD1      ILE  10  -9.766  -4.735  -3.187
   69    H    CYS  11           H        CYS  11  -7.077  -1.947  -2.052
   70    HA   CYS  11           HA       CYS  11  -7.094   0.090   0.117
   71    HB2  CYS  11           2HB      CYS  11  -5.125  -1.460  -0.145
   72    HB3  CYS  11           1HB      CYS  11  -4.806  -0.706  -1.706
   73    H    SER  12           H        SER  12  -6.482   2.303  -0.397
   74    HA   SER  12           HA       SER  12  -7.411   3.102  -3.112
   75    HG   SER  12           HG       SER  12  -8.336   4.394   0.305
   76    HB2  SER  12           2HB      SER  12  -7.138   5.434  -1.728
   77    HB3  SER  12           1HB      SER  12  -8.622   4.486  -1.778
   78    H    LEU  13           H        LEU  13  -5.771   3.213  -4.505
   79    HA   LEU  13           HA       LEU  13  -3.055   3.413  -4.237
   80    HG   LEU  13           HG       LEU  13  -5.207   2.728  -6.168
   81    HB2  LEU  13           2HB      LEU  13  -3.964   5.472  -6.120
   82    HB3  LEU  13           1HB      LEU  13  -2.990   4.043  -6.413
   83   HD11  LEU  13          1HD1      LEU  13  -7.229   3.926  -6.468
   84   HD12  LEU  13          2HD1      LEU  13  -6.387   5.387  -6.983
   85   HD13  LEU  13          3HD1      LEU  13  -6.344   4.895  -5.290
   86   HD21  LEU  13          3HD2      LEU  13  -5.004   2.606  -8.399
   87   HD22  LEU  13          1HD2      LEU  13  -3.858   3.943  -8.305
   88   HD23  LEU  13          2HD2      LEU  13  -5.569   4.266  -8.587
   89    H    TYR  14           H        TYR  14  -5.287   6.138  -4.209
   90    HA   TYR  14           HA       TYR  14  -3.526   8.261  -3.773
   91    HD1  TYR  14           HD2      TYR  14  -6.143   8.272  -0.447
   92    HD2  TYR  14           HD1      TYR  14  -4.849  11.021  -3.489
   93    HE1  TYR  14           HE2      TYR  14  -6.067  10.096   1.234
   94    HE2  TYR  14           HE1      TYR  14  -4.775  12.844  -1.806
   95    HH   TYR  14           HH       TYR  14  -4.874  13.330   0.381
   96    HB2  TYR  14           2HB      TYR  14  -5.785   8.841  -4.066
   97    HB3  TYR  14           1HB      TYR  14  -6.327   7.711  -2.829
   98    H    GLN  15           H        GLN  15  -5.296   6.712  -1.102
   99    HA   GLN  15           HA       GLN  15  -3.576   7.626   0.968
  100    HB2  GLN  15           2HB      GLN  15  -5.547   5.425   0.662
  101    HB3  GLN  15           1HB      GLN  15  -4.344   5.202   1.926
  102    HG2  GLN  15           2HG      GLN  15  -6.027   7.703   1.641
  103    HG3  GLN  15           1HG      GLN  15  -6.449   6.356   2.696
  104   HE21  GLN  15          1HE2      GLN  15  -3.073   6.536   2.658
  105   HE22  GLN  15          2HE2      GLN  15  -2.858   7.487   4.043
  106    H    LEU  16           H        LEU  16  -3.547   4.738  -1.005
  107    HA   LEU  16           HA       LEU  16  -1.427   3.280   0.088
  108    HG   LEU  16           HG       LEU  16   0.009   2.212  -1.692
  109    HB2  LEU  16           2HB      LEU  16  -2.930   2.660  -1.870
  110    HB3  LEU  16           1HB      LEU  16  -1.887   3.668  -2.873
  111   HD11  LEU  16          1HD1      LEU  16  -2.243   0.230  -1.943
  112   HD12  LEU  16          2HD1      LEU  16  -1.898   1.037  -0.413
  113   HD13  LEU  16          3HD1      LEU  16  -0.675   0.013  -1.166
  114   HD21  LEU  16          3HD2      LEU  16   0.273   1.245  -3.746
  115   HD22  LEU  16          1HD2      LEU  16  -0.971   2.413  -4.193
  116   HD23  LEU  16          2HD2      LEU  16  -1.415   0.743  -3.840
  117    H    GLU  17           H        GLU  17  -1.334   6.088  -2.039
  118    HA   GLU  17           HA       GLU  17   1.523   5.929  -2.499
  119    HB2  GLU  17           2HB      GLU  17   0.255   7.074  -4.150
  120    HB3  GLU  17           1HB      GLU  17  -0.542   8.083  -2.945
  121    HG2  GLU  17           2HG      GLU  17   1.732   9.047  -2.387
  122    HG3  GLU  17           1HG      GLU  17   2.368   8.173  -3.780
  123    H    ASN  18           H        ASN  18  -0.462   7.260   0.006
  124    HA   ASN  18           HA       ASN  18   1.599   9.063   0.997
  125    HB2  ASN  18           2HB      ASN  18  -0.851   9.427   1.399
  126    HB3  ASN  18           1HB      ASN  18  -0.839   8.014   2.455
  127   HD21  ASN  18          1HD2      ASN  18   0.244   8.197   4.529
  128   HD22  ASN  18          2HD2      ASN  18   0.753   9.695   5.143
  129    H    TYR  19           H        TYR  19   1.028   5.702   1.239
  130    HA   TYR  19           HA       TYR  19   2.536   5.500   3.783
  131    HD1  TYR  19           HD2      TYR  19   0.555   5.782   4.545
  132    HD2  TYR  19           HD1      TYR  19  -0.614   2.445   2.104
  133    HE1  TYR  19           HE2      TYR  19  -1.826   6.246   5.032
  134    HE2  TYR  19           HE1      TYR  19  -2.989   2.906   2.589
  135    HH   TYR  19           HH       TYR  19  -4.300   4.053   4.420
  136    HB2  TYR  19           2HB      TYR  19   1.617   3.202   2.056
  137    HB3  TYR  19           1HB      TYR  19   1.990   3.187   3.777
  138    H    CYS  20           H        CYS  20   3.362   6.025   0.645
  139    HA   CYS  20           HA       CYS  20   5.388   3.982   0.306
  140    HB2  CYS  20           2HB      CYS  20   6.076   5.125  -1.614
  141    HB3  CYS  20           1HB      CYS  20   4.401   5.545  -1.535
  142    H    ASN  21           H        ASN  21   7.727   5.269  -0.195
  143    HA   ASN  21           HA       ASN  21   8.919   5.506   2.353
  144    HB2  ASN  21           2HB      ASN  21  10.209   5.168   0.259
  145    HB3  ASN  21           1HB      ASN  21   9.853   6.830  -0.210
  146   HD21  ASN  21          1HD2      ASN  21  11.463   8.293   0.368
  147   HD22  ASN  21          2HD2      ASN  21  12.541   8.094   1.665
  148    HA   PHE   1           HA       PHE   1 -11.057   5.005 -10.892
  149    HD1  PHE   1           HD1      PHE   1 -13.489   6.805  -9.276
  150    HD2  PHE   1           HD2      PHE   1  -9.474   5.704  -8.208
  151    HE1  PHE   1           HE1      PHE   1 -12.906   9.200  -8.994
  152    HE2  PHE   1           HE2      PHE   1  -8.891   8.099  -7.929
  153    HZ   PHE   1           HZ       PHE   1 -10.607   9.848  -8.322
  154    H1   PHE   1           1H       PHE   1 -13.358   5.021 -11.260
  155    H2   PHE   1           2H       PHE   1 -13.589   3.530 -10.479
  156    H3   PHE   1           3H       PHE   1 -12.810   3.591 -11.987
  157    HB2  PHE   1           2HB      PHE   1 -12.908   4.488  -8.685
  158    HB3  PHE   1           1HB      PHE   1 -11.247   4.041  -8.292
  159    H    VAL   2           H        VAL   2  -9.303   3.670  -9.499
  160    HA   VAL   2           HA       VAL   2  -9.211   1.007 -10.799
  161    HB   VAL   2           HB       VAL   2  -7.062   2.432  -9.208
  162   HG11  VAL   2          1HG1      VAL   2  -6.513   0.425 -11.344
  163   HG12  VAL   2          2HG1      VAL   2  -7.145  -0.181  -9.813
  164   HG13  VAL   2          3HG1      VAL   2  -5.640   0.738  -9.843
  165   HG21  VAL   2          3HG2      VAL   2  -7.918   2.592 -12.079
  166   HG22  VAL   2          1HG2      VAL   2  -6.197   2.686 -11.705
  167   HG23  VAL   2          2HG2      VAL   2  -7.313   3.867 -11.020
  168    H    ASN   3           H        ASN   3  -9.706  -0.798  -9.655
  169    HA   ASN   3           HA       ASN   3  -9.564  -0.632  -6.669
  170    HB2  ASN   3           2HB      ASN   3 -11.241  -2.660  -6.944
  171    HB3  ASN   3           1HB      ASN   3 -11.829  -1.001  -7.063
  172   HD21  ASN   3          1HD2      ASN   3 -12.424  -0.192  -9.185
  173   HD22  ASN   3          2HD2      ASN   3 -12.587  -1.225 -10.522
  174    H    GLN   4           H        GLN   4  -7.923  -1.857  -5.869
  175    HA   GLN   4           HA       GLN   4  -7.371  -4.492  -7.107
  176    HB2  GLN   4           2HB      GLN   4  -5.799  -3.128  -8.287
  177    HB3  GLN   4           1HB      GLN   4  -5.381  -2.225  -6.835
  178    HG2  GLN   4           2HG      GLN   4  -3.642  -3.645  -6.598
  179    HG3  GLN   4           1HG      GLN   4  -4.821  -4.882  -6.162
  180   HE21  GLN   4          1HE2      GLN   4  -4.229  -6.738  -7.319
  181   HE22  GLN   4          2HE2      GLN   4  -3.870  -6.765  -8.979
  182    H    HIS   5           H        HIS   5  -6.851  -6.002  -5.557
  183    HA   HIS   5           HA       HIS   5  -6.986  -5.210  -2.756
  184    HD2  HIS   5           HD2      HIS   5  -9.846  -7.781  -2.796
  185    HE1  HIS   5           HE1      HIS   5  -9.592  -7.723  -7.016
  186    HE2  HIS   5           HE2      HIS   5 -11.165  -7.966  -5.025
  187    HB2  HIS   5           2HB      HIS   5  -6.106  -7.930  -3.682
  188    HB3  HIS   5           1HB      HIS   5  -7.088  -7.503  -2.284
  189    H    LEU   6           H        LEU   6  -5.286  -5.358  -1.225
  190    HA   LEU   6           HA       LEU   6  -2.541  -5.738  -2.317
  191    HG   LEU   6           HG       LEU   6  -2.759  -2.703  -3.080
  192    HB2  LEU   6           2HB      LEU   6  -3.743  -3.347  -1.097
  193    HB3  LEU   6           1HB      LEU   6  -2.227  -3.831  -0.373
  194   HD11  LEU   6          1HD1      LEU   6  -0.081  -2.616  -1.887
  195   HD12  LEU   6          2HD1      LEU   6  -1.347  -2.007  -0.820
  196   HD13  LEU   6          3HD1      LEU   6  -1.127  -1.302  -2.420
  197   HD21  LEU   6          3HD2      LEU   6  -0.873  -5.007  -2.568
  198   HD22  LEU   6          1HD2      LEU   6  -0.435  -3.763  -3.732
  199   HD23  LEU   6          2HD2      LEU   6  -1.899  -4.714  -3.971
  200    H    CYS   7           H        CYS   7  -1.308  -7.031  -1.127
  201    HA   CYS   7           HA       CYS   7  -1.621  -7.234   1.774
  202    HB2  CYS   7           2HB      CYS   7  -2.596  -9.418  -0.077
  203    HB3  CYS   7           1HB      CYS   7  -1.994  -9.808   1.532
  204    H    GLY   8           H        GLY   8   0.273  -8.065   2.668
  205    HA2  GLY   8           2HA      GLY   8   2.606  -8.470   2.619
  206    HA3  GLY   8           1HA      GLY   8   2.060  -9.933   1.807
  207    H    SER   9           H        SER   9   3.520 -10.218   0.194
  208    HA   SER   9           HA       SER   9   5.126  -8.469  -1.155
  209    HG   SER   9           HG       SER   9   3.920 -12.086  -2.183
  210    HB2  SER   9           2HB      SER   9   4.309 -10.056  -3.251
  211    HB3  SER   9           1HB      SER   9   5.533 -10.499  -2.064
  212    H    ASP  10           H        ASP  10   1.773  -9.195  -2.207
  213    HA   ASP  10           HA       ASP  10   1.716  -7.358  -4.362
  214    HB2  ASP  10           2HB      ASP  10  -0.527  -8.214  -2.507
  215    HB3  ASP  10           1HB      ASP  10  -0.746  -7.431  -4.069
  216    H    LEU  11           H        LEU  11   1.125  -6.907  -0.911
  217    HA   LEU  11           HA       LEU  11   0.116  -4.250  -0.965
  218    HG   LEU  11           HG       LEU  11   1.929  -3.431   1.805
  219    HB2  LEU  11           2HB      LEU  11   0.076  -5.667   1.039
  220    HB3  LEU  11           1HB      LEU  11   1.834  -5.657   1.104
  221   HD11  LEU  11          1HD1      LEU  11   0.459  -2.558  -0.017
  222   HD12  LEU  11          2HD1      LEU  11   0.124  -1.819   1.549
  223   HD13  LEU  11          3HD1      LEU  11  -0.946  -3.072   0.919
  224   HD21  LEU  11          3HD2      LEU  11  -0.686  -4.524   2.876
  225   HD22  LEU  11          1HD2      LEU  11   0.247  -3.222   3.614
  226   HD23  LEU  11          2HD2      LEU  11   0.918  -4.851   3.530
  227    H    VAL  12           H        VAL  12   3.499  -5.374  -0.648
  228    HA   VAL  12           HA       VAL  12   4.593  -2.719  -0.624
  229    HB   VAL  12           HB       VAL  12   6.727  -3.901  -1.312
  230   HG11  VAL  12          1HG1      VAL  12   6.006  -3.521   1.060
  231   HG12  VAL  12          2HG1      VAL  12   6.996  -4.966   0.856
  232   HG13  VAL  12          3HG1      VAL  12   5.247  -5.113   1.039
  233   HG21  VAL  12          3HG2      VAL  12   6.724  -6.316  -1.382
  234   HG22  VAL  12          1HG2      VAL  12   5.519  -5.739  -2.530
  235   HG23  VAL  12          2HG2      VAL  12   5.013  -6.371  -0.963
  236    H    GLU  13           H        GLU  13   3.958  -5.042  -3.245
  237    HA   GLU  13           HA       GLU  13   5.240  -3.820  -5.385
  238    HB2  GLU  13           2HB      GLU  13   3.857  -5.880  -5.575
  239    HB3  GLU  13           1HB      GLU  13   2.401  -4.896  -5.418
  240    HG2  GLU  13           2HG      GLU  13   3.196  -3.574  -7.427
  241    HG3  GLU  13           1HG      GLU  13   4.455  -4.790  -7.640
  242    H    ALA  14           H        ALA  14   1.953  -3.003  -4.217
  243    HA   ALA  14           HA       ALA  14   1.596  -0.753  -5.938
  244    HB1  ALA  14           3HB      ALA  14   0.387  -0.638  -3.232
  245    HB2  ALA  14           1HB      ALA  14  -0.002  -2.064  -4.191
  246    HB3  ALA  14           2HB      ALA  14  -0.379  -0.459  -4.811
  247    H    LEU  15           H        LEU  15   2.915  -1.047  -2.667
