*HEADER    HORMONE/GROWTH FACTOR                   25-APR-02   1LKQ              
*TITLE     NMR STRUCTURE OF HUMAN INSULIN MUTANT ILE-A2-GLY, VAL-A3-             
*TITLE    2 GLY, HIS-B10-ASP, PRO-B28-LYS, LYS-B29-PRO, 20 STRUCTURES            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: INSULIN;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES;                                                       
*COMPND   6 OTHER_DETAILS: INSULIN A CHAIN (RESIDUES 90-110);                    
*COMPND   7 MOL_ID: 2;                                                           
*COMPND   8 MOLECULE: INSULIN;                                                   
*COMPND   9 CHAIN: B;                                                            
*COMPND  10 ENGINEERED: YES;                                                     
*COMPND  11 MUTATION: YES;                                                       
*COMPND  12 OTHER_DETAILS: INSULIN B CHAIN (RESIDUES 25-54)                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO SAPIENS           
*SOURCE   5 (HUMAN).;                                                            
*SOURCE   6 MOL_ID: 2;                                                           
*SOURCE   7 SYNTHETIC: YES;                                                      
*SOURCE   8 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   9 SEQUENCE OF THE PEPTIDE IS NATURALLY FOUND IN HOMO SAPIENS           
*SOURCE  10 (HUMAN).                                                             
*KEYWDS    HORMONE, HUMAN INSULIN, MUTANT                                        
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.A.WEISS, Q.X.HUA, Y.C.CHU, W.JIA, N.F.PHILIPS, R.Y.WANG,            
*AUTHOR   2 P.G.KATSOYANNIS                                                      
*REVDAT   1   22-MAY-02 1LKQ    0                                                

!BIOSYM restraint 1
!
#remote_prochiral_center
1:LEU_32:HD1*   1:LEU_32:HD2*   1:LEU_32:CD1    1:LEU_32:CD2    1:LEU_32:CG    
1:LEU_27:HD1*   1:LEU_27:HD2*   1:LEU_27:CD1    1:LEU_27:CD2    1:LEU_27:CG    
1:LEU_16:HD1*   1:LEU_16:HD2*   1:LEU_16:CD1    1:LEU_16:CD2    1:LEU_16:CG    
1:VAL_39:HG1*   1:VAL_39:HG2*   1:VAL_39:CG1    1:VAL_39:CG2    1:VAL_39:CB    
1:LEU_36:HD2*   1:LEU_36:HD1*   1:LEU_36:CD2    1:LEU_36:CD1    1:LEU_36:CG    
1:VAL_23:HG1*   1:VAL_23:HG2*   1:VAL_23:CG1    1:VAL_23:CG2    1:VAL_23:CB    
1:LEU_13:HD1*   1:LEU_13:HD2*   1:LEU_13:CD1    1:LEU_13:CD2    1:LEU_13:CG    
1:VAL_33:HG1*   1:VAL_33:HG2*   1:VAL_33:CG1    1:VAL_33:CG2    1:VAL_33:CB    
1:LEU_38:HD2*   1:LEU_38:HD1*   1:LEU_38:CD2    1:LEU_38:CD1    1:LEU_38:CG    
!
#chiral
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_10:CB        R
1:THR_8:CB         R
1:THR_48:CB        R
!
#distance
1:GLYN_1:CA        1:GLY_3:CA          4.700  7.200  1.00  1.00 1000.000
1:GLY_2:CA         1:GLU-_4:CA         4.700  7.200  1.00  1.00 1000.000
1:GLY_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: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: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
!
#NOE_distance
1:GLY_2:HN         1:GLYN_1:HA*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:GLY_3:HA*        1:GLY_2:HA*        -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLY_3:HA*        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:GLN_5:HB*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_4:HN        1:CYS_7:HB*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLN_5:HA         1:CYS_6:HA         -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:GLN_5:HG*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:LEU_32:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HA         1:LEU_32:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB*        1:LEU_27:HB*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB*        1:LEU_27:HD1*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB*        1:LEU_27:HD2*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HB*        1:LEU_32:HD1*      -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:CYS_6:HB*        1:LEU_32:HD2*      -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:GLN_5:HA         -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:GLN_5:HB*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:GLN_5:HG*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:CYS_7:HN         -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:LEU_32:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_6:HN         1:LEU_32:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HA         1:HIS_26:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HA         1:CYS_28:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HB*        1:THR_8:HG2*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:GLU-_4:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:GLU-_4:HG*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:GLN_5:HA         -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:CYS_6:HA         -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:CYS_6:HB*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:THR_8:HG2*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:SER_9:HB*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_7:HN         1:CYS_28:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:THR_8:HA         1:SER_9:HA         -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:THR_8:HN         1:CYS_7:HB*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:SER_9:HB*        1:THR_8:HG2*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:SER_9:HN         1:CYS_6:HA         -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:SER_9:HN         1:THR_8:HA         -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:SER_9:HN         1:THR_8:HB         -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:SER_9:HN         1:THR_8:HG2*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:SER_9:HN         1:ILE_10:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:ILE_10:HG2*      1:CYS_11:HA        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ILE_10:HN        1:SER_9:HA         -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:ILE_10:HN        1:SER_9:HB*        -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_11:HA        1:GLN_15:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_11:HA        1:GLN_15:HG*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB*       1:GLN_5:HG*        -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB*       1:LEU_16:HD1*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB*       1:LEU_16:HD2*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_11:HB*       1:LEU_16:HG        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_11:HN        1:ILE_10:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_11:HN        1:ILE_10:HG2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:SER_12:HA        1:LEU_13:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:CYS_11:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:CYS_11:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:LEU_13:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:GLN_15:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:GLN_15:HG*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:GLN_15:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:SER_12:HN        1:LEU_16:HG        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_16:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_16:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_13:HA        1:LEU_16:HG        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:SER_12:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:SER_12:HB1       -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:SER_12:HB2       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_13:HN        1:TYR_14:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HA        1:LEU_13:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HA        1:GLU-_17:HB*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_14:HA        1:GLU-_17:HG*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:LEU_13:HA        -1.000  6.300  4.300 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:GLU-_17:HG*      -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:GLN_15:HG*       -1.000  8.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HD*       1:GLU-_17:HB*      -1.000  8.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:SER_12:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:SER_12:HB1       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:SER_12:HB2       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:LEU_13:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:LEU_13:HG        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:GLN_15:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:GLN_15:HG*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:GLN_15:HN        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_14:HN        1:LEU_16:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:CYS_11:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:TYR_14:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:TYR_14:HB1       -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:GLN_15:HN        1:TYR_14:HB2       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:GLN_15:HA        1:ASN_18:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_16:HB*       1:LEU_32:HD2*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:CYS_11:HB*       -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_13:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:LEU_13:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLN_15:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLN_15:HB*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLN_15:HG*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_16:HN        1:GLU-_17:HN       -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HA       1:VAL_39:HG1*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_17:HB*      1:VAL_39:HG1*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HB*      1:VAL_39:HG2*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HG*      1:VAL_39:HG1*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HG*      1:VAL_39:HG2*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:LEU_13:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:TYR_14:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:TYR_14:HB1       -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:TYR_14:HB2       -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:GLN_15:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:LEU_16:HB*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:LEU_16:HG        -1.000  4.300  4.300 