  248    HA   LEU  15           HA       LEU  15   3.322   1.773  -2.282
  249    HG   LEU  15           HG       LEU  15   2.312  -0.513  -0.185
  250    HB2  LEU  15           2HB      LEU  15   4.498  -0.673  -0.966
  251    HB3  LEU  15           1HB      LEU  15   4.906   0.959  -0.465
  252   HD11  LEU  15          1HD1      LEU  15   4.231  -0.066   1.543
  253   HD12  LEU  15          2HD1      LEU  15   2.548   0.102   2.043
  254   HD13  LEU  15          3HD1      LEU  15   3.501   1.535   1.652
  255   HD21  LEU  15          3HD2      LEU  15   1.158   1.641   0.273
  256   HD22  LEU  15          1HD2      LEU  15   1.687   1.549  -1.406
  257   HD23  LEU  15          2HD2      LEU  15   2.596   2.519  -0.248
  258    H    TYR  16           H        TYR  16   5.190  -0.790  -3.733
  259    HA   TYR  16           HA       TYR  16   7.762   0.423  -3.720
  260    HD1  TYR  16           HD2      TYR  16   9.967  -0.612  -5.329
  261    HD2  TYR  16           HD1      TYR  16   7.216  -3.183  -3.256
  262    HE1  TYR  16           HE2      TYR  16  11.866  -1.694  -4.150
  263    HE2  TYR  16           HE1      TYR  16   9.114  -4.265  -2.079
  264    HH   TYR  16           HH       TYR  16  11.498  -4.594  -2.345
  265    HB2  TYR  16           2HB      TYR  16   6.447  -1.816  -5.040
  266    HB3  TYR  16           1HB      TYR  16   7.578  -1.007  -6.121
  267    H    LEU  17           H        LEU  17   5.310   0.400  -6.319
  268    HA   LEU  17           HA       LEU  17   6.740   2.264  -7.956
  269    HG   LEU  17           HG       LEU  17   3.686   1.016  -6.712
  270    HB2  LEU  17           2HB      LEU  17   4.507   2.535  -9.128
  271    HB3  LEU  17           1HB      LEU  17   5.110   0.882  -9.019
  272   HD11  LEU  17          1HD1      LEU  17   1.940   2.480  -6.760
  273   HD12  LEU  17          2HD1      LEU  17   1.752   2.351  -8.508
  274   HD13  LEU  17          3HD1      LEU  17   2.999   3.396  -7.831
  275   HD21  LEU  17          3HD2      LEU  17   2.060   0.475  -9.136
  276   HD22  LEU  17          1HD2      LEU  17   2.371  -0.555  -7.740
  277   HD23  LEU  17          2HD2      LEU  17   3.581  -0.410  -9.015
  278    H    VAL  18           H        VAL  18   4.196   2.801  -5.480
  279    HA   VAL  18           HA       VAL  18   3.651   5.478  -6.100
  280    HB   VAL  18           HB       VAL  18   3.378   5.832  -3.558
  281   HG11  VAL  18          1HG1      VAL  18   1.301   4.479  -3.596
  282   HG12  VAL  18          2HG1      VAL  18   1.881   3.672  -5.051
  283   HG13  VAL  18          3HG1      VAL  18   1.531   5.400  -5.082
  284   HG21  VAL  18          3HG2      VAL  18   3.040   3.576  -2.421
  285   HG22  VAL  18          1HG2      VAL  18   4.709   4.080  -2.633
  286   HG23  VAL  18          2HG2      VAL  18   4.006   2.890  -3.716
  287    H    CYS  19           H        CYS  19   6.007   4.635  -3.525
  288    HA   CYS  19           HA       CYS  19   7.247   7.234  -3.972
  289    HB2  CYS  19           2HB      CYS  19   7.648   5.108  -2.003
  290    HB3  CYS  19           1HB      CYS  19   9.143   5.848  -2.539
  291    H    GLY  20           H        GLY  20   8.625   3.957  -4.091
  292    HA2  GLY  20           2HA      GLY  20   9.573   3.360  -6.424
  293    HA3  GLY  20           1HA      GLY  20  10.442   4.890  -6.271
  294    H    GLU  21           H        GLU  21  12.536   3.964  -6.191
  295    HA   GLU  21           HA       GLU  21  13.199   1.760  -4.449
  296    HB2  GLU  21           2HB      GLU  21  14.488   2.919  -6.512
  297    HB3  GLU  21           1HB      GLU  21  15.314   3.724  -5.176
  298    HG2  GLU  21           2HG      GLU  21  16.451   1.850  -4.641
  299    HG3  GLU  21           1HG      GLU  21  14.978   0.880  -4.659
  300    H    ARG  22           H        ARG  22  12.501   5.013  -3.818
  301    HA   ARG  22           HA       ARG  22  14.290   5.662  -1.725
  302    HE   ARG  22           HE       ARG  22  13.228  10.050  -2.559
  303    HB2  ARG  22           2HB      ARG  22  11.349   6.368  -1.931
  304    HB3  ARG  22           1HB      ARG  22  12.543   7.199  -0.933
  305    HG2  ARG  22           2HG      ARG  22  13.752   7.961  -2.863
  306    HG3  ARG  22           1HG      ARG  22  12.815   6.920  -3.935
  307    HD2  ARG  22           2HD      ARG  22  11.556   8.786  -4.271
  308    HD3  ARG  22           1HD      ARG  22  10.826   8.352  -2.725
  309   HH11  ARG  22          1HH2      ARG  22  10.526   9.548  -0.896
  310   HH12  ARG  22          2HH2      ARG  22   9.914  11.168  -0.920
  311   HH21  ARG  22          1HH1      ARG  22  12.135  12.257  -3.347
  312   HH22  ARG  22          2HH1      ARG  22  10.826  12.702  -2.303
  313    H    GLY  23           H        GLY  23  11.734   3.349  -1.835
  314    HA2  GLY  23           2HA      GLY  23  11.855   1.574  -0.078
  315    HA3  GLY  23           1HA      GLY  23  12.101   2.869   1.094
  316    H    PHE  24           H        PHE  24  10.136   1.571   1.993
  317    HA   PHE  24           HA       PHE  24   7.725   3.132   1.338
  318    HD1  PHE  24           HD2      PHE  24   8.982   0.835  -1.351
  319    HD2  PHE  24           HD1      PHE  24   7.880  -1.174   2.284
  320    HE1  PHE  24           HE2      PHE  24  10.558  -1.001  -1.887
  321    HE2  PHE  24           HE1      PHE  24   9.457  -3.014   1.745
  322    HZ   PHE  24           HZ       PHE  24  10.796  -2.927  -0.342
  323    HB2  PHE  24           2HB      PHE  24   6.547   0.684   1.407
  324    HB3  PHE  24           1HB      PHE  24   6.994   1.499  -0.090
  325    H    PHE  25           H        PHE  25   5.866   1.764   2.828
  326    HA   PHE  25           HA       PHE  25   7.166   1.673   5.520
  327    HD1  PHE  25           HD2      PHE  25   6.237   2.002   7.844
  328    HD2  PHE  25           HD1      PHE  25   5.470   5.279   5.166
  329    HE1  PHE  25           HE2      PHE  25   7.195   3.580   9.498
  330    HE2  PHE  25           HE1      PHE  25   6.432   6.853   6.823
  331    HZ   PHE  25           HZ       PHE  25   7.292   6.006   8.989
  332    HB2  PHE  25           2HB      PHE  25   4.859   3.121   4.523
  333    HB3  PHE  25           1HB      PHE  25   4.376   2.043   5.829
  334    H    TYR  26           H        TYR  26   4.087   0.503   4.076
  335    HA   TYR  26           HA       TYR  26   2.981  -1.543   4.445
  336    HD1  TYR  26           HD1      TYR  26   2.447  -3.459   4.906
  337    HD2  TYR  26           HD2      TYR  26   6.364  -4.787   3.728
  338    HE1  TYR  26           HE1      TYR  26   1.833  -5.788   5.488
  339    HE2  TYR  26           HE2      TYR  26   5.746  -7.113   4.311
  340    HH   TYR  26           HH       TYR  26   3.637  -8.042   6.182
  341    HB2  TYR  26           2HB      TYR  26   4.639  -2.366   2.889
  342    HB3  TYR  26           1HB      TYR  26   5.877  -2.394   4.139
  343    H    THR  27           H        THR  27   3.295  -0.133   6.784
  344    HA   THR  27           HA       THR  27   4.605  -1.774   8.819
  345    HB   THR  27           HB       THR  27   4.537   0.552   9.302
  346    HG1  THR  27           HG1      THR  27   2.289  -0.209  10.767
  347   HG21  THR  27          3HG2      THR  27   2.982   1.722   8.147
  348   HG22  THR  27          1HG2      THR  27   1.896   1.357   9.488
  349   HG23  THR  27          2HG2      THR  27   1.897   0.335   8.051
  350    H    LYS  28           H        LYS  28   3.636  -3.275  10.149
  351    HA   LYS  28           HA       LYS  28   0.699  -3.720   9.772
  352    HB2  LYS  28           2HB      LYS  28   2.401  -5.458   8.806
  353    HB3  LYS  28           1HB      LYS  28   2.614  -5.932  10.492
  354    HG2  LYS  28           2HG      LYS  28  -0.166  -5.652   9.392
  355    HG3  LYS  28           1HG      LYS  28   0.764  -7.105   9.023
  356    HD2  LYS  28           2HD      LYS  28   0.390  -6.062  11.841
  357    HD3  LYS  28           1HD      LYS  28  -0.680  -7.258  11.108
  358    HE2  LYS  28           2HE      LYS  28   2.269  -7.521  11.706
  359    HE3  LYS  28           1HE      LYS  28   0.946  -8.533  12.287
  360    HZ1  LYS  28           3HZ      LYS  28   1.834  -9.782  10.584
  361    HZ2  LYS  28           1HZ      LYS  28   2.170  -8.435   9.609
  362    HZ3  LYS  28           2HZ      LYS  28   0.568  -8.975   9.792
  363    HA   PRO  29           HA       PRO  29   1.363  -2.868  14.182
  364    HB2  PRO  29           2HB      PRO  29  -1.059  -1.611  14.505
  365    HB3  PRO  29           1HB      PRO  29   0.412  -0.788  13.957
  366    HG2  PRO  29           2HG      PRO  29  -1.970  -1.636  12.369
  367    HG3  PRO  29           1HG      PRO  29  -0.842  -0.300  12.076
  368    HD2  PRO  29           2HD      PRO  29  -0.814  -2.784  10.743
  369    HD3  PRO  29           1HD      PRO  29   0.511  -1.603  10.755
  370    H    THR  30           H        THR  30   0.529  -4.037  15.945
  371    HA   THR  30           HA       THR  30  -2.000  -5.526  15.615
  372    HB   THR  30           HB       THR  30  -0.343  -7.054  14.657
  373    HG1  THR  30           HG1      THR  30  -1.571  -8.398  15.689
  374   HG21  THR  30          3HG2      THR  30   1.148  -7.397  17.181
  375   HG22  THR  30          1HG2      THR  30   1.426  -5.860  16.364
  376   HG23  THR  30          2HG2      THR  30   1.736  -7.375  15.518
  Start of MODEL   13
    1    H1   GLY   1           1H       GLY   1  -4.215  -1.129  11.472
    2    H2   GLY   1           2H       GLY   1  -2.942  -0.647  12.488
    3    H3   GLY   1           3H       GLY   1  -2.946  -2.204  11.810
    4    HA2  GLY   1           1HA      GLY   1  -2.531   0.282  10.337
    5    HA3  GLY   1           2HA      GLY   1  -1.311  -1.005  10.573
    6    H    ILE   2           H        ILE   2  -1.312  -0.772   8.162
    7    HA   ILE   2           HA       ILE   2  -3.793  -0.247   6.665
    8    HB   ILE   2           HB       ILE   2  -1.507   0.714   6.055
    9   HG12  ILE   2          2HG1      ILE   2  -3.201  -0.844   4.088
   10   HG13  ILE   2          1HG1      ILE   2  -3.265   0.883   4.442
   11   HG21  ILE   2          1HG2      ILE   2  -0.034  -0.765   4.741
   12   HG22  ILE   2          2HG2      ILE   2  -1.112  -2.124   5.061
   13   HG23  ILE   2          3HG2      ILE   2  -0.225  -1.371   6.386
   14   HD11  ILE   2          3HD1      ILE   2  -1.332  -0.637   2.754
   15   HD12  ILE   2          1HD1      ILE   2  -0.703   0.734   3.668
   16   HD13  ILE   2          2HD1      ILE   2  -2.013   0.972   2.511
   17    H    THR   3           H        THR   3  -1.661  -2.955   7.385
   18    HA   THR   3           HA       THR   3  -2.520  -4.777   5.398
   19    HB   THR   3           HB       THR   3  -1.667  -5.246   8.266
   20    HG1  THR   3           HG1      THR   3  -0.424  -5.346   5.731
   21   HG21  THR   3          3HG2      THR   3  -2.380  -7.174   6.060
   22   HG22  THR   3          1HG2      THR   3  -2.898  -7.193   7.745
   23   HG23  THR   3          2HG2      THR   3  -1.238  -7.620   7.329
   24    H    GLU   4           H        GLU   4  -4.149  -3.565   8.204
   25    HA   GLU   4           HA       GLU   4  -6.305  -5.597   7.906
   26    HB2  GLU   4           2HB      GLU   4  -5.219  -4.100  10.128
   27    HB3  GLU   4           1HB      GLU   4  -6.948  -3.788   9.978
   28    HG2  GLU   4           2HG      GLU   4  -7.084  -5.725  11.200
   29    HG3  GLU   4           1HG      GLU   4  -6.962  -6.454   9.598
   30    H    GLN   5           H        GLN   5  -6.012  -3.702   5.819
   31    HA   GLN   5           HA       GLN   5  -8.685  -2.589   5.775
   32    HB2  GLN   5           2HB      GLN   5  -7.142  -0.968   7.195
   33    HB3  GLN   5           1HB      GLN   5  -6.574  -0.463   5.603
   34    HG2  GLN   5           2HG      GLN   5  -8.460   0.705   5.222
   35    HG3  GLN   5           1HG      GLN   5  -9.469  -0.677   5.653
   36   HE21  GLN   5          1HE2      GLN   5  -7.617   2.031   7.117
   37   HE22  GLN   5          2HE2      GLN   5  -8.550   2.106   8.533
   38    H    CYS   6           H        CYS   6  -5.414  -2.632   4.419
   39    HA   CYS   6           HA       CYS   6  -6.494  -2.053   1.726
   40    HB2  CYS   6           2HB      CYS   6  -3.744  -2.208   2.925
   41    HB3  CYS   6           1HB      CYS   6  -3.929  -2.380   1.187
   42    H    CYS   7           H        CYS   7  -6.319  -4.710   3.611
   43    HA   CYS   7           HA       CYS   7  -5.853  -6.458   1.233
   44    HB2  CYS   7           2HB      CYS   7  -4.044  -6.739   2.885
   45    HB3  CYS   7           1HB      CYS   7  -5.228  -7.090   4.132
   46    H    THR   8           H        THR   8  -7.911  -5.625   3.904
   47    HA   THR   8           HA       THR   8  -9.571  -8.027   3.680
   48    HB   THR   8           HB       THR   8  -9.575  -6.934   5.821
   49    HG1  THR   8           HG1      THR   8 -11.783  -6.416   6.008
   50   HG21  THR   8          3HG2      THR   8  -8.824  -4.745   5.348
   51   HG22  THR   8          1HG2      THR   8 -10.482  -4.516   5.907