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:ASN_18:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:ASN_18:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:ASN_18:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:VAL_39:HG1*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_17:HN       1:VAL_39:HG2*      -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:ASN_18:HA        1:TYR_19:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:GLN_15:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:GLN_15:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:GLN_15:HG*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:GLU-_17:HA       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:ASN_18:HN        1:TYR_19:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HA        1:LEU_36:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_19:HB*       1:LEU_36:HD1*      -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_19:HB*       1:LEU_36:HD2*      -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_19:HB*       1:PHE_45:HB*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_16:HA        -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_16:HD2*      -1.000  7.300  4.300 10.00 10.00 1000.000  0.00
1:TYR_19:HD*       1:LEU_36:HD1*      -1.000  5.700  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:HD*       1:PHE_45:HA        -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_19:HE*       1:LEU_16:HA        -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:GLU-_17:HA       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:ASN_18:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:ASN_18:HB*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:CYS_20:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:TYR_19:HN        1:LEU_36:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:GLU-_17:HA       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:ASN_18:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:TYR_19:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:TYR_19:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:ASNC_21:HN       -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_20:HN        1:LEU_36:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HB1       -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:CYS_20:HB2       -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:ARG+_43:HB*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:ASNC_21:HN       1:PHE_45:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:PHEN_22:HA       1:VAL_23:HG1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:LEU_13:HD1*      -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:LEU_13:HD2*      -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:PHEN_22:HD*      1:VAL_23:HA        -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:PHEN_22:HE*      1:LEU_13:HD1*      -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:PHEN_22:HE*      1:LEU_13:HD2*      -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:PHEN_22:HZ       1:LEU_13:HD1*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:PHEN_22:HZ       1:LEU_13:HD2*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:VAL_23:HN        1:PHEN_22:HA       -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_23:HN        1:PHEN_22:HB*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ASN_24:HA        1:VAL_23:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:ASN_24:HA        1:VAL_23:HG1*      -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:ASN_24:HB*       1:ILE_10:HG2*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:ASN_24:HD2*      1:VAL_23:HG2*      -1.000  7.000  5.000 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:HN        1:VAL_23:HB        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:ASN_24:HN        1:VAL_23:HG1*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:ASN_24:HN        1:VAL_23:HG2*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:GLN_25:HA        1:ILE_10:HG2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:ILE_10:HD1*      -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:ILE_10:HG2*      -1.000  5.300  4.300 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:ASN_24:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:GLN_25:HN        1:HIS_26:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:HIS_26:HB*       1:LEU_27:HB*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:HIS_26:HD2       1:ILE_10:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:HIS_26:HD2       1:ILE_10:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:HIS_26:HD2       1:ILE_10:HG2*      -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:ILE_10:HG2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:GLN_25:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:GLN_25:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:GLN_25:HG*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:LEU_27:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:HIS_26:HN        1:LEU_27:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:ASP-_31:HB*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:CYS_7:HA         -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:CYS_7:HB*        -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:HIS_26:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:HIS_26:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_27:HA        1:LEU_32:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:LEU_32:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_27:HN        1:LEU_32:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:CYS_7:HB*        -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:LEU_32:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:LEU_32:HD1*      -1.000  6.000  5.000 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:LEU_27:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_27:HG        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HA        1:GLY_29:HA*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:GLY_29:HA*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:ASP-_31:HB*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_32:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_28:HN        1:LEU_32:HD2*      -1.000  6.000  5.000 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:HA       1:LEU_27:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HA       1:LEU_27:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HB1      -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:ASP-_31:HA       1:GLU-_34:HB2      -1.000  4.300  4.300 10.00 10.00 1000.000  0.00
1:ASP-_31:HB*      1:LEU_27:HD1*      -1.000  6.300  4.300 10.00 10.00 1000.000  0.00
1:ASP-_31:HB*      1:LEU_27:HD2*      -1.000  6.300  4.300 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:SER_30:HB1       -1.000  4.300  4.300 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:SER_30:HB2       -1.000  4.300  4.300 10.00 10.00 1000.000  0.00
1:ASP-_31:HN       1:LEU_32:HN        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_32:HA        1:ALA_35:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_32:HG        1:LEU_27:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:ASP-_31:HA       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_32:HN        1:ASP-_31:HB*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_33:HA        1:LEU_36:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:VAL_33:HA        1:LEU_36:HG        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:LEU_32:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:LEU_32:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_33:HN        1:GLU-_34:HN       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:ALA_35:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HA       1:TYR_37:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:ASP-_31:HA       -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:LEU_32:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:VAL_33:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:VAL_33:HB        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:VAL_33:HG1*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:VAL_33:HG2*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:ALA_35:HB*       -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:ALA_35:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:GLU-_34:HN       1:LEU_36:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_38:HD2*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:LEU_27:HB*       -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:LEU_32:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:LEU_36:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:LEU_36:HG        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:ALA_35:HN        1:LEU_36:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:ALA_35:HA        1:LEU_16:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_36:HA        1:VAL_39:HB        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:VAL_33:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:GLU-_34:HA       -1.000  4.300  4.300 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:ALA_35:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:ALA_35:HB*       -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:TYR_37:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:TYR_37:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:TYR_37:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:LEU_38:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_36:HN        1:VAL_39:HG2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_37:HB*       1:LEU_36:HB*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_37:HE*       1:LEU_38:HD1*      -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:VAL_33:HG2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_36:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_36:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_36:HG        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_37:HN        1:LEU_38:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:LEU_36:HB*       -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:TYR_37:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:VAL_39:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:VAL_39:HG2*      -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:VAL_39:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:LEU_38:HN        1:CYS_40:HN        -1.000  4.300  4.300 10.00 10.00 1000.000  0.00
1:VAL_39:HB        1:LEU_36:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:TYR_37:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:TYR_37:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HD1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:LEU_38:HG        -1.000  4.300  4.300 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:CYS_40:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:VAL_39:HN        1:CYS_40:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:VAL_39:HG1*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:VAL_39:HG2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HA        1:ARG+_43:HD*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:LEU_36:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:LEU_36:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:TYR_37:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:LEU_38:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HB        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HG1*      -1.000  3.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:VAL_39:HG2*      -1.000  5.300  4.300 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:GLY_41:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:PHE_45:HE*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:CYS_40:HN        1:PHE_45:HD*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:GLY_41:HN        1:TYR_37:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLY_41:HN        1:LEU_38:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:GLY_41:HN        1:CYS_40:HB*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:GLY_41:HA*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:GLU-_42:HN       1:ARG+_43:HN       -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HA       1:GLU-_42:HA       -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:GLY_41:HA*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:GLU-_42:HG*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:GLY_44:HA*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:ARG+_43:HN       1:GLY_44:HN        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:GLY_44:HA*       1:GLU-_42:HA       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLY_44:HN        1:CYS_40:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:GLY_44:HN        1:ARG+_43:HD*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:GLY_44:HN        1:PHE_45:HA        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:VAL_33:HG2*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:LEU_36:HD1*      -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:LEU_36:HD2*      -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:PHE_45:HD*       1:CYS_40:HB*       -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:LEU_36:HD1*      -1.000  7.300  4.300 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:LEU_36:HD2*      -1.000  7.300  4.300 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:TYR_37:HA        -1.000  4.700  2.700 10.00 10.00 1000.000  0.00
1:PHE_45:HE*       1:TYR_37:HB*       -1.000  5.700  2.700 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_46:HD*       1:TYR_19:HB*       -1.000  8.000  5.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:LEU_36:HD2*      -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:PHE_45:HA        -1.000  2.700  2.700 10.00 10.00 1000.000  0.00
1:PHE_46:HN        1:TYR_47:HN        -1.000  5.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB*       1:LEU_36:HB*       -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_47:HB*       1:LEU_36:HD1*      -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LEU_32:HB*       -1.000  6.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:THR_48:HG2*      -1.000  8.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LYS+_49:HA       -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:TYR_47:HE*       1:LYS+_49:HG*      -1.000  8.000  5.000 10.00 10.00 1000.000  0.00
1:TYR_47:HN        1:PHE_46:HA        -1.000  3.400  3.400 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:LYS+_49:HN       1:THR_48:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:LYS+_49:HN       1:THR_48:HB        -1.000  4.300  4.300 10.00 10.00 1000.000  0.00
1:LYS+_49:HN       1:THR_48:HG2*      -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:LYS+_49:HN       1:PRO_50:HD*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD*       1:LYS+_49:HA       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:PRO_50:HD*       1:LYS+_49:HB*      -1.000  7.000  5.000 10.00 10.00 1000.000  0.00
1:PRO_50:HD*       1:LYS+_49:HG*      -1.000  5.400  3.400 10.00 10.00 1000.000  0.00
1:THRC_51:HN       1:PRO_50:HA        -1.000  3.400  3.400 10.00 10.00 1000.000  0.00
1:THRC_51:HN       1:PRO_50:HB*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
1:THRC_51:HN       1:PRO_50:HD*       -1.000  6.000  5.000 10.00 10.00 1000.000  0.00
1:THRC_51:HN       1:PRO_50:HG*       -1.000  4.400  3.400 10.00 10.00 1000.000  0.00
!
#mixing_times
-9.990000E+02 
!