   52   HG23  THR   8          2HG2      THR   8 -10.116  -4.462   4.183
   53    H    SER   9           H        SER   9  -9.094  -5.374   1.735
   54    HA   SER   9           HA       SER   9 -11.422  -5.947   0.109
   55    HG   SER   9           HG       SER   9 -13.543  -3.363   0.473
   56    HB2  SER   9           2HB      SER   9 -12.429  -4.524   1.906
   57    HB3  SER   9           1HB      SER   9 -11.299  -3.241   1.482
   58    H    ILE  10           H        ILE  10 -11.137  -2.904  -0.719
   59    HA   ILE  10           HA       ILE  10  -8.542  -3.275  -2.153
   60    HB   ILE  10           HB       ILE  10 -11.124  -2.080  -3.191
   61   HG12  ILE  10          2HG1      ILE  10  -9.606  -4.275  -4.532
   62   HG13  ILE  10          1HG1      ILE  10 -10.506  -4.686  -3.070
   63   HG21  ILE  10          1HG2      ILE  10  -8.574  -1.238  -3.818
   64   HG22  ILE  10          2HG2      ILE  10  -9.968  -1.106  -4.889
   65   HG23  ILE  10          3HG2      ILE  10  -8.868  -2.474  -5.041
   66   HD11  ILE  10          3HD1      ILE  10 -11.501  -4.134  -5.738
   67   HD12  ILE  10          1HD1      ILE  10 -12.240  -3.058  -4.551
   68   HD13  ILE  10          2HD1      ILE  10 -12.352  -4.806  -4.347
   69    H    CYS  11           H        CYS  11  -7.206  -1.437  -2.251
   70    HA   CYS  11           HA       CYS  11  -8.151   0.872  -0.609
   71    HB2  CYS  11           2HB      CYS  11  -5.520  -0.457  -0.984
   72    HB3  CYS  11           1HB      CYS  11  -5.484   1.301  -0.839
   73    H    SER  12           H        SER  12  -6.652   2.935  -1.407
   74    HA   SER  12           HA       SER  12  -7.163   3.143  -4.351
   75    HG   SER  12           HG       SER  12  -7.139   4.817  -1.301
   76    HB2  SER  12           2HB      SER  12  -7.726   5.502  -3.979
   77    HB3  SER  12           1HB      SER  12  -8.764   4.465  -3.004
   78    H    LEU  13           H        LEU  13  -5.438   3.702  -5.560
   79    HA   LEU  13           HA       LEU  13  -2.807   3.859  -4.660
   80    HG   LEU  13           HG       LEU  13  -2.093   5.633  -8.017
   81    HB2  LEU  13           2HB      LEU  13  -2.897   3.721  -6.945
   82    HB3  LEU  13           1HB      LEU  13  -4.296   4.766  -7.063
   83   HD11  LEU  13          1HD1      LEU  13  -2.813   7.736  -6.172
   84   HD12  LEU  13          2HD1      LEU  13  -4.248   6.893  -6.759
   85   HD13  LEU  13          3HD1      LEU  13  -3.121   7.620  -7.905
   86   HD21  LEU  13          3HD2      LEU  13  -1.213   6.873  -5.602
   87   HD22  LEU  13          1HD2      LEU  13  -0.301   5.845  -6.707
   88   HD23  LEU  13          2HD2      LEU  13  -1.210   5.124  -5.378
   89    H    TYR  14           H        TYR  14  -5.260   6.381  -4.856
   90    HA   TYR  14           HA       TYR  14  -3.742   8.678  -4.330
   91    HD1  TYR  14           HD1      TYR  14  -4.637  10.456  -5.277
   92    HD2  TYR  14           HD2      TYR  14  -6.665  10.075  -1.508
   93    HE1  TYR  14           HE1      TYR  14  -4.452  12.906  -4.930
   94    HE2  TYR  14           HE2      TYR  14  -6.480  12.525  -1.161
   95    HH   TYR  14           HH       TYR  14  -6.238  14.586  -2.709
   96    HB2  TYR  14           2HB      TYR  14  -6.339   8.417  -4.524
   97    HB3  TYR  14           1HB      TYR  14  -6.272   8.169  -2.779
   98    H    GLN  15           H        GLN  15  -5.305   6.707  -1.838
   99    HA   GLN  15           HA       GLN  15  -3.743   7.769   0.317
  100    HB2  GLN  15           2HB      GLN  15  -5.581   5.448  -0.051
  101    HB3  GLN  15           1HB      GLN  15  -4.522   5.450   1.359
  102    HG2  GLN  15           2HG      GLN  15  -6.475   7.640   0.585
  103    HG3  GLN  15           1HG      GLN  15  -6.653   6.513   1.931
  104   HE21  GLN  15          1HE2      GLN  15  -6.189   9.603   1.756
  105   HE22  GLN  15          2HE2      GLN  15  -4.916   9.864   2.847
  106    H    LEU  16           H        LEU  16  -3.561   4.743  -1.488
  107    HA   LEU  16           HA       LEU  16  -1.486   3.401  -0.307
  108    HG   LEU  16           HG       LEU  16  -0.821   1.503  -1.518
  109    HB2  LEU  16           2HB      LEU  16  -2.630   3.489  -2.925
  110    HB3  LEU  16           1HB      LEU  16  -0.881   3.424  -3.097
  111   HD11  LEU  16          1HD1      LEU  16  -3.394   2.370  -0.896
  112   HD12  LEU  16          2HD1      LEU  16  -2.644   0.869  -0.351
  113   HD13  LEU  16          3HD1      LEU  16  -3.656   0.876  -1.797
  114   HD21  LEU  16          3HD2      LEU  16  -0.855   1.070  -3.916
  115   HD22  LEU  16          1HD2      LEU  16  -2.611   1.228  -3.951
  116   HD23  LEU  16          2HD2      LEU  16  -1.865  -0.127  -3.107
  117    H    GLU  17           H        GLU  17  -1.181   6.290  -2.338
  118    HA   GLU  17           HA       GLU  17   1.712   6.223  -2.331
  119    HB2  GLU  17           2HB      GLU  17   0.669   7.376  -4.143
  120    HB3  GLU  17           1HB      GLU  17  -0.301   8.364  -3.051
  121    HG2  GLU  17           2HG      GLU  17   2.555   8.583  -2.493
  122    HG3  GLU  17           1HG      GLU  17   2.157   9.072  -4.141
  123    H    ASN  18           H        ASN  18  -0.732   7.581  -0.233
  124    HA   ASN  18           HA       ASN  18   1.011   9.435   1.142
  125    HB2  ASN  18           2HB      ASN  18  -1.520   9.509   1.144
  126    HB3  ASN  18           1HB      ASN  18  -1.488   8.143   2.258
  127   HD21  ASN  18          1HD2      ASN  18  -1.534   8.764   4.421
  128   HD22  ASN  18          2HD2      ASN  18  -0.936  10.232   5.029
  129    H    TYR  19           H        TYR  19   0.975   6.064   1.133
  130    HA   TYR  19           HA       TYR  19   1.821   5.880   3.967
  131    HD1  TYR  19           HD2      TYR  19   0.333   4.943   5.269
  132    HD2  TYR  19           HD1      TYR  19  -0.864   3.424   1.433
  133    HE1  TYR  19           HE2      TYR  19  -2.047   5.077   5.958
  134    HE2  TYR  19           HE1      TYR  19  -3.244   3.558   2.121
  135    HH   TYR  19           HH       TYR  19  -4.508   3.520   4.370
  136    HB2  TYR  19           2HB      TYR  19   1.399   3.734   1.867
  137    HB3  TYR  19           1HB      TYR  19   1.867   3.427   3.540
  138    H    CYS  20           H        CYS  20   3.447   7.225   1.813
  139    HA   CYS  20           HA       CYS  20   5.800   5.402   1.766
  140    HB2  CYS  20           2HB      CYS  20   4.843   6.861  -0.258
  141    HB3  CYS  20           1HB      CYS  20   5.917   8.060   0.424
  142    H    ASN  21           H        ASN  21   7.891   6.949   1.785
  143    HA   ASN  21           HA       ASN  21   7.723   8.461   4.362
  144    HB2  ASN  21           2HB      ASN  21   9.130   6.339   4.309
  145    HB3  ASN  21           1HB      ASN  21  10.201   7.180   3.188
  146   HD21  ASN  21          1HD2      ASN  21  12.015   7.623   4.500
  147   HD22  ASN  21          2HD2      ASN  21  11.941   8.476   5.966
  148    HA   PHE   1           HA       PHE   1  -7.402   4.929 -11.063
  149    HD1  PHE   1           HD1      PHE   1  -7.971   6.906 -10.910
  150    HD2  PHE   1           HD2      PHE   1  -8.030   5.765  -6.766
  151    HE1  PHE   1           HE1      PHE   1  -7.141   9.156 -10.279
  152    HE2  PHE   1           HE2      PHE   1  -7.199   8.017  -6.137
  153    HZ   PHE   1           HZ       PHE   1  -6.755   9.712  -7.893
  154    H1   PHE   1           1H       PHE   1  -8.966   5.935 -12.244
  155    H2   PHE   1           2H       PHE   1  -9.928   5.983 -10.844
  156    H3   PHE   1           3H       PHE   1 -10.093   4.702 -11.949
  157    HB2  PHE   1           2HB      PHE   1  -9.612   4.733  -9.010
  158    HB3  PHE   1           1HB      PHE   1  -8.009   4.060  -8.717
  159    H    VAL   2           H        VAL   2  -7.055   2.611  -9.848
  160    HA   VAL   2           HA       VAL   2  -8.570   0.634 -11.508
  161    HB   VAL   2           HB       VAL   2  -6.272   0.742 -12.270
  162   HG11  VAL   2          1HG1      VAL   2  -5.787   1.131  -9.428
  163   HG12  VAL   2          2HG1      VAL   2  -4.731   1.487 -10.796
  164   HG13  VAL   2          3HG1      VAL   2  -4.743  -0.129 -10.086
  165   HG21  VAL   2          3HG2      VAL   2  -5.763  -1.636 -10.728
  166   HG22  VAL   2          1HG2      VAL   2  -6.264  -1.508 -12.415
  167   HG23  VAL   2          2HG2      VAL   2  -7.478  -1.568 -11.135
  168    H    ASN   3           H        ASN   3  -9.747  -0.791 -10.317
  169    HA   ASN   3           HA       ASN   3  -9.640  -0.826  -7.436
  170    HB2  ASN   3           2HB      ASN   3 -10.858  -2.897  -9.288
  171    HB3  ASN   3           1HB      ASN   3 -11.263  -2.633  -7.592
  172   HD21  ASN   3          1HD2      ASN   3 -13.304  -2.433  -9.551
  173   HD22  ASN   3          2HD2      ASN   3 -13.779  -0.809  -9.692
  174    H    GLN   4           H        GLN   4  -7.850  -1.642  -6.408
  175    HA   GLN   4           HA       GLN   4  -6.886  -4.310  -7.296
  176    HB2  GLN   4           2HB      GLN   4  -5.070  -3.240  -8.136
  177    HB3  GLN   4           1HB      GLN   4  -5.437  -1.749  -7.278
  178    HG2  GLN   4           2HG      GLN   4  -4.415  -4.078  -5.694
  179    HG3  GLN   4           1HG      GLN   4  -3.274  -3.182  -6.694
  180   HE21  GLN   4          1HE2      GLN   4  -4.902  -3.157  -3.668
  181   HE22  GLN   4          2HE2      GLN   4  -4.522  -1.566  -3.219
  182    H    HIS   5           H        HIS   5  -6.308  -5.691  -5.636
  183    HA   HIS   5           HA       HIS   5  -7.016  -4.812  -2.897
  184    HD2  HIS   5           HD2      HIS   5  -9.580  -6.172  -4.511
  185    HE1  HIS   5           HE1      HIS   5  -8.093  -8.976  -7.305
  186    HE2  HIS   5           HE2      HIS   5 -10.058  -7.456  -6.725
  187    HB2  HIS   5           2HB      HIS   5  -6.060  -7.581  -3.275
  188    HB3  HIS   5           1HB      HIS   5  -7.525  -7.002  -2.488
  189    H    LEU   6           H        LEU   6  -5.458  -5.442  -1.095
  190    HA   LEU   6           HA       LEU   6  -2.637  -5.593  -2.009
  191    HG   LEU   6           HG       LEU   6  -2.897  -2.501  -2.511
  192    HB2  LEU   6           2HB      LEU   6  -3.974  -3.340  -0.654
  193    HB3  LEU   6           1HB      LEU   6  -2.490  -3.860   0.112
  194   HD11  LEU   6          1HD1      LEU   6  -1.682  -1.914  -0.136
  195   HD12  LEU   6          2HD1      LEU   6  -1.301  -1.130  -1.668
  196   HD13  LEU   6          3HD1      LEU   6  -0.312  -2.472  -1.096
  197   HD21  LEU   6          3HD2      LEU   6  -1.901  -4.342  -3.556
  198   HD22  LEU   6          1HD2      LEU   6  -1.023  -4.819  -2.103
  199   HD23  LEU   6          2HD2      LEU   6  -0.473  -3.443  -3.045
  200    H    CYS   7           H        CYS   7  -1.421  -6.920  -0.818
  201    HA   CYS   7           HA       CYS   7  -2.007  -7.359   2.023
  202    HB2  CYS   7           2HB      CYS   7  -2.126  -9.727   0.116
  203    HB3  CYS   7           1HB      CYS   7  -2.377  -9.761   1.858
  204    H    GLY   8           H        GLY   8   0.024  -7.343   2.881
  205    HA2  GLY   8           2HA      GLY   8   2.397  -7.432   2.912
  206    HA3  GLY   8           1HA      GLY   8   2.039  -9.135   2.666
  207    H    SER   9           H        SER   9   2.945 -10.051   0.911
  208    HA   SER   9           HA       SER   9   4.778  -8.916  -0.787
  209    HG   SER   9           HG       SER   9   5.046 -12.128  -1.433
  210    HB2  SER   9           2HB      SER   9   3.152 -11.305  -0.836
  211    HB3  SER   9           1HB      SER   9   3.339 -10.669  -2.467
  212    H    ASP  10           H        ASP  10   1.290  -9.177  -1.536
  213    HA   ASP  10           HA       ASP  10   1.525  -7.553  -3.921
  214    HB2  ASP  10           2HB      ASP  10  -0.862  -8.304  -2.205
  215    HB3  ASP  10           1HB      ASP  10  -0.974  -7.485  -3.759
  216    H    LEU  11           H        LEU  11   1.024  -6.986  -0.533
  217    HA   LEU  11           HA       LEU  11  -0.002  -4.323  -0.630
  218    HG   LEU  11           HG       LEU  11   1.855  -3.445   2.071
  219    HB2  LEU  11           2HB      LEU  11  -0.014  -5.702   1.408
  220    HB3  LEU  11           1HB      LEU  11   1.744  -5.694   1.444
  221   HD11  LEU  11          1HD1      LEU  11  -0.385  -2.079   1.990
  222   HD12  LEU  11          2HD1      LEU  11  -0.845  -3.284   0.788
  223   HD13  LEU  11          3HD1      LEU  11   0.574  -2.271   0.524
  224   HD21  LEU  11          3HD2      LEU  11   0.668  -3.397   4.056
  225   HD22  LEU  11          1HD2      LEU  11   0.496  -5.103   3.641
  226   HD23  LEU  11          2HD2      LEU  11  -0.816  -3.976   3.298
  227    H    VAL  12           H        VAL  12   3.333  -5.579  -0.685
  228    HA   VAL  12           HA       VAL  12   4.479  -2.898  -0.600
  229    HB   VAL  12           HB       VAL  12   6.595  -4.164  -1.282
  230   HG11  VAL  12          1HG1      VAL  12   5.287  -3.878   1.157
  231   HG12  VAL  12          2HG1      VAL  12   6.966  -4.369   0.937
  232   HG13  VAL  12          3HG1      VAL  12   5.705  -5.590   1.106
  233   HG21  VAL  12          3HG2      VAL  12   5.185  -6.051  -2.298
  234   HG22  VAL  12          1HG2      VAL  12   4.901  -6.583  -0.641
  235   HG23  VAL  12          2HG2      VAL  12   6.542  -6.545  -1.287
  236    H    GLU  13           H        GLU  13   3.675  -5.249  -3.124
  237    HA   GLU  13           HA       GLU  13   5.023  -4.071  -5.300
  238    HB2  GLU  13           2HB      GLU  13   3.762  -6.206  -5.446
  239    HB3  GLU  13           1HB      GLU  13   2.250  -5.303  -5.334
  240    HG2  GLU  13           2HG      GLU  13   3.862  -4.096  -7.368
  241    HG3  GLU  13           1HG      GLU  13   3.802  -5.834  -7.667
  242    H    ALA  14           H        ALA  14   1.697  -3.378  -4.160
  243    HA   ALA  14           HA       ALA  14   1.226  -1.220  -5.971
  244    HB1  ALA  14           3HB      ALA  14   0.069  -1.467  -3.190
  245    HB2  ALA  14           1HB      ALA  14  -0.491  -2.437  -4.553
  246    HB3  ALA  14           2HB      ALA  14  -0.653  -0.685  -4.597
  247    H    LEU  15           H        LEU  15   2.260  -1.154  -2.547
  248    HA   LEU  15           HA       LEU  15   2.640   1.663  -2.405
  249    HG   LEU  15           HG       LEU  15   1.801  -0.793  -0.532
  250    HB2  LEU  15           2HB      LEU  15   4.182  -0.504  -0.943
  251    HB3  LEU  15           1HB      LEU  15   4.096   1.193  -0.478
  252   HD11  LEU  15          1HD1      LEU  15   3.276   0.713   1.634
  253   HD12  LEU  15          2HD1      LEU  15   3.192  -1.035   1.412
  254   HD13  LEU  15          3HD1      LEU  15   1.755  -0.138   1.904
  255   HD21  LEU  15          3HD2      LEU  15   1.750   2.135   0.265
  256   HD22  LEU  15          1HD2      LEU  15   0.380   1.029   0.187
  257   HD23  LEU  15          2HD2      LEU  15   1.180   1.545  -1.296
  258    H    TYR  16           H        TYR  16   4.628  -0.906  -3.724
  259    HA   TYR  16           HA       TYR  16   7.123   0.449  -3.825
  260    HD1  TYR  16           HD2      TYR  16   9.189  -0.068  -4.792
  261    HD2  TYR  16           HD1      TYR  16   6.935  -3.605  -3.855
  262    HE1  TYR  16           HE2      TYR  16  11.156  -1.008  -3.608
  263    HE2  TYR  16           HE1      TYR  16   8.901  -4.544  -2.670
  264    HH   TYR  16           HH       TYR  16  11.991  -3.363  -3.022
  265    HB2  TYR  16           2HB      TYR  16   5.913  -1.898  -5.055
  266    HB3  TYR  16           1HB      TYR  16   6.993  -1.059  -6.168
  267    H    LEU  17           H        LEU  17   4.905   0.017  -6.603
  268    HA   LEU  17           HA       LEU  17   6.099   1.889  -8.290
  269    HG   LEU  17           HG       LEU  17   3.222   0.627  -6.804
  270    HB2  LEU  17           2HB      LEU  17   3.651   2.278  -9.153
  271    HB3  LEU  17           1HB      LEU  17   4.414   0.705  -9.356
  272   HD11  LEU  17          1HD1      LEU  17   1.255   1.735  -6.858
  273   HD12  LEU  17          2HD1      LEU  17   0.922   1.212  -8.509
  274   HD13  LEU  17          3HD1      LEU  17   1.927   2.632  -8.220
  275   HD21  LEU  17          3HD2      LEU  17   1.755  -0.487  -9.142
  276   HD22  LEU  17          1HD2      LEU  17   2.270  -1.286  -7.657
  277   HD23  LEU  17          2HD2      LEU  17   3.432  -0.995  -8.950
  278    H    VAL  18           H        VAL  18   3.717   2.561  -5.704
  279    HA   VAL  18           HA       VAL  18   3.583   5.383  -6.358
  280    HB   VAL  18           HB       VAL  18   2.520   5.648  -4.144
  281   HG11  VAL  18          1HG1      VAL  18   0.564   4.716  -4.838
  282   HG12  VAL  18          2HG1      VAL  18   1.295   3.130  -5.093
  283   HG13  VAL  18          3HG1      VAL  18   1.489   4.396  -6.305
  284   HG21  VAL  18          3HG2      VAL  18   2.143   3.612  -2.768
  285   HG22  VAL  18          1HG2      VAL  18   3.846   4.056  -2.861
  286   HG23  VAL  18          2HG2      VAL  18   3.223   2.728  -3.840
  287    H    CYS  19           H        CYS  19   5.277   3.523  -3.885
  288    HA   CYS  19           HA       CYS  19   6.671   5.808  -2.802
  289    HB2  CYS  19           2HB      CYS  19   6.830   2.846  -2.504
  290    HB3  CYS  19           1HB      CYS  19   8.265   3.767  -2.070
  291    H    GLY  20           H        GLY  20   7.867   3.051  -4.732
  292    HA2  GLY  20           2HA      GLY  20   9.513   3.022  -6.428
  293    HA3  GLY  20           1HA      GLY  20   9.544   4.789  -6.374
  294    H    GLU  21           H        GLU  21  11.914   4.703  -6.345
  295    HA   GLU  21           HA       GLU  21  13.296   3.340  -4.188
  296    HB2  GLU  21           2HB      GLU  21  14.085   4.446  -6.579
  297    HB3  GLU  21           1HB      GLU  21  14.685   5.628  -5.414
  298    HG2  GLU  21           2HG      GLU  21  16.427   4.003  -5.673
  299    HG3  GLU  21           1HG      GLU  21  15.668   3.671  -4.116
  300    H    ARG  22           H        ARG  22  11.287   4.800  -2.991
  301    HA   ARG  22           HA       ARG  22  12.808   6.965  -1.624
  302    HE   ARG  22           HE       ARG  22   8.553   8.628  -3.950
  303    HB2  ARG  22           2HB      ARG  22  10.106   6.946  -2.795
  304    HB3  ARG  22           1HB      ARG  22  10.149   7.521  -1.127
  305    HG2  ARG  22           2HG      ARG  22  11.080   9.472  -1.760
  306    HG3  ARG  22           1HG      ARG  22  12.365   8.627  -2.625
  307    HD2  ARG  22           2HD      ARG  22  11.102  10.001  -4.201
  308    HD3  ARG  22           1HD      ARG  22  10.810   8.297  -4.546
  309   HH11  ARG  22          1HH2      ARG  22   9.070   9.679  -1.198
  310   HH12  ARG  22          2HH2      ARG  22   8.422  11.282  -1.290
  311   HH21  ARG  22          1HH1      ARG  22   8.360  11.341  -4.758
  312   HH22  ARG  22          2HH1      ARG  22   8.020  12.224  -3.308
  313    H    GLY  23           H        GLY  23  11.372   3.922  -1.393
  314    HA2  GLY  23           2HA      GLY  23  11.368   2.531   0.535
  315    HA3  GLY  23           1HA      GLY  23  11.709   3.948   1.526
  316    H    PHE  24           H        PHE  24   9.481   1.677   1.263
  317    HA   PHE  24           HA       PHE  24   7.160   3.534   1.582
  318    HD1  PHE  24           HD2      PHE  24   8.803   0.879  -0.840
  319    HD2  PHE  24           HD1      PHE  24   6.448  -0.696   2.393
  320    HE1  PHE  24           HE2      PHE  24  10.039  -1.267  -0.984
  321    HE2  PHE  24           HE1      PHE  24   7.684  -2.843   2.246
  322    HZ   PHE  24           HZ       PHE  24   9.479  -3.128   0.558
  323    HB2  PHE  24           2HB      PHE  24   5.817   1.357   1.314
  324    HB3  PHE  24           1HB      PHE  24   6.654   1.929  -0.123
  325    H    PHE  25           H        PHE  25   5.455   2.397   3.177
  326    HA   PHE  25           HA       PHE  25   6.995   1.903   5.670
  327    HD1  PHE  25           HD2      PHE  25   6.161   1.368   7.866
  328    HD2  PHE  25           HD1      PHE  25   5.011   5.320   6.624
  329    HE1  PHE  25           HE2      PHE  25   7.034   2.291   9.995
  330    HE2  PHE  25           HE1      PHE  25   5.886   6.240   8.752
  331    HZ   PHE  25           HZ       PHE  25   6.896   4.728  10.438
  332    HB2  PHE  25           2HB      PHE  25   4.783   3.529   5.120
  333    HB3  PHE  25           1HB      PHE  25   4.102   2.157   5.992
  334    H    TYR  26           H        TYR  26   3.819   0.710   4.433
  335    HA   TYR  26           HA       TYR  26   2.876  -1.440   4.668
  336    HD1  TYR  26           HD1      TYR  26   2.508  -3.556   4.910
  337    HD2  TYR  26           HD2      TYR  26   6.642  -4.285   3.969
  338    HE1  TYR  26           HE1      TYR  26   2.222  -5.944   5.501
  339    HE2  TYR  26           HE2      TYR  26   6.348  -6.671   4.558
  340    HH   TYR  26           HH       TYR  26   4.487  -8.317   4.684
  341    HB2  TYR  26           2HB      TYR  26   4.469  -2.143   3.025
  342    HB3  TYR  26           1HB      TYR  26   5.803  -2.023   4.158
  343    H    THR  27           H        THR  27   2.751  -0.391   7.038
  344    HA   THR  27           HA       THR  27   4.513  -1.608   9.012
  345    HB   THR  27           HB       THR  27   3.612   0.537   9.556
  346    HG1  THR  27           HG1      THR  27   1.866  -0.520  11.224
  347   HG21  THR  27          3HG2      THR  27   0.937   0.498   9.836
  348   HG22  THR  27          1HG2      THR  27   1.094  -0.686   8.537
  349   HG23  THR  27          2HG2      THR  27   1.719   0.949   8.321
  350    H    LYS  28           H        LYS  28   3.745  -3.017  10.741
  351    HA   LYS  28           HA       LYS  28   1.242  -4.476  10.455
  352    HB2  LYS  28           2HB      LYS  28   3.535  -5.407   9.008
  353    HB3  LYS  28           1HB      LYS  28   3.218  -6.536  10.324
  354    HG2  LYS  28           2HG      LYS  28   0.718  -6.311   9.529
  355    HG3  LYS  28           1HG      LYS  28   1.454  -5.776   8.017
  356    HD2  LYS  28           2HD      LYS  28   2.103  -7.871   7.488
  357    HD3  LYS  28           1HD      LYS  28   2.783  -8.136   9.094
  358    HE2  LYS  28           2HE      LYS  28   0.898  -9.153   9.870
  359    HE3  LYS  28           1HE      LYS  28  -0.172  -8.073   8.977
  360    HZ1  LYS  28           3HZ      LYS  28   0.606  -9.296   6.929
  361    HZ2  LYS  28           1HZ      LYS  28  -0.405 -10.163   7.978
  362    HZ3  LYS  28           2HZ      LYS  28   1.268 -10.457   7.977
  363    HA   PRO  29           HA       PRO  29   3.056  -4.379  14.642
  364    HB2  PRO  29           2HB      PRO  29   0.677  -3.758  15.876
  365    HB3  PRO  29           1HB      PRO  29   1.795  -2.548  15.223
  366    HG2  PRO  29           2HG      PRO  29  -0.801  -3.507  14.100
  367    HG3  PRO  29           1HG      PRO  29  -0.005  -1.936  13.904
  368    HD2  PRO  29           2HD      PRO  29  -0.017  -4.009  11.998
  369    HD3  PRO  29           1HD      PRO  29   1.078  -2.613  11.996
  370    H    THR  30           H        THR  30   3.334  -6.410  15.460
  371    HA   THR  30           HA       THR  30   1.032  -8.306  15.381
  372    HB   THR  30           HB       THR  30   2.882  -9.311  14.301
  373    HG1  THR  30           HG1      THR  30   1.989 -10.320  16.426
  374   HG21  THR  30          3HG2      THR  30   4.739  -7.988  14.645
  375   HG22  THR  30          1HG2      THR  30   5.132  -9.320  15.731
  376   HG23  THR  30          2HG2      THR  30   4.439  -7.833  16.376
  Start of MODEL   14
    1    H1   GLY   1           1H       GLY   1  -0.695  -0.044  10.694
    2    H2   GLY   1           2H       GLY   1  -0.876  -1.666  10.225
    3    H3   GLY   1           3H       GLY   1  -1.067  -1.225  11.854
    4    HA2  GLY   1           1HA      GLY   1  -3.210  -1.525  10.659
    5    HA3  GLY   1           2HA      GLY   1  -3.060   0.086  11.427
    6    H    ILE   2           H        ILE   2  -1.585  -1.480   8.504
    7    HA   ILE   2           HA       ILE   2  -3.750  -0.346   6.802
    8    HB   ILE   2           HB       ILE   2  -1.282   0.287   6.468
    9   HG12  ILE   2          2HG1      ILE   2  -3.132  -0.776   4.340
   10   HG13  ILE   2          1HG1      ILE   2  -2.817   0.902   4.776
   11   HG21  ILE   2          1HG2      ILE   2  -0.399  -2.029   6.683
   12   HG22  ILE   2          2HG2      ILE   2   0.059  -1.275   5.156
   13   HG23  ILE   2          3HG2      ILE   2  -1.243  -2.464   5.196
   14   HD11  ILE   2          3HD1      ILE   2  -1.576   0.691   2.810
   15   HD12  ILE   2          1HD1      ILE   2  -1.136  -0.980   3.152
   16   HD13  ILE   2          2HD1      ILE   2  -0.358   0.332   4.034
   17    H    THR   3           H        THR   3  -1.738  -3.286   7.123
   18    HA   THR   3           HA       THR   3  -2.880  -4.867   5.148
   19    HB   THR   3           HB       THR   3  -2.135  -5.714   7.964
   20    HG1  THR   3           HG1      THR   3  -0.753  -5.140   5.647
   21   HG21  THR   3          3HG2      THR   3  -2.645  -7.310   5.444
   22   HG22  THR   3          1HG2      THR   3  -3.510  -7.431   6.976
   23   HG23  THR   3          2HG2      THR   3  -1.832  -7.963   6.866
   24    H    GLU   4           H        GLU   4  -4.392  -3.696   8.046
   25    HA   GLU   4           HA       GLU   4  -6.665  -5.577   7.742
   26    HB2  GLU   4           2HB      GLU   4  -5.707  -5.060  10.011
   27    HB3  GLU   4           1HB      GLU   4  -6.272  -3.401   9.812
   28    HG2  GLU   4           2HG      GLU   4  -8.478  -3.974  10.075
   29    HG3  GLU   4           1HG      GLU   4  -8.264  -5.554   9.319
   30    H    GLN   5           H        GLN   5  -6.140  -3.512   5.718
   31    HA   GLN   5           HA       GLN   5  -8.843  -2.456   5.523
   32    HB2  GLN   5           2HB      GLN   5  -7.407  -0.829   7.063
   33    HB3  GLN   5           1HB      GLN   5  -6.760  -0.294   5.510
   34    HG2  GLN   5           2HG      GLN   5  -8.577   1.053   5.411