#NMR_dihedral
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: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:VAL_39:C         1:CYS_40:N         1:CYS_40:CA        1:CYS_40: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: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: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:PHE_45:N         1:PHE_45:CA        1:PHE_45:CB        1:PHE_45:CG        140.000 -140.000 30.00 30.00 1000.000
1:GLU-_34:N        1:GLU-_34:CA       1:GLU-_34:CB       1:GLU-_34:CG       140.000 -140.000 30.00 30.00 1000.000
1:GLU-_42:N        1:GLU-_42:CA       1:GLU-_42:CB       1:GLU-_42:CG       140.000 -140.000 30.00 30.00 1000.000
1:SER_9:N          1:SER_9:CA         1:SER_9:CB         1:SER_9:OG         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        140.000 -140.000 30.00 30.00 1000.000


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1  -5.527   7.787  -7.594
    2   2H    GLY   1          2H        GLY   1  -5.524   7.261  -5.978
    3   3H    GLY   1          3H        GLY   1  -6.756   8.288  -6.536
    4   1HA   GLY   1          1HA       GLY   1  -7.642   6.519  -7.845
    5   2HA   GLY   1          2HA       GLY   1  -6.218   5.471  -7.568
    6    H    GLY   2           H        GLY   2  -7.422   6.882  -4.777
    7   1HA   GLY   2          1HA       GLY   2  -9.981   6.825  -4.171
    8   2HA   GLY   2          2HA       GLY   2  -9.821   5.127  -4.626
    9    H    GLY   3           H        GLY   3  -9.854   3.990  -2.736
   10   1HA   GLY   3          1HA       GLY   3  -8.660   5.081  -0.295
   11   2HA   GLY   3          2HA       GLY   3  -9.444   3.508  -0.451
   12    H    GLU   4           H        GLU   4  -6.422   5.257  -1.048
   13    HA   GLU   4           HA       GLU   4  -5.038   2.663  -1.518
   14   1HB   GLU   4          1HB       GLU   4  -3.994   5.502  -1.759
   15   2HB   GLU   4          2HB       GLU   4  -3.136   4.037  -2.243
   16   1HG   GLU   4          1HG       GLU   4  -5.850   4.748  -3.368
   17   2HG   GLU   4          2HG       GLU   4  -4.352   5.316  -4.107
   18    H    GLN   5           H        GLN   5  -2.871   2.431  -0.361
   19    HA   GLN   5           HA       GLN   5  -2.781   3.850   2.233
   20   1HB   GLN   5          1HB       GLN   5  -3.057   2.004   3.586
   21   2HB   GLN   5          2HB       GLN   5  -4.084   1.525   2.239
   22   1HG   GLN   5          1HG       GLN   5  -2.819  -0.382   2.346
   23   2HG   GLN   5          2HG       GLN   5  -1.714   0.567   1.353
   24   1HE2  GLN   5          1HE2      GLN   5  -1.475  -1.501   3.795
   25   2HE2  GLN   5          2HE2      GLN   5  -0.266  -0.776   4.741
   26    H    CYS   6           H        CYS   6  -1.186   1.822  -0.143
   27    HA   CYS   6           HA       CYS   6   1.428   2.506   1.136
   28   1HB   CYS   6          1HB       CYS   6   0.590   0.165  -0.585
   29   2HB   CYS   6          2HB       CYS   6   2.285   0.566  -0.303
   30    H    CYS   7           H        CYS   7  -0.211   4.153  -0.767
   31    HA   CYS   7           HA       CYS   7   1.569   4.143  -3.156
   32   1HB   CYS   7          1HB       CYS   7  -0.857   4.161  -3.594
   33   2HB   CYS   7          2HB       CYS   7  -1.026   5.630  -2.632
   34    H    THR   8           H        THR   8  -0.087   6.860  -1.558
   35    HA   THR   8           HA       THR   8   2.115   8.649  -1.975
   36    HB   THR   8           HB       THR   8   0.876  10.092  -0.290
   37    HG1  THR   8           HG1      THR   8  -0.091   8.546   0.954
   38   1HG2  THR   8          1HG2      THR   8  -0.063  10.764  -2.219
   39   2HG2  THR   8          2HG2      THR   8  -1.363   9.612  -1.911
   40   3HG2  THR   8          3HG2      THR   8   0.024   9.135  -2.891
   41    H    SER   9           H        SER   9   1.365   6.353   0.536
   42    HA   SER   9           HA       SER   9   3.519   7.469   2.262