   35    HG3  GLN   5           1HG      GLN   5  -9.475  -0.414   5.018
   36   HE21  GLN   5          1HE2      GLN   5  -9.126   2.093   7.362
   37   HE22  GLN   5          2HE2      GLN   5 -10.139   1.425   8.550
   38    H    CYS   6           H        CYS   6  -5.481  -2.055   4.412
   39    HA   CYS   6           HA       CYS   6  -6.309  -1.549   1.664
   40    HB2  CYS   6           2HB      CYS   6  -3.664  -2.067   3.016
   41    HB3  CYS   6           1HB      CYS   6  -3.786  -1.994   1.265
   42    H    CYS   7           H        CYS   7  -6.241  -4.283   3.567
   43    HA   CYS   7           HA       CYS   7  -5.962  -6.003   1.143
   44    HB2  CYS   7           2HB      CYS   7  -4.133  -6.414   2.729
   45    HB3  CYS   7           1HB      CYS   7  -5.292  -6.694   4.017
   46    H    THR   8           H        THR   8  -7.524  -5.860   4.381
   47    HA   THR   8           HA       THR   8  -9.509  -7.823   3.862
   48    HB   THR   8           HB       THR   8 -10.805  -6.770   5.632
   49    HG1  THR   8           HG1      THR   8  -9.099  -4.558   5.161
   50   HG21  THR   8          3HG2      THR   8  -8.489  -7.842   6.104
   51   HG22  THR   8          1HG2      THR   8  -9.233  -6.875   7.375
   52   HG23  THR   8          2HG2      THR   8  -7.949  -6.185   6.382
   53    H    SER   9           H        SER   9  -9.048  -4.631   2.654
   54    HA   SER   9           HA       SER   9 -11.486  -4.910   0.981
   55    HG   SER   9           HG       SER   9 -12.686  -3.156   3.589
   56    HB2  SER   9           2HB      SER   9 -10.796  -2.212   2.097
   57    HB3  SER   9           1HB      SER   9 -12.352  -2.818   1.538
   58    H    ILE  10           H        ILE  10 -11.022  -2.210  -0.140
   59    HA   ILE  10           HA       ILE  10  -8.440  -2.776  -1.542
   60    HB   ILE  10           HB       ILE  10 -11.032  -1.619  -2.582
   61   HG12  ILE  10          2HG1      ILE  10  -9.435  -3.789  -3.880
   62   HG13  ILE  10          1HG1      ILE  10 -10.326  -4.188  -2.411
   63   HG21  ILE  10          1HG2      ILE  10  -9.552  -0.240  -3.716
   64   HG22  ILE  10          2HG2      ILE  10  -9.516  -1.651  -4.774
   65   HG23  ILE  10          3HG2      ILE  10  -8.225  -1.395  -3.599
   66   HD11  ILE  10          3HD1      ILE  10 -12.179  -4.391  -3.666
   67   HD12  ILE  10          1HD1      ILE  10 -11.334  -3.782  -5.089
   68   HD13  ILE  10          2HD1      ILE  10 -12.097  -2.654  -3.968
   69    H    CYS  11           H        CYS  11  -6.985  -1.080  -1.730
   70    HA   CYS  11           HA       CYS  11  -7.739   1.412  -0.275
   71    HB2  CYS  11           2HB      CYS  11  -5.247  -0.168  -0.548
   72    HB3  CYS  11           1HB      CYS  11  -5.039   1.584  -0.573
   73    H    SER  12           H        SER  12  -6.385   3.375  -1.151
   74    HA   SER  12           HA       SER  12  -6.658   3.385  -4.132
   75    HG   SER  12           HG       SER  12  -8.407   5.774  -1.629
   76    HB2  SER  12           2HB      SER  12  -6.750   6.014  -3.455
   77    HB3  SER  12           1HB      SER  12  -8.182   5.003  -3.627
   78    H    LEU  13           H        LEU  13  -4.655   3.122  -4.893
   79    HA   LEU  13           HA       LEU  13  -2.137   3.431  -4.002
   80    HG   LEU  13           HG       LEU  13  -3.670   2.346  -6.261
   81    HB2  LEU  13           2HB      LEU  13  -2.413   5.083  -6.418
   82    HB3  LEU  13           1HB      LEU  13  -1.453   3.639  -6.152
   83   HD11  LEU  13          1HD1      LEU  13  -4.608   5.045  -6.525
   84   HD12  LEU  13          2HD1      LEU  13  -5.556   3.557  -6.505
   85   HD13  LEU  13          3HD1      LEU  13  -4.942   4.192  -8.032
   86   HD21  LEU  13          3HD2      LEU  13  -2.922   3.791  -8.796
   87   HD22  LEU  13          1HD2      LEU  13  -3.446   2.118  -8.605
   88   HD23  LEU  13          2HD2      LEU  13  -1.846   2.611  -8.048
   89    H    TYR  14           H        TYR  14  -4.121   6.150  -5.052
   90    HA   TYR  14           HA       TYR  14  -2.346   8.267  -4.571
   91    HD1  TYR  14           HD1      TYR  14  -2.997  10.901  -4.855
   92    HD2  TYR  14           HD2      TYR  14  -6.193   9.201  -2.543
   93    HE1  TYR  14           HE1      TYR  14  -3.210  13.024  -3.587
   94    HE2  TYR  14           HE2      TYR  14  -6.410  11.321  -1.274
   95    HH   TYR  14           HH       TYR  14  -5.084  14.200  -2.277
   96    HB2  TYR  14           2HB      TYR  14  -4.375   8.843  -5.599
   97    HB3  TYR  14           1HB      TYR  14  -5.332   8.012  -4.375
   98    H    GLN  15           H        GLN  15  -4.747   6.990  -2.271
   99    HA   GLN  15           HA       GLN  15  -3.474   8.351  -0.021
  100    HB2  GLN  15           2HB      GLN  15  -5.810   6.573  -0.419
  101    HB3  GLN  15           1HB      GLN  15  -4.992   6.382   1.128
  102    HG2  GLN  15           2HG      GLN  15  -6.059   8.981  -0.013
  103    HG3  GLN  15           1HG      GLN  15  -6.731   8.083   1.349
  104   HE21  GLN  15          1HE2      GLN  15  -5.900  10.743   1.782
  105   HE22  GLN  15          2HE2      GLN  15  -4.494  10.746   2.734
  106    H    LEU  16           H        LEU  16  -3.429   5.237  -1.552
  107    HA   LEU  16           HA       LEU  16  -2.040   3.681   0.366
  108    HG   LEU  16           HG       LEU  16  -3.041   1.776  -0.380
  109    HB2  LEU  16           2HB      LEU  16  -2.913   3.414  -2.299
  110    HB3  LEU  16           1HB      LEU  16  -1.176   3.125  -2.349
  111   HD11  LEU  16          1HD1      LEU  16  -1.834   0.629  -2.917
  112   HD12  LEU  16          2HD1      LEU  16  -3.506   1.173  -2.786
  113   HD13  LEU  16          3HD1      LEU  16  -2.940  -0.181  -1.808
  114   HD21  LEU  16          3HD2      LEU  16  -1.179   0.786   0.443
  115   HD22  LEU  16          1HD2      LEU  16  -0.313   2.106  -0.343
  116   HD23  LEU  16          2HD2      LEU  16  -0.487   0.555  -1.162
  117    H    GLU  17           H        GLU  17  -0.966   6.164  -1.841
  118    HA   GLU  17           HA       GLU  17   1.865   5.560  -1.672
  119    HB2  GLU  17           2HB      GLU  17   1.111   6.834  -3.557
  120    HB3  GLU  17           1HB      GLU  17   0.314   8.015  -2.519
  121    HG2  GLU  17           2HG      GLU  17   2.440   8.811  -1.683
  122    HG3  GLU  17           1HG      GLU  17   3.305   7.519  -2.518
  123    H    ASN  18           H        ASN  18  -0.378   7.130   0.410
  124    HA   ASN  18           HA       ASN  18   1.404   8.944   1.742
  125    HB2  ASN  18           2HB      ASN  18  -1.203   8.733   1.864
  126    HB3  ASN  18           1HB      ASN  18  -0.873   7.578   3.156
  127   HD21  ASN  18          1HD2      ASN  18  -1.857   9.173   4.690
  128   HD22  ASN  18          2HD2      ASN  18  -0.945  10.508   5.207
  129    H    TYR  19           H        TYR  19   1.447   5.573   1.650
  130    HA   TYR  19           HA       TYR  19   2.531   5.348   4.401
  131    HD1  TYR  19           HD2      TYR  19   0.984   3.995   5.843
  132    HD2  TYR  19           HD1      TYR  19  -0.268   3.412   1.778
  133    HE1  TYR  19           HE2      TYR  19  -1.385   4.191   6.546
  134    HE2  TYR  19           HE1      TYR  19  -2.638   3.607   2.475
  135    HH   TYR  19           HH       TYR  19  -3.507   4.411   5.826
  136    HB2  TYR  19           2HB      TYR  19   2.001   3.185   2.336
  137    HB3  TYR  19           1HB      TYR  19   2.474   2.923   4.013
  138    H    CYS  20           H        CYS  20   4.021   6.810   2.334
  139    HA   CYS  20           HA       CYS  20   6.329   4.971   1.897
  140    HB2  CYS  20           2HB      CYS  20   5.225   6.609   0.100
  141    HB3  CYS  20           1HB      CYS  20   6.355   7.744   0.802
  142    H    ASN  21           H        ASN  21   8.423   6.594   1.853
  143    HA   ASN  21           HA       ASN  21   8.765   7.321   4.678
  144    HB2  ASN  21           2HB      ASN  21  10.601   6.152   3.632
  145    HB3  ASN  21           1HB      ASN  21  10.654   7.316   2.307
  146   HD21  ASN  21          1HD2      ASN  21  10.600   7.610   5.915
  147   HD22  ASN  21          2HD2      ASN  21  11.917   8.680   5.986
  148    HA   PHE   1           HA       PHE   1 -10.136   1.884 -12.521
  149    HD1  PHE   1           HD1      PHE   1  -8.828   0.357 -12.889
  150    HD2  PHE   1           HD2      PHE   1  -5.885   3.114 -11.402
  151    HE1  PHE   1           HE1      PHE   1  -7.405  -1.546 -12.176
  152    HE2  PHE   1           HE2      PHE   1  -4.462   1.210 -10.689
  153    HZ   PHE   1           HZ       PHE   1  -5.222  -1.119 -11.075
  154    H1   PHE   1           1H       PHE   1 -10.013   4.785 -12.714
  155    H2   PHE   1           2H       PHE   1 -11.311   4.148 -11.823
  156    H3   PHE   1           3H       PHE   1 -11.085   3.692 -13.444
  157    HB2  PHE   1           2HB      PHE   1  -8.322   3.078 -13.704
  158    HB3  PHE   1           1HB      PHE   1  -7.919   3.937 -12.217
  159    H    VAL   2           H        VAL   2 -11.175   1.358 -10.575
  160    HA   VAL   2           HA       VAL   2  -9.645   2.030  -8.134
  161    HB   VAL   2           HB       VAL   2 -11.440   3.757  -8.336
  162   HG11  VAL   2          1HG1      VAL   2 -13.559   1.829  -7.647
  163   HG12  VAL   2          2HG1      VAL   2 -12.965   1.692  -9.302
  164   HG13  VAL   2          3HG1      VAL   2 -13.612   3.226  -8.722
  165   HG21  VAL   2          3HG2      VAL   2 -11.591   3.750  -6.080
  166   HG22  VAL   2          1HG2      VAL   2 -10.703   2.227  -6.134
  167   HG23  VAL   2          2HG2      VAL   2 -12.466   2.219  -6.071
  168    H    ASN   3           H        ASN   3  -9.122  -0.042  -7.603
  169    HA   ASN   3           HA       ASN   3 -10.859  -1.805  -6.343
  170    HB2  ASN   3           2HB      ASN   3 -11.363  -1.794  -9.136
  171    HB3  ASN   3           1HB      ASN   3 -10.560  -3.319  -8.771
  172   HD21  ASN   3          1HD2      ASN   3 -13.465  -1.397  -8.135
  173   HD22  ASN   3          2HD2      ASN   3 -14.334  -2.639  -7.371
  174    H    GLN   4           H        GLN   4  -8.238  -1.021  -6.053
  175    HA   GLN   4           HA       GLN   4  -6.564  -3.267  -6.985
  176    HB2  GLN   4           2HB      GLN   4  -5.984  -0.673  -6.956
  177    HB3  GLN   4           1HB      GLN   4  -5.528  -1.012  -5.291
  178    HG2  GLN   4           2HG      GLN   4  -4.280  -1.969  -7.838
  179    HG3  GLN   4           1HG      GLN   4  -3.510  -1.391  -6.363
  180   HE21  GLN   4          1HE2      GLN   4  -4.721  -4.243  -8.004
  181   HE22  GLN   4          2HE2      GLN   4  -4.282  -5.361  -6.803
  182    H    HIS   5           H        HIS   5  -6.781  -5.036  -5.680
  183    HA   HIS   5           HA       HIS   5  -7.187  -4.781  -2.794
  184    HD2  HIS   5           HD2      HIS   5  -9.304  -6.373  -1.716
  185    HE1  HIS   5           HE1      HIS   5 -11.417  -6.962  -5.331
  186    HE2  HIS   5           HE2      HIS   5 -11.651  -6.558  -2.823
  187    HB2  HIS   5           2HB      HIS   5  -6.731  -7.115  -4.665
  188    HB3  HIS   5           1HB      HIS   5  -6.759  -7.331  -2.916
  189    H    LEU   6           H        LEU   6  -5.566  -4.781  -1.260
  190    HA   LEU   6           HA       LEU   6  -2.787  -5.330  -2.212
  191    HG   LEU   6           HG       LEU   6  -2.887  -2.194  -2.684
  192    HB2  LEU   6           2HB      LEU   6  -3.950  -3.005  -0.819
  193    HB3  LEU   6           1HB      LEU   6  -2.477  -3.613  -0.108
  194   HD11  LEU   6          1HD1      LEU   6  -1.111  -1.002  -1.939
  195   HD12  LEU   6          2HD1      LEU   6  -0.234  -2.435  -1.406
  196   HD13  LEU   6          3HD1      LEU   6  -1.502  -1.746  -0.391
  197   HD21  LEU   6          3HD2      LEU   6  -2.172  -4.180  -3.761
  198   HD22  LEU   6          1HD2      LEU   6  -1.103  -4.625  -2.431
  199   HD23  LEU   6          2HD2      LEU   6  -0.671  -3.296  -3.502
  200    H    CYS   7           H        CYS   7  -1.673  -6.778  -1.091
  201    HA   CYS   7           HA       CYS   7  -2.200  -7.197   1.771
  202    HB2  CYS   7           2HB      CYS   7  -2.570  -9.498  -0.184
  203    HB3  CYS   7           1HB      CYS   7  -2.737  -9.571   1.568
  204    H    GLY   8           H        GLY   8  -0.127  -7.270   2.534
  205    HA2  GLY   8           2HA      GLY   8   2.210  -7.626   2.559
  206    HA3  GLY   8           1HA      GLY   8   1.711  -9.272   2.190
  207    H    SER   9           H        SER   9   2.656 -10.109   0.437
  208    HA   SER   9           HA       SER   9   4.495  -8.981  -1.240
  209    HG   SER   9           HG       SER   9   4.831 -10.450  -3.265
  210    HB2  SER   9           2HB      SER   9   3.950 -11.341  -1.414
  211    HB3  SER   9           1HB      SER   9   2.337 -10.966  -2.012
  212    H    ASP  10           H        ASP  10   1.011  -9.092  -2.031
  213    HA   ASP  10           HA       ASP  10   1.277  -7.347  -4.315
  214    HB2  ASP  10           2HB      ASP  10  -1.082  -8.168  -2.601
  215    HB3  ASP  10           1HB      ASP  10  -1.239  -7.146  -4.026
  216    H    LEU  11           H        LEU  11   0.747  -6.906  -0.904
  217    HA   LEU  11           HA       LEU  11  -0.160  -4.211  -0.893
  218    HG   LEU  11           HG       LEU  11   1.843  -3.598   1.783
  219    HB2  LEU  11           2HB      LEU  11  -0.317  -5.584   1.088
  220    HB3  LEU  11           1HB      LEU  11   1.423  -5.830   1.121
  221   HD11  LEU  11          1HD1      LEU  11  -0.452  -2.172   1.944
  222   HD12  LEU  11          2HD1      LEU  11  -0.796  -3.163   0.531
  223   HD13  LEU  11          3HD1      LEU  11   0.623  -2.116   0.548
  224   HD21  LEU  11          3HD2      LEU  11   0.601  -3.392   3.806
  225   HD22  LEU  11          1HD2      LEU  11   0.657  -5.123   3.470
  226   HD23  LEU  11          2HD2      LEU  11  -0.803  -4.201   3.108
  227    H    VAL  12           H        VAL  12   3.161  -5.551  -0.845
  228    HA   VAL  12           HA       VAL  12   4.345  -2.895  -0.676
  229    HB   VAL  12           HB       VAL  12   6.465  -4.192  -1.368
  230   HG11  VAL  12          1HG1      VAL  12   5.440  -3.624   1.014
  231   HG12  VAL  12          2HG1      VAL  12   6.848  -4.674   0.861
  232   HG13  VAL  12          3HG1      VAL  12   5.247  -5.376   1.094
  233   HG21  VAL  12          3HG2      VAL  12   5.008  -6.080  -2.330
  234   HG22  VAL  12          1HG2      VAL  12   4.745  -6.569  -0.656
  235   HG23  VAL  12          2HG2      VAL  12   6.377  -6.563  -1.326
  236    H    GLU  13           H        GLU  13   3.443  -5.097  -3.273
  237    HA   GLU  13           HA       GLU  13   4.914  -3.913  -5.388
  238    HB2  GLU  13           2HB      GLU  13   3.544  -5.978  -5.640
  239    HB3  GLU  13           1HB      GLU  13   2.081  -5.002  -5.503
  240    HG2  GLU  13           2HG      GLU  13   3.128  -3.613  -7.457
  241    HG3  GLU  13           1HG      GLU  13   4.115  -5.051  -7.720
  242    H    ALA  14           H        ALA  14   1.473  -3.265  -4.630
  243    HA   ALA  14           HA       ALA  14   1.125  -0.958  -6.153
  244    HB1  ALA  14           3HB      ALA  14  -0.711  -1.994  -4.900
  245    HB2  ALA  14           1HB      ALA  14  -0.585  -0.291  -4.459
  246    HB3  ALA  14           2HB      ALA  14   0.043  -1.532  -3.374
  247    H    LEU  15           H        LEU  15   2.747  -1.301  -3.041
  248    HA   LEU  15           HA       LEU  15   3.110   1.584  -2.687
  249    HG   LEU  15           HG       LEU  15   1.977  -0.644  -0.934
  250    HB2  LEU  15           2HB      LEU  15   4.461  -0.776  -1.319
  251    HB3  LEU  15           1HB      LEU  15   4.603   0.904  -0.814
  252   HD11  LEU  15          1HD1      LEU  15   3.867   0.019   1.327
  253   HD12  LEU  15          2HD1      LEU  15   3.269  -1.567   0.836
  254   HD13  LEU  15          3HD1      LEU  15   2.175  -0.405   1.586
  255   HD21  LEU  15          3HD2      LEU  15   1.649   1.765  -1.218
  256   HD22  LEU  15          1HD2      LEU  15   2.761   2.110   0.107
  257   HD23  LEU  15          2HD2      LEU  15   1.209   1.341   0.436
  258    H    TYR  16           H        TYR  16   5.073  -1.130  -3.873
  259    HA   TYR  16           HA       TYR  16   7.538   0.261  -4.107
  260    HD1  TYR  16           HD2      TYR  16   9.768  -0.665  -5.335
  261    HD2  TYR  16           HD1      TYR  16   7.203  -3.486  -3.352
  262    HE1  TYR  16           HE2      TYR  16  11.696  -1.481  -4.007
  263    HE2  TYR  16           HE1      TYR  16   9.134  -4.304  -2.023
  264    HH   TYR  16           HH       TYR  16  11.766  -4.320  -2.430
  265    HB2  TYR  16           2HB      TYR  16   6.364  -2.212  -5.140
  266    HB3  TYR  16           1HB      TYR  16   7.480  -1.467  -6.285
  267    H    LEU  17           H        LEU  17   4.597   0.664  -5.835
  268    HA   LEU  17           HA       LEU  17   5.968   1.940  -8.138
  269    HG   LEU  17           HG       LEU  17   3.424  -0.218  -7.048
  270    HB2  LEU  17           2HB      LEU  17   2.997   2.019  -7.878
  271    HB3  LEU  17           1HB      LEU  17   3.992   1.720  -9.303
  272   HD11  LEU  17          1HD1      LEU  17   1.596  -0.091  -8.617
  273   HD12  LEU  17          2HD1      LEU  17   2.491  -1.572  -8.955
  274   HD13  LEU  17          3HD1      LEU  17   2.706  -0.156  -9.985
  275   HD21  LEU  17          3HD2      LEU  17   4.709  -1.718  -8.864
  276   HD22  LEU  17          1HD2      LEU  17   5.572  -0.877  -7.577
  277   HD23  LEU  17          2HD2      LEU  17   5.499  -0.176  -9.194
  278    H    VAL  18           H        VAL  18   3.737   2.746  -5.486
  279    HA   VAL  18           HA       VAL  18   3.632   5.568  -6.133
  280    HB   VAL  18           HB       VAL  18   2.639   5.805  -3.892
  281   HG11  VAL  18          1HG1      VAL  18   1.050   3.593  -4.275
  282   HG12  VAL  18          2HG1      VAL  18   1.755   3.825  -5.875
  283   HG13  VAL  18          3HG1      VAL  18   0.846   5.132  -5.114
  284   HG21  VAL  18          3HG2      VAL  18   3.699   3.012  -3.611
  285   HG22  VAL  18          1HG2      VAL  18   2.346   3.561  -2.628
  286   HG23  VAL  18          2HG2      VAL  18   3.905   4.378  -2.517
  287    H    CYS  19           H        CYS  19   5.428   3.606  -3.852
  288    HA   CYS  19           HA       CYS  19   6.876   5.769  -2.639
  289    HB2  CYS  19           2HB      CYS  19   6.981   2.802  -2.620
  290    HB3  CYS  19           1HB      CYS  19   8.490   3.621  -2.234
  291    H    GLY  20           H        GLY  20   8.013   3.196  -4.841
  292    HA2  GLY  20           2HA      GLY  20   9.554   3.376  -6.641
  293    HA3  GLY  20           1HA      GLY  20   9.648   5.116  -6.346
  294    H    GLU  21           H        GLU  21  12.034   4.878  -6.481
  295    HA   GLU  21           HA       GLU  21  13.403   3.228  -4.522
  296    HB2  GLU  21           2HB      GLU  21  14.310   4.097  -6.796
  297    HB3  GLU  21           1HB      GLU  21  14.660   5.587  -5.916
  298    HG2  GLU  21           2HG      GLU  21  16.360   4.640  -4.732
  299    HG3  GLU  21           1HG      GLU  21  15.504   3.109  -4.545
  300    H    ARG  22           H        ARG  22  11.554   4.751  -3.126
  301    HA   ARG  22           HA       ARG  22  13.313   6.643  -1.643
  302    HE   ARG  22           HE       ARG  22  11.648  10.641  -4.566
  303    HB2  ARG  22           2HB      ARG  22  10.431   6.839  -2.451
  304    HB3  ARG  22           1HB      ARG  22  10.923   7.552  -0.914
  305    HG2  ARG  22           2HG      ARG  22  12.462   9.025  -1.959
  306    HG3  ARG  22           1HG      ARG  22  12.431   8.114  -3.469
  307    HD2  ARG  22           2HD      ARG  22   9.794   8.743  -3.217
  308    HD3  ARG  22           1HD      ARG  22  10.536  10.150  -2.457
  309   HH11  ARG  22          1HH2      ARG  22  10.507   7.478  -4.783
  310   HH12  ARG  22          2HH2      ARG  22   9.922   7.619  -6.408
  311   HH21  ARG  22          1HH1      ARG  22  10.464  11.040  -6.588
  312   HH22  ARG  22          2HH1      ARG  22   9.900   9.636  -7.430
  313    H    GLY  23           H        GLY  23  11.595   3.724  -1.607
  314    HA2  GLY  23           2HA      GLY  23  11.619   2.163   0.202
  315    HA3  GLY  23           1HA      GLY  23  12.067   3.472   1.295
  316    H    PHE  24           H        PHE  24   9.841   1.373   1.317
  317    HA   PHE  24           HA       PHE  24   7.536   3.260   1.625
  318    HD1  PHE  24           HD2      PHE  24   8.752   1.133  -1.172
  319    HD2  PHE  24           HD1      PHE  24   7.387  -1.183   2.182
  320    HE1  PHE  24           HE2      PHE  24  10.198  -0.754  -1.885
  321    HE2  PHE  24           HE1      PHE  24   8.832  -3.068   1.469
  322    HZ   PHE  24           HZ       PHE  24  10.239  -2.853  -0.563
  323    HB2  PHE  24           2HB      PHE  24   6.305   0.872   1.621
  324    HB3  PHE  24           1HB      PHE  24   6.673   1.722   0.124
  325    H    PHE  25           H        PHE  25   5.882   1.808   3.255
  326    HA   PHE  25           HA       PHE  25   7.556   1.416   5.704
  327    HD1  PHE  25           HD2      PHE  25   7.456   1.627   7.834
  328    HD2  PHE  25           HD1      PHE  25   5.647   5.144   6.147
  329    HE1  PHE  25           HE2      PHE  25   8.787   3.045   9.370
  330    HE2  PHE  25           HE1      PHE  25   6.978   6.560   7.687
  331    HZ   PHE  25           HZ       PHE  25   8.547   5.513   9.299
  332    HB2  PHE  25           2HB      PHE  25   5.190   3.041   5.201
  333    HB3  PHE  25           1HB      PHE  25   4.902   1.896   6.509
  334    H    TYR  26           H        TYR  26   4.295   0.490   4.480
  335    HA   TYR  26           HA       TYR  26   3.110  -1.522   4.829
  336    HD1  TYR  26           HD1      TYR  26   2.326  -3.439   4.651
  337    HD2  TYR  26           HD2      TYR  26   6.366  -4.860   4.257
  338    HE1  TYR  26           HE1      TYR  26   1.561  -5.750   5.112
  339    HE2  TYR  26           HE2      TYR  26   5.596  -7.169   4.719
  340    HH   TYR  26           HH       TYR  26   2.442  -7.856   5.902
  341    HB2  TYR  26           2HB      TYR  26   4.654  -2.326   3.128
  342    HB3  TYR  26           1HB      TYR  26   5.929  -2.519   4.318
  343    H    THR  27           H        THR  27   3.588  -0.279   7.215
  344    HA   THR  27           HA       THR  27   5.012  -2.043   9.058
  345    HB   THR  27           HB       THR  27   4.687  -0.388  10.625
  346    HG1  THR  27           HG1      THR  27   2.212   0.290   9.428
  347   HG21  THR  27          3HG2      THR  27   3.715   1.520   8.598
  348   HG22  THR  27          1HG2      THR  27   5.126   0.587   8.101
  349   HG23  THR  27          2HG2      THR  27   5.187   1.561   9.570
  350    H    LYS  28           H        LYS  28   3.980  -3.242  10.789
  351    HA   LYS  28           HA       LYS  28   1.087  -3.795  10.346
  352    HB2  LYS  28           2HB      LYS  28   2.697  -5.531   9.313
  353    HB3  LYS  28           1HB      LYS  28   3.048  -5.996  10.976
  354    HG2  LYS  28           2HG      LYS  28   0.559  -6.272  11.329
  355    HG3  LYS  28           1HG      LYS  28   0.356  -6.050   9.592
  356    HD2  LYS  28           2HD      LYS  28   2.243  -8.123  10.717
  357    HD3  LYS  28           1HD      LYS  28   0.537  -8.476  10.437
  358    HE2  LYS  28           2HE      LYS  28   0.995  -8.855   8.267
  359    HE3  LYS  28           1HE      LYS  28   1.512  -7.178   8.102
  360    HZ1  LYS  28           3HZ      LYS  28   3.611  -8.330   9.346
  361    HZ2  LYS  28           1HZ      LYS  28   3.503  -8.055   7.676
  362    HZ3  LYS  28           2HZ      LYS  28   3.092  -9.575   8.313
  363    HA   PRO  29           HA       PRO  29   2.474  -3.560  14.892
  364    HB2  PRO  29           2HB      PRO  29   1.912  -0.939  15.471
  365    HB3  PRO  29           1HB      PRO  29   3.519  -1.503  14.979
  366    HG2  PRO  29           2HG      PRO  29   1.471  -0.023  13.378
  367    HG3  PRO  29           1HG      PRO  29   3.238   0.013  13.247
  368    HD2  PRO  29           2HD      PRO  29   1.534  -1.417  11.540
  369    HD3  PRO  29           1HD      PRO  29   3.272  -1.711  11.747
  370    H    THR  30           H        THR  30   0.729  -4.408  16.001
  371    HA   THR  30           HA       THR  30  -1.820  -2.906  16.018
  372    HB   THR  30           HB       THR  30  -3.083  -5.044  15.532
  373    HG1  THR  30           HG1      THR  30  -1.811  -6.715  15.587
  374   HG21  THR  30          3HG2      THR  30  -3.211  -4.419  13.353
  375   HG22  THR  30          1HG2      THR  30  -1.481  -4.638  13.093
  376   HG23  THR  30          2HG2      THR  30  -2.082  -3.150  13.822
  Start of MODEL   15
    1    H1   GLY   1           1H       GLY   1  -4.087   1.093  11.497
    2    H2   GLY   1           2H       GLY   1  -3.603  -0.168  12.526
    3    H3   GLY   1           3H       GLY   1  -4.960  -0.363  11.522
    4    HA2  GLY   1           1HA      GLY   1  -2.546   0.200  10.112
    5    HA3  GLY   1           2HA      GLY   1  -2.507  -1.376  10.963
    6    H    ILE   2           H        ILE   2  -1.867  -1.141   8.388
    7    HA   ILE   2           HA       ILE   2  -4.207  -0.553   6.641
    8    HB   ILE   2           HB       ILE   2  -1.900   0.466   6.201
    9   HG12  ILE   2          2HG1      ILE   2  -3.346  -1.202   4.126
   10   HG13  ILE   2          1HG1      ILE   2  -3.556   0.517   4.459
   11   HG21  ILE   2          1HG2      ILE   2  -0.676  -1.680   6.703
   12   HG22  ILE   2          2HG2      ILE   2  -0.229  -0.941   5.166
   13   HG23  ILE   2          3HG2      ILE   2  -1.314  -2.331   5.193
   14   HD11  ILE   2          3HD1      ILE   2  -1.330   1.008   3.637
   15   HD12  ILE   2          1HD1      ILE   2  -2.164   0.046   2.417
   16   HD13  ILE   2          2HD1      ILE   2  -0.968  -0.708   3.469
   17    H    THR   3           H        THR   3  -1.787  -3.080   7.316