   43   1HB   SER   9          1HB       SER   9   1.313   6.895   3.302
   44   2HB   SER   9          2HB       SER   9   1.570   5.216   2.838
   45    HG   SER   9           HG       SER   9   3.467   6.682   4.340
   46    H    ILE  10           H        ILE  10   4.262   5.014   3.505
   47    HA   ILE  10           HA       ILE  10   5.184   3.265   1.305
   48    HB   ILE  10           HB       ILE  10   7.362   3.996   3.164
   49   1HG1  ILE  10          1HG1      ILE  10   6.316   5.975   1.109
   50   2HG1  ILE  10          2HG1      ILE  10   6.383   6.224   2.855
   51   1HG2  ILE  10          1HG2      ILE  10   8.560   3.160   1.446
   52   2HG2  ILE  10          2HG2      ILE  10   7.832   4.297   0.311
   53   3HG2  ILE  10          3HG2      ILE  10   7.030   2.767   0.664
   54   1HD1  ILE  10          1HD1      ILE  10   8.492   6.977   2.667
   55   2HD1  ILE  10          2HD1      ILE  10   8.436   6.712   0.925
   56   3HD1  ILE  10          3HD1      ILE  10   8.982   5.421   1.995
   57    H    CYS  11           H        CYS  11   4.642   1.279   2.031
   58    HA   CYS  11           HA       CYS  11   4.844   0.718   4.959
   59   1HB   CYS  11          1HB       CYS  11   3.364  -1.252   4.380
   60   2HB   CYS  11          2HB       CYS  11   2.619   0.323   4.126
   61    H    SER  12           H        SER  12   4.969  -2.072   4.821
   62    HA   SER  12           HA       SER  12   7.437  -2.594   3.242
   63   1HB   SER  12          1HB       SER  12   8.321  -2.217   5.419
   64   2HB   SER  12          2HB       SER  12   7.008  -3.098   6.187
   65    HG   SER  12           HG       SER  12   8.700  -4.493   6.109
   66    H    LEU  13           H        LEU  13   7.906  -5.066   3.454
   67    HA   LEU  13           HA       LEU  13   5.768  -6.442   2.228
   68   1HB   LEU  13          1HB       LEU  13   7.074  -8.492   2.600
   69   2HB   LEU  13          2HB       LEU  13   8.142  -7.179   2.106
   70    HG   LEU  13           HG       LEU  13   7.696  -7.400   5.021
   71   1HD1  LEU  13          1HD1      LEU  13   9.306  -9.479   3.505
   72   2HD1  LEU  13          2HD1      LEU  13   7.814  -9.785   4.394
   73   3HD1  LEU  13          3HD1      LEU  13   9.270  -9.288   5.257
   74   1HD2  LEU  13          1HD2      LEU  13  10.432  -7.474   4.078
   75   2HD2  LEU  13          2HD2      LEU  13   9.608  -6.201   4.978
   76   3HD2  LEU  13          3HD2      LEU  13   9.527  -6.230   3.216
   77    H    TYR  14           H        TYR  14   6.358  -5.753   5.523
   78    HA   TYR  14           HA       TYR  14   4.863  -7.894   6.719
   79   1HB   TYR  14          1HB       TYR  14   5.766  -5.174   7.554
   80   2HB   TYR  14          2HB       TYR  14   4.587  -6.020   8.551
   81    HD1  TYR  14           HD1      TYR  14   8.026  -6.096   7.198
   82    HD2  TYR  14           HD2      TYR  14   5.180  -8.042   9.763
   83    HE1  TYR  14           HE1      TYR  14   9.845  -7.478   8.168
   84    HE2  TYR  14           HE2      TYR  14   6.999  -9.424  10.734
   85    HH   TYR  14           HH       TYR  14  10.290  -9.300   9.442
   86    H    GLN  15           H        GLN  15   3.978  -4.494   6.281
   87    HA   GLN  15           HA       GLN  15   1.238  -4.727   6.859
   88   1HB   GLN  15          1HB       GLN  15   2.837  -2.864   5.142
   89   2HB   GLN  15          2HB       GLN  15   1.077  -2.789   5.063
   90   1HG   GLN  15          1HG       GLN  15   0.893  -2.293   7.389
   91   2HG   GLN  15          2HG       GLN  15   2.577  -2.723   7.687
   92   1HE2  GLN  15          1HE2      GLN  15   4.025  -0.992   7.702
   93   2HE2  GLN  15          2HE2      GLN  15   3.726   0.529   7.009
   94    H    LEU  16           H        LEU  16   3.020  -5.550   3.982
   95    HA   LEU  16           HA       LEU  16   0.674  -5.980   2.315