   18    HA   THR   3           HA       THR   3  -2.527  -5.046   5.505
   19    HB   THR   3           HB       THR   3  -1.909  -5.435   8.450
   20    HG1  THR   3           HG1      THR   3  -0.402  -5.025   6.136
   21   HG21  THR   3          3HG2      THR   3  -0.967  -7.596   6.915
   22   HG22  THR   3          1HG2      THR   3  -2.612  -7.303   6.353
   23   HG23  THR   3          2HG2      THR   3  -2.307  -7.615   8.062
   24    H    GLU   4           H        GLU   4  -4.296  -3.914   8.291
   25    HA   GLU   4           HA       GLU   4  -6.370  -6.007   7.884
   26    HB2  GLU   4           2HB      GLU   4  -5.624  -5.588  10.204
   27    HB3  GLU   4           1HB      GLU   4  -6.107  -3.899  10.053
   28    HG2  GLU   4           2HG      GLU   4  -8.106  -4.590  10.869
   29    HG3  GLU   4           1HG      GLU   4  -8.384  -5.228   9.248
   30    H    GLN   5           H        GLN   5  -6.406  -4.490   5.740
   31    HA   GLN   5           HA       GLN   5  -8.987  -3.246   5.719
   32    HB2  GLN   5           2HB      GLN   5  -7.526  -1.499   6.937
   33    HB3  GLN   5           1HB      GLN   5  -6.729  -1.259   5.382
   34    HG2  GLN   5           2HG      GLN   5  -9.060  -0.904   4.397
   35    HG3  GLN   5           1HG      GLN   5  -9.640  -0.807   6.061
   36   HE21  GLN   5          1HE2      GLN   5  -8.140   0.779   7.467
   37   HE22  GLN   5          2HE2      GLN   5  -7.767   2.254   6.715
   38    H    CYS   6           H        CYS   6  -5.799  -2.763   4.178
   39    HA   CYS   6           HA       CYS   6  -6.908  -2.734   1.505
   40    HB2  CYS   6           2HB      CYS   6  -4.263  -2.522   2.765
   41    HB3  CYS   6           1HB      CYS   6  -4.240  -3.328   1.206
   42    H    CYS   7           H        CYS   7  -5.836  -5.173   3.670
   43    HA   CYS   7           HA       CYS   7  -5.724  -7.163   1.487
   44    HB2  CYS   7           2HB      CYS   7  -3.968  -7.189   3.164
   45    HB3  CYS   7           1HB      CYS   7  -5.152  -7.360   4.448
   46    H    THR   8           H        THR   8  -7.849  -5.981   3.928
   47    HA   THR   8           HA       THR   8  -9.611  -8.368   3.665
   48    HB   THR   8           HB       THR   8  -9.617  -5.999   5.554
   49    HG1  THR   8           HG1      THR   8  -9.521  -8.803   5.967
   50   HG21  THR   8          3HG2      THR   8 -11.794  -7.880   4.790
   51   HG22  THR   8          1HG2      THR   8 -11.897  -6.222   5.381
   52   HG23  THR   8          2HG2      THR   8 -11.600  -7.543   6.510
   53    H    SER   9           H        SER   9  -9.119  -5.189   2.524
   54    HA   SER   9           HA       SER   9 -11.572  -5.337   0.898
   55    HG   SER   9           HG       SER   9 -13.394  -3.203   1.408
   56    HB2  SER   9           2HB      SER   9 -12.297  -4.122   2.936
   57    HB3  SER   9           1HB      SER   9 -10.982  -2.973   2.713
   58    H    ILE  10           H        ILE  10 -11.505  -3.086  -0.498
   59    HA   ILE  10           HA       ILE  10  -8.712  -2.981  -1.533
   60    HB   ILE  10           HB       ILE  10 -11.357  -2.226  -2.792
   61   HG12  ILE  10          2HG1      ILE  10  -9.351  -4.327  -3.636
   62   HG13  ILE  10          1HG1      ILE  10 -10.672  -4.682  -2.521
   63   HG21  ILE  10          1HG2      ILE  10 -10.230  -1.039  -4.338
   64   HG22  ILE  10          2HG2      ILE  10  -9.115  -2.378  -4.606
   65   HG23  ILE  10          3HG2      ILE  10  -8.783  -1.196  -3.342
   66   HD11  ILE  10          3HD1      ILE  10 -11.550  -3.207  -4.890
   67   HD12  ILE  10          1HD1      ILE  10 -12.210  -4.678  -4.174
   68   HD13  ILE  10          2HD1      ILE  10 -10.839  -4.774  -5.280
   69    H    CYS  11           H        CYS  11  -7.573  -1.052  -1.520
   70    HA   CYS  11           HA       CYS  11  -8.985   1.283  -0.294
   71    HB2  CYS  11           2HB      CYS  11  -5.992   1.078  -0.525
   72    HB3  CYS  11           1HB      CYS  11  -6.954   1.961   0.657
   73    H    SER  12           H        SER  12  -7.660   3.421  -1.051
   74    HA   SER  12           HA       SER  12  -7.727   3.325  -4.035
   75    HG   SER  12           HG       SER  12  -8.854   6.314  -1.595
   76    HB2  SER  12           2HB      SER  12  -8.059   5.817  -3.841
   77    HB3  SER  12           1HB      SER  12  -9.365   4.864  -3.142
   78    H    LEU  13           H        LEU  13  -5.818   3.574  -5.070
   79    HA   LEU  13           HA       LEU  13  -3.303   3.670  -3.944
   80    HG   LEU  13           HG       LEU  13  -5.371   5.473  -6.074
   81    HB2  LEU  13           2HB      LEU  13  -2.544   4.755  -6.070
   82    HB3  LEU  13           1HB      LEU  13  -3.588   3.358  -6.305
   83   HD11  LEU  13          1HD1      LEU  13  -3.058   6.257  -7.864
   84   HD12  LEU  13          2HD1      LEU  13  -3.479   7.048  -6.345
   85   HD13  LEU  13          3HD1      LEU  13  -4.589   7.119  -7.713
   86   HD21  LEU  13          3HD2      LEU  13  -5.817   5.011  -8.409
   87   HD22  LEU  13          1HD2      LEU  13  -5.466   3.501  -7.568
   88   HD23  LEU  13          2HD2      LEU  13  -4.235   4.251  -8.585
   89    H    TYR  14           H        TYR  14  -5.511   6.279  -4.526
   90    HA   TYR  14           HA       TYR  14  -4.058   8.589  -4.272
   91    HD1  TYR  14           HD2      TYR  14  -5.698  10.535  -1.633
   92    HD2  TYR  14           HD1      TYR  14  -6.379   9.858  -5.823
   93    HE1  TYR  14           HE2      TYR  14  -5.692  12.985  -2.032
   94    HE2  TYR  14           HE1      TYR  14  -6.373  12.307  -6.220
   95    HH   TYR  14           HH       TYR  14  -6.439  14.328  -5.227
   96    HB2  TYR  14           2HB      TYR  14  -6.671   8.069  -4.204
   97    HB3  TYR  14           1HB      TYR  14  -6.430   8.334  -2.483
   98    H    GLN  15           H        GLN  15  -5.425   7.020  -1.390
   99    HA   GLN  15           HA       GLN  15  -3.537   8.345   0.378
  100    HB2  GLN  15           2HB      GLN  15  -4.596   7.139   2.133
  101    HB3  GLN  15           1HB      GLN  15  -5.865   7.507   0.974
  102    HG2  GLN  15           2HG      GLN  15  -5.698   5.264   0.018
  103    HG3  GLN  15           1HG      GLN  15  -4.357   4.885   1.100
  104   HE21  GLN  15          1HE2      GLN  15  -7.849   5.715   1.108
  105   HE22  GLN  15          2HE2      GLN  15  -8.174   4.988   2.607
  106    H    LEU  16           H        LEU  16  -3.898   5.164  -1.015
  107    HA   LEU  16           HA       LEU  16  -1.940   3.625   0.185
  108    HG   LEU  16           HG       LEU  16  -2.067   1.325  -2.571
  109    HB2  LEU  16           2HB      LEU  16  -3.419   3.290  -2.015
  110    HB3  LEU  16           1HB      LEU  16  -1.919   3.778  -2.803
  111   HD11  LEU  16          1HD1      LEU  16   0.023   2.305  -0.640
  112   HD12  LEU  16          2HD1      LEU  16   0.109   2.725  -2.352
  113   HD13  LEU  16          3HD1      LEU  16   0.154   1.035  -1.853
  114   HD21  LEU  16          3HD2      LEU  16  -3.034   2.044   0.001
  115   HD22  LEU  16          1HD2      LEU  16  -1.545   1.128   0.234
  116   HD23  LEU  16          2HD2      LEU  16  -2.877   0.427  -0.687
  117    H    GLU  17           H        GLU  17  -1.548   6.464  -1.801
  118    HA   GLU  17           HA       GLU  17   1.271   6.038  -2.322
  119    HB2  GLU  17           2HB      GLU  17   0.180   7.375  -3.910
  120    HB3  GLU  17           1HB      GLU  17  -0.631   8.337  -2.678
  121    HG2  GLU  17           2HG      GLU  17   2.284   8.437  -2.442
  122    HG3  GLU  17           1HG      GLU  17   1.715   9.025  -4.003
  123    H    ASN  18           H        ASN  18  -0.542   7.484   0.277
  124    HA   ASN  18           HA       ASN  18   1.754   8.950   1.336
  125    HB2  ASN  18           2HB      ASN  18  -0.997   9.008   1.801
  126    HB3  ASN  18           1HB      ASN  18  -0.327   8.335   3.287
  127   HD21  ASN  18          1HD2      ASN  18   1.846   9.624   3.957
  128   HD22  ASN  18          2HD2      ASN  18   1.699  11.314   3.906
  129    H    TYR  19           H        TYR  19   0.895   5.702   1.242
  130    HA   TYR  19           HA       TYR  19   2.169   5.060   3.841
  131    HD1  TYR  19           HD2      TYR  19   0.764   4.909   5.081
  132    HD2  TYR  19           HD1      TYR  19  -1.412   2.892   1.977
  133    HE1  TYR  19           HE2      TYR  19  -1.361   5.438   6.229
  134    HE2  TYR  19           HE1      TYR  19  -3.539   3.417   3.120
  135    HH   TYR  19           HH       TYR  19  -3.707   5.646   5.759
  136    HB2  TYR  19           2HB      TYR  19   0.899   3.291   1.730
  137    HB3  TYR  19           1HB      TYR  19   1.576   2.708   3.250
  138    H    CYS  20           H        CYS  20   3.283   5.874   0.879
  139    HA   CYS  20           HA       CYS  20   5.075   3.759   0.216
  140    HB2  CYS  20           2HB      CYS  20   6.060   5.226  -1.274
  141    HB3  CYS  20           1HB      CYS  20   4.497   5.953  -1.112
  142    H    ASN  21           H        ASN  21   7.585   5.047   0.228
  143    HA   ASN  21           HA       ASN  21   8.746   4.137   2.581
  144    HB2  ASN  21           2HB      ASN  21  10.691   5.075   1.796
  145    HB3  ASN  21           1HB      ASN  21   9.730   5.210   0.330
  146   HD21  ASN  21          1HD2      ASN  21  11.925   6.982   1.821
  147   HD22  ASN  21          2HD2      ASN  21  11.280   8.544   1.667
  148    HA   PHE   1           HA       PHE   1 -11.361   3.723 -13.641
  149    HD1  PHE   1           HD2      PHE   1 -10.557   6.942 -12.757
  150    HD2  PHE   1           HD1      PHE   1  -8.063   4.159 -10.635
  151    HE1  PHE   1           HE2      PHE   1 -10.338   8.562 -10.892
  152    HE2  PHE   1           HE1      PHE   1  -7.843   5.780  -8.769
  153    HZ   PHE   1           HZ       PHE   1  -8.981   7.981  -8.897
  154    H1   PHE   1           1H       PHE   1 -11.792   4.990 -11.654
  155    H2   PHE   1           2H       PHE   1 -10.844   3.931 -10.724
  156    H3   PHE   1           3H       PHE   1 -12.293   3.386 -11.425
  157    HB2  PHE   1           2HB      PHE   1  -8.591   3.816 -12.972
  158    HB3  PHE   1           1HB      PHE   1  -9.523   4.997 -13.888
  159    H    VAL   2           H        VAL   2  -9.239   2.478 -11.029
  160    HA   VAL   2           HA       VAL   2  -9.877  -0.276 -11.894
  161    HB   VAL   2           HB       VAL   2  -7.110   0.946 -12.022
  162   HG11  VAL   2          1HG1      VAL   2  -6.347  -1.420 -12.459
  163   HG12  VAL   2          2HG1      VAL   2  -7.933  -1.970 -11.914
  164   HG13  VAL   2          3HG1      VAL   2  -6.861  -1.124 -10.798
  165   HG21  VAL   2          3HG2      VAL   2  -7.149  -0.047 -14.287
  166   HG22  VAL   2          1HG2      VAL   2  -8.497   1.067 -14.061
  167   HG23  VAL   2          2HG2      VAL   2  -8.770  -0.674 -13.982
  168    H    ASN   3           H        ASN   3 -10.665  -0.840  -9.876
  169    HA   ASN   3           HA       ASN   3  -9.862   0.012  -7.356
  170    HB2  ASN   3           2HB      ASN   3 -10.728  -2.759  -8.228
  171    HB3  ASN   3           1HB      ASN   3 -10.589  -2.263  -6.541
  172   HD21  ASN   3          1HD2      ASN   3 -12.946  -2.506  -6.261
  173   HD22  ASN   3          2HD2      ASN   3 -14.015  -1.354  -6.901
  174    H    GLN   4           H        GLN   4  -8.405  -0.988  -5.746
  175    HA   GLN   4           HA       GLN   4  -6.185  -2.562  -6.955
  176    HB2  GLN   4           2HB      GLN   4  -5.306  -0.351  -6.966
  177    HB3  GLN   4           1HB      GLN   4  -5.987   0.010  -5.380
  178    HG2  GLN   4           2HG      GLN   4  -3.621  -0.391  -5.100
  179    HG3  GLN   4           1HG      GLN   4  -4.488  -1.764  -4.413
  180   HE21  GLN   4          1HE2      GLN   4  -1.704  -1.580  -5.694
  181   HE22  GLN   4          2HE2      GLN   4  -1.713  -2.787  -6.887
  182    H    HIS   5           H        HIS   5  -5.912  -4.376  -5.774
  183    HA   HIS   5           HA       HIS   5  -6.864  -4.412  -2.956
  184    HD2  HIS   5           HD2      HIS   5  -9.663  -6.797  -4.417
  185    HE1  HIS   5           HE1      HIS   5  -8.413  -5.552  -8.259
  186    HE2  HIS   5           HE2      HIS   5 -10.396  -6.338  -6.864
  187    HB2  HIS   5           2HB      HIS   5  -5.847  -6.857  -4.356
  188    HB3  HIS   5           1HB      HIS   5  -7.145  -6.705  -3.176
  189    H    LEU   6           H        LEU   6  -5.390  -4.319  -1.336
  190    HA   LEU   6           HA       LEU   6  -2.544  -4.948  -1.999
  191    HG   LEU   6           HG       LEU   6  -2.547  -1.832  -2.257
  192    HB2  LEU   6           2HB      LEU   6  -3.827  -2.713  -0.546
  193    HB3  LEU   6           1HB      LEU   6  -2.452  -3.404   0.287
  194   HD11  LEU   6          1HD1      LEU   6  -1.446  -1.596   0.308
  195   HD12  LEU   6          2HD1      LEU   6  -1.129  -0.550  -1.076
  196   HD13  LEU   6          3HD1      LEU   6  -0.069  -1.918  -0.746
  197   HD21  LEU   6          3HD2      LEU   6  -0.128  -2.875  -2.621
  198   HD22  LEU   6          1HD2      LEU   6  -1.544  -3.659  -3.319
  199   HD23  LEU   6          2HD2      LEU   6  -0.841  -4.274  -1.824
  200    H    CYS   7           H        CYS   7  -1.445  -6.349  -0.657
  201    HA   CYS   7           HA       CYS   7  -2.236  -7.003   2.011
  202    HB2  CYS   7           2HB      CYS   7  -4.207  -7.976   0.862
  203    HB3  CYS   7           1HB      CYS   7  -3.139  -8.976  -0.118
  204    H    GLY   8           H        GLY   8  -0.286  -7.647   2.804
  205    HA2  GLY   8           2HA      GLY   8   1.838  -8.636   2.921
  206    HA3  GLY   8           1HA      GLY   8   1.134  -9.929   1.954
  207    H    SER   9           H        SER   9   2.608 -10.313   0.374
  208    HA   SER   9           HA       SER   9   4.545  -8.716  -0.732
  209    HG   SER   9           HG       SER   9   4.524 -11.810  -1.066
  210    HB2  SER   9           2HB      SER   9   2.937 -10.294  -2.689
  211    HB3  SER   9           1HB      SER   9   4.682 -10.239  -2.458
  212    H    ASP  10           H        ASP  10   1.185  -8.884  -1.978
  213    HA   ASP  10           HA       ASP  10   1.470  -6.882  -3.960
  214    HB2  ASP  10           2HB      ASP  10  -0.976  -7.469  -2.267
  215    HB3  ASP  10           1HB      ASP  10  -0.959  -6.687  -3.844
  216    H    LEU  11           H        LEU  11   0.859  -6.673  -0.500
  217    HA   LEU  11           HA       LEU  11   0.118  -3.980  -0.239
  218    HG   LEU  11           HG       LEU  11   1.889  -3.424   2.645
  219    HB2  LEU  11           2HB      LEU  11   0.303  -5.709   1.603
  220    HB3  LEU  11           1HB      LEU  11   2.044  -5.453   1.584
  221   HD11  LEU  11          1HD1      LEU  11   0.757  -2.246   0.865
  222   HD12  LEU  11          2HD1      LEU  11  -0.081  -1.892   2.373
  223   HD13  LEU  11          3HD1      LEU  11  -0.765  -3.054   1.237
  224   HD21  LEU  11          3HD2      LEU  11  -0.904  -4.377   3.296
  225   HD22  LEU  11          1HD2      LEU  11   0.194  -3.464   4.330
  226   HD23  LEU  11          2HD2      LEU  11   0.541  -5.151   3.947
  227    H    VAL  12           H        VAL  12   3.457  -5.280  -0.128
  228    HA   VAL  12           HA       VAL  12   4.682  -2.689  -0.137
  229    HB   VAL  12           HB       VAL  12   6.736  -3.939  -0.830
  230   HG11  VAL  12          1HG1      VAL  12   5.338  -5.522   1.315
  231   HG12  VAL  12          2HG1      VAL  12   5.696  -3.814   1.573
  232   HG13  VAL  12          3HG1      VAL  12   7.008  -4.953   1.268
  233   HG21  VAL  12          3HG2      VAL  12   5.375  -5.599  -2.218
  234   HG22  VAL  12          1HG2      VAL  12   4.959  -6.382  -0.694
  235   HG23  VAL  12          2HG2      VAL  12   6.643  -6.300  -1.211
  236    H    GLU  13           H        GLU  13   3.557  -4.830  -2.698
  237    HA   GLU  13           HA       GLU  13   4.878  -3.698  -4.918
  238    HB2  GLU  13           2HB      GLU  13   3.262  -5.694  -4.883
  239    HB3  GLU  13           1HB      GLU  13   1.960  -4.505  -4.960
  240    HG2  GLU  13           2HG      GLU  13   3.729  -3.662  -6.933
  241    HG3  GLU  13           1HG      GLU  13   3.759  -5.420  -7.073
  242    H    ALA  14           H        ALA  14   1.725  -2.738  -3.520
  243    HA   ALA  14           HA       ALA  14   1.358  -0.438  -5.174
  244    HB1  ALA  14           3HB      ALA  14  -0.290   0.258  -3.513
  245    HB2  ALA  14           1HB      ALA  14   0.383  -0.877  -2.346
  246    HB3  ALA  14           2HB      ALA  14  -0.432  -1.478  -3.790
  247    H    LEU  15           H        LEU  15   2.657  -0.742  -1.880
  248    HA   LEU  15           HA       LEU  15   3.359   1.992  -1.516
  249    HG   LEU  15           HG       LEU  15   2.460  -0.424   0.597
  250    HB2  LEU  15           2HB      LEU  15   4.555  -0.541  -0.381
  251    HB3  LEU  15           1HB      LEU  15   5.013   1.069   0.153
  252   HD11  LEU  15          1HD1      LEU  15   2.775   0.947   2.775
  253   HD12  LEU  15          2HD1      LEU  15   4.374   1.310   2.130
  254   HD13  LEU  15          3HD1      LEU  15   3.911  -0.362   2.443
  255   HD21  LEU  15          3HD2      LEU  15   1.215   1.608   1.055
  256   HD22  LEU  15          1HD2      LEU  15   1.808   1.716  -0.600
  257   HD23  LEU  15          2HD2      LEU  15   2.616   2.612   0.686
  258    H    TYR  16           H        TYR  16   4.928  -0.651  -3.177
  259    HA   TYR  16           HA       TYR  16   7.547   0.492  -3.377
  260    HD1  TYR  16           HD2      TYR  16   9.605  -0.500  -4.890
  261    HD2  TYR  16           HD1      TYR  16   7.012  -3.226  -2.812
  262    HE1  TYR  16           HE2      TYR  16  11.573  -1.526  -3.781
  263    HE2  TYR  16           HE1      TYR  16   8.981  -4.252  -1.703
  264    HH   TYR  16           HH       TYR  16  11.286  -4.444  -1.863
  265    HB2  TYR  16           2HB      TYR  16   6.119  -1.805  -4.458
  266    HB3  TYR  16           1HB      TYR  16   7.182  -1.077  -5.660
  267    H    LEU  17           H        LEU  17   5.009   0.281  -5.918
  268    HA   LEU  17           HA       LEU  17   6.354   2.023  -7.703
  269    HG   LEU  17           HG       LEU  17   3.374   1.021  -6.160
  270    HB2  LEU  17           2HB      LEU  17   4.018   2.438  -8.663
  271    HB3  LEU  17           1HB      LEU  17   4.579   0.768  -8.625
  272   HD11  LEU  17          1HD1      LEU  17   1.317   2.196  -7.955
  273   HD12  LEU  17          2HD1      LEU  17   2.554   3.298  -7.349
  274   HD13  LEU  17          3HD1      LEU  17   1.544   2.397  -6.218
  275   HD21  LEU  17          3HD2      LEU  17   1.351  -0.005  -7.600
  276   HD22  LEU  17          1HD2      LEU  17   2.832  -0.913  -7.297
  277   HD23  LEU  17          2HD2      LEU  17   2.612  -0.071  -8.831
  278    H    VAL  18           H        VAL  18   3.961   2.836  -5.149
  279    HA   VAL  18           HA       VAL  18   3.651   5.543  -5.808
  280    HB   VAL  18           HB       VAL  18   3.401   5.939  -3.279
  281   HG11  VAL  18          1HG1      VAL  18   1.423   5.699  -4.500
  282   HG12  VAL  18          2HG1      VAL  18   1.306   4.385  -3.328
  283   HG13  VAL  18          3HG1      VAL  18   1.810   4.048  -4.985
  284   HG21  VAL  18          3HG2      VAL  18   4.208   3.093  -3.403
  285   HG22  VAL  18          1HG2      VAL  18   2.838   3.468  -2.368
  286   HG23  VAL  18          2HG2      VAL  18   4.389   4.252  -2.090
  287    H    CYS  19           H        CYS  19   5.838   4.765  -3.056
  288    HA   CYS  19           HA       CYS  19   7.327   7.161  -3.763
  289    HB2  CYS  19           2HB      CYS  19   7.575   5.195  -1.592
  290    HB3  CYS  19           1HB      CYS  19   9.103   5.837  -2.159
  291    H    GLY  20           H        GLY  20   7.618   3.768  -4.474
  292    HA2  GLY  20           2HA      GLY  20   8.816   2.997  -6.448
  293    HA3  GLY  20           1HA      GLY  20   9.886   4.395  -6.301
  294    H    GLU  21           H        GLU  21  11.536   2.511  -6.463
  295    HA   GLU  21           HA       GLU  21  11.851   0.668  -4.313
  296    HB2  GLU  21           2HB      GLU  21  13.847   0.091  -5.310
  297    HB3  GLU  21           1HB      GLU  21  13.133   0.974  -6.655
  298    HG2  GLU  21           2HG      GLU  21  15.283   1.914  -6.497
  299    HG3  GLU  21           1HG      GLU  21  14.295   3.060  -5.589
  300    H    ARG  22           H        ARG  22  12.210   4.055  -4.406
  301    HA   ARG  22           HA       ARG  22  14.259   4.683  -2.662
  302    HE   ARG  22           HE       ARG  22  14.558   9.575  -3.968
  303    HB2  ARG  22           2HB      ARG  22  11.783   5.909  -3.479
  304    HB3  ARG  22           1HB      ARG  22  12.056   6.207  -1.762
  305    HG2  ARG  22           2HG      ARG  22  14.210   7.169  -2.181
  306    HG3  ARG  22           1HG      ARG  22  14.194   6.629  -3.860
  307    HD2  ARG  22           2HD      ARG  22  12.596   8.227  -4.493
  308    HD3  ARG  22           1HD      ARG  22  12.037   8.461  -2.836
  309   HH11  ARG  22          1HH2      ARG  22  14.694   8.970  -1.015
  310   HH12  ARG  22          2HH2      ARG  22  14.172  10.470  -0.324
  311   HH21  ARG  22          1HH1      ARG  22  12.808  11.663  -3.281
  312   HH22  ARG  22          2HH1      ARG  22  13.110  11.997  -1.608
  313    H    GLY  23           H        GLY  23  11.314   2.982  -1.907
  314    HA2  GLY  23           2HA      GLY  23  11.856   1.548   0.233
  315    HA3  GLY  23           1HA      GLY  23  11.945   3.133   1.000
  316    H    PHE  24           H        PHE  24  10.103   1.478   2.044
  317    HA   PHE  24           HA       PHE  24   7.580   2.835   1.397
  318    HD1  PHE  24           HD2      PHE  24   9.559   0.600  -0.818
  319    HD2  PHE  24           HD1      PHE  24   7.384  -1.588   2.173
  320    HE1  PHE  24           HE2      PHE  24  11.151  -1.290  -1.043
  321    HE2  PHE  24           HE1      PHE  24   8.975  -3.478   1.949
  322    HZ   PHE  24           HZ       PHE  24  10.859  -3.330   0.341
  323    HB2  PHE  24           2HB      PHE  24   6.491   0.423   1.304
  324    HB3  PHE  24           1HB      PHE  24   7.157   1.156  -0.155
  325    H    PHE  25           H        PHE  25   5.828   1.990   2.985
  326    HA   PHE  25           HA       PHE  25   7.149   1.595   5.615
  327    HD1  PHE  25           HD2      PHE  25   6.682   2.249   7.788
  328    HD2  PHE  25           HD1      PHE  25   5.177   5.190   5.035
  329    HE1  PHE  25           HE2      PHE  25   7.765   4.044   9.111
  330    HE2  PHE  25           HE1      PHE  25   6.262   6.982   6.360
  331    HZ   PHE  25           HZ       PHE  25   7.554   6.410   8.398
  332    HB2  PHE  25           2HB      PHE  25   4.708   2.939   4.656
  333    HB3  PHE  25           1HB      PHE  25   4.465   2.000   6.126
  334    H    TYR  26           H        TYR  26   3.932   0.532   4.425
  335    HA   TYR  26           HA       TYR  26   2.840  -1.524   4.785
  336    HD1  TYR  26           HD1      TYR  26   2.273  -3.559   5.047
  337    HD2  TYR  26           HD2      TYR  26   6.267  -4.705   3.938
  338    HE1  TYR  26           HE1      TYR  26   1.771  -5.907   5.659
  339    HE2  TYR  26           HE2      TYR  26   5.760  -7.051   4.549
  340    HH   TYR  26           HH       TYR  26   4.280  -8.379   5.687
  341    HB2  TYR  26           2HB      TYR  26   4.300  -2.356   3.068
  342    HB3  TYR  26           1HB      TYR  26   5.680  -2.374   4.155
  343    H    THR  27           H        THR  27   3.325  -0.201   7.118
  344    HA   THR  27           HA       THR  27   4.785  -1.931   8.989
  345    HB   THR  27           HB       THR  27   4.918   0.395   9.468
  346    HG1  THR  27           HG1      THR  27   3.731   0.523  11.463
  347   HG21  THR  27          3HG2      THR  27   2.413   1.401   9.967
  348   HG22  THR  27          1HG2      THR  27   2.105   0.335   8.596
  349   HG23  THR  27          2HG2      THR  27   3.299   1.626   8.459
  350    H    LYS  28           H        LYS  28   3.746  -2.929  10.854
  351    HA   LYS  28           HA       LYS  28   0.917  -3.723  10.288
  352    HB2  LYS  28           2HB      LYS  28   2.858  -5.264  12.019
  353    HB3  LYS  28           1HB      LYS  28   1.379  -5.844  11.252
  354    HG2  LYS  28           2HG      LYS  28   2.660  -6.564   9.545
  355    HG3  LYS  28           1HG      LYS  28   2.925  -4.868   9.136
  356    HD2  LYS  28           2HD      LYS  28   4.802  -4.928  10.909
  357    HD3  LYS  28           1HD      LYS  28   4.665  -6.685  10.805
  358    HE2  LYS  28           2HE      LYS  28   5.807  -6.719   8.865
  359    HE3  LYS  28           1HE      LYS  28   4.724  -5.523   8.155
  360    HZ1  LYS  28           3HZ      LYS  28   6.095  -3.945   9.734
  361    HZ2  LYS  28           1HZ      LYS  28   6.637  -4.332   8.174
  362    HZ3  LYS  28           2HZ      LYS  28   7.278  -5.144   9.523
  363    HA   PRO  29           HA       PRO  29  -0.224  -1.976  14.136
  364    HB2  PRO  29           2HB      PRO  29  -2.375  -3.570  14.756
  365    HB3  PRO  29           1HB      PRO  29  -2.415  -2.304  13.517
  366    HG2  PRO  29           2HG      PRO  29  -2.282  -5.264  13.173
  367    HG3  PRO  29           1HG      PRO  29  -2.944  -4.036  12.081
  368    HD2  PRO  29           2HD      PRO  29  -0.435  -5.303  11.809
  369    HD3  PRO  29           1HD      PRO  29  -0.962  -3.845  10.947
  370    H    THR  30           H        THR  30   0.785  -5.260  13.924
  371    HA   THR  30           HA       THR  30   0.438  -6.203  16.560
  372    HB   THR  30           HB       THR  30   1.403  -7.469  14.562
  373    HG1  THR  30           HG1      THR  30   3.009  -7.666  16.873
  374   HG21  THR  30          3HG2      THR  30   3.645  -7.221  13.968
  375   HG22  THR  30          1HG2      THR  30   4.073  -6.474  15.508
  376   HG23  THR  30          2HG2      THR  30   3.178  -5.553  14.300