   96   1HB   LEU  16          1HB       LEU  16   3.538  -6.957   2.049
   97   2HB   LEU  16          2HB       LEU  16   2.297  -7.141   0.807
   98    HG   LEU  16           HG       LEU  16   3.182  -4.484   1.965
   99   1HD1  LEU  16          1HD1      LEU  16   3.890  -5.865  -0.643
  100   2HD1  LEU  16          2HD1      LEU  16   4.999  -5.444   0.661
  101   3HD1  LEU  16          3HD1      LEU  16   4.236  -4.172  -0.291
  102   1HD2  LEU  16          1HD2      LEU  16   1.988  -3.911  -0.381
  103   2HD2  LEU  16          2HD2      LEU  16   1.089  -4.009   1.133
  104   3HD2  LEU  16          3HD2      LEU  16   1.103  -5.381   0.025
  105    H    GLU  17           H        GLU  17   2.511  -7.803   4.652
  106    HA   GLU  17           HA       GLU  17   1.396 -10.391   3.871
  107   1HB   GLU  17          1HB       GLU  17   3.239  -9.366   5.948
  108   2HB   GLU  17          2HB       GLU  17   2.271 -10.758   6.430
  109   1HG   GLU  17          1HG       GLU  17   3.131 -11.345   3.824
  110   2HG   GLU  17          2HG       GLU  17   4.540 -10.648   4.624
  111    H    ASN  18           H        ASN  18   0.352  -7.693   5.698
  112    HA   ASN  18           HA       ASN  18  -1.472  -9.173   7.432
  113   1HB   ASN  18          1HB       ASN  18  -0.980  -6.272   6.822
  114   2HB   ASN  18          2HB       ASN  18  -2.464  -6.744   7.650
  115   1HD2  ASN  18          1HD2      ASN  18  -1.851  -5.879   9.730
  116   2HD2  ASN  18          2HD2      ASN  18  -0.582  -6.537  10.645
  117    H    TYR  19           H        TYR  19  -1.456  -8.498   4.156
  118    HA   TYR  19           HA       TYR  19  -4.406  -8.195   3.961
  119   1HB   TYR  19          1HB       TYR  19  -2.111  -7.878   2.050
  120   2HB   TYR  19          2HB       TYR  19  -3.725  -8.194   1.413
  121    HD1  TYR  19           HD1      TYR  19  -1.492  -5.685   2.628
  122    HD2  TYR  19           HD2      TYR  19  -5.657  -6.695   2.324
  123    HE1  TYR  19           HE1      TYR  19  -2.094  -3.300   2.954
  124    HE2  TYR  19           HE2      TYR  19  -6.260  -4.311   2.651
  125    HH   TYR  19           HH       TYR  19  -5.356  -2.152   2.505
  126    H    CYS  20           H        CYS  20  -1.991 -10.603   3.880
  127    HA   CYS  20           HA       CYS  20  -3.546 -12.413   2.152
  128   1HB   CYS  20          1HB       CYS  20  -1.155 -13.252   3.762
  129   2HB   CYS  20          2HB       CYS  20  -1.692 -13.834   2.188
  130    H    ASN  21           H        ASN  21  -3.362 -14.818   3.248
  131    HA   ASN  21           HA       ASN  21  -4.252 -16.259   4.880
  132   1HB   ASN  21          1HB       ASN  21  -4.142 -13.898   6.772
  133   2HB   ASN  21          2HB       ASN  21  -4.119 -15.614   7.182
  134   1HD2  ASN  21          1HD2      ASN  21  -2.152 -12.931   6.008
  135   2HD2  ASN  21          2HD2      ASN  21  -0.669 -13.757   6.060
  136   1H    PHE   1          1H        PHE   1  11.747  -3.247   2.996
  137   2H    PHE   1          2H        PHE   1  11.255  -4.748   2.372
  138   3H    PHE   1          3H        PHE   1  10.536  -3.316   1.810
  139    HA   PHE   1           HA       PHE   1  13.304  -4.263   1.337
  140   1HB   PHE   1          1HB       PHE   1  11.201  -3.364  -0.637
  141   2HB   PHE   1          2HB       PHE   1  12.670  -4.285  -0.958
  142    HD1  PHE   1           HD1      PHE   1   9.220  -4.581  -0.650
  143    HD2  PHE   1           HD2      PHE   1  12.848  -6.503   0.623
  144    HE1  PHE   1           HE1      PHE   1   7.974  -6.697  -0.294
  145    HE2  PHE   1           HE2      PHE   1  11.602  -8.618   0.979
  146    HZ   PHE   1           HZ       PHE   1   9.165  -8.716   0.520
  147    H    VAL   2           H        VAL   2  13.415  -2.474  -0.951
  148    HA   VAL   2           HA       VAL   2  14.384  -0.094   0.440
  149    HB   VAL   2           HB       VAL   2  15.346  -1.314  -1.670
  150   1HG1  VAL   2          1HG1      VAL   2  12.945  -0.667  -2.744
  151   2HG1  VAL   2          2HG1      VAL   2  14.404  -0.929  -3.699
  152   3HG1  VAL   2          3HG1      VAL   2  13.914   0.711  -3.270
  153   1HG2  VAL   2          1HG2      VAL   2  16.745   0.443  -1.639
  154   2HG2  VAL   2          2HG2      VAL   2  15.587   1.286  -0.610
  155   3HG2  VAL   2          3HG2      VAL   2  15.515   1.480  -2.362
  156    H    ASN   3           H        ASN   3  13.754   1.843  -1.507
  157    HA   ASN   3           HA       ASN   3  11.193   2.734  -0.562
  158   1HB   ASN   3          1HB       ASN   3  13.314   3.734  -2.319
  159   2HB   ASN   3          2HB       ASN   3  11.701   4.208  -2.852
  160   1HD2  ASN   3          1HD2      ASN   3  12.209   6.461  -2.176
  161   2HD2  ASN   3          2HD2      ASN   3  12.163   6.884  -0.532
  162    H    GLN   4           H        GLN   4   9.187   2.594  -1.509
  163    HA   GLN   4           HA       GLN   4   8.859   1.741  -4.284
  164   1HB   GLN   4          1HB       GLN   4   9.021  -0.258  -2.288
  165   2HB   GLN   4          2HB       GLN   4   7.313  -0.116  -2.703
  166   1HG   GLN   4          1HG       GLN   4   7.689  -1.251  -4.609
  167   2HG   GLN   4          2HG       GLN   4   8.802   0.013  -5.132
  168   1HE2  GLN   4          1HE2      GLN   4   8.676  -3.273  -4.530
  169   2HE2  GLN   4          2HE2      GLN   4  10.316  -3.550  -4.189
  170    H    HIS   5           H        HIS   5   6.783   2.277  -5.025
  171    HA   HIS   5           HA       HIS   5   4.804   3.180  -2.992
  172   1HB   HIS   5          1HB       HIS   5   4.875   4.888  -5.381
  173   2HB   HIS   5          2HB       HIS   5   4.764   5.341  -3.683
  174    HD2  HIS   5           HD2      HIS   5   7.264   5.777  -2.395
  175    HE1  HIS   5           HE1      HIS   5   9.555   5.541  -5.941
  176    HE2  HIS   5           HE2      HIS   5   9.601   6.172  -3.469
  177    H    LEU   6           H        LEU   6   3.285   1.616  -3.433
  178    HA   LEU   6           HA       LEU   6   2.553   1.110  -6.270
  179   1HB   LEU   6          1HB       LEU   6   1.973  -0.323  -3.670
  180   2HB   LEU   6          2HB       LEU   6   1.117  -0.715  -5.159
  181    HG   LEU   6           HG       LEU   6   2.993  -1.628  -6.165
  182   1HD1  LEU   6          1HD1      LEU   6   5.312  -1.022  -5.617
  183   2HD1  LEU   6          2HD1      LEU   6   4.745   0.009  -4.304
  184   3HD1  LEU   6          3HD1      LEU   6   4.373   0.425  -5.977
  185   1HD2  LEU   6          1HD2      LEU   6   4.252  -2.122  -3.555
  186   2HD2  LEU   6          2HD2      LEU   6   3.571  -3.267  -4.711
  187   3HD2  LEU   6          3HD2      LEU   6   2.515  -2.429  -3.574
  188    H    CYS   7           H        CYS   7   0.330   1.368  -6.952
  189    HA   CYS   7           HA       CYS   7  -1.483   2.732  -5.040
  190   1HB   CYS   7          1HB       CYS   7  -0.990   3.927  -7.769
  191   2HB   CYS   7          2HB       CYS   7  -1.807   4.656  -6.386
  192    H    GLY   8           H        GLY   8  -2.280   0.376  -5.525
  193   1HA   GLY   8          1HA       GLY   8  -4.507  -0.330  -6.322
  194   2HA   GLY   8          2HA       GLY   8  -4.204   0.580  -7.801
  195    H    SER   9           H        SER   9  -3.750  -0.701  -9.499
  196    HA   SER   9           HA       SER   9  -3.421  -3.436  -9.554
  197   1HB   SER   9          1HB       SER   9  -3.333  -1.512 -11.455
  198   2HB   SER   9          2HB       SER   9  -1.631  -1.967 -11.414
  199    HG   SER   9           HG       SER   9  -2.251  -4.106 -11.780
  200    H    ASP  10           H        ASP  10  -0.783  -1.054  -9.206
  201    HA   ASP  10           HA       ASP  10   1.294  -3.037  -9.038
  202   1HB   ASP  10          1HB       ASP  10   1.086  -0.122  -8.346
  203   2HB   ASP  10          2HB       ASP  10   2.504  -1.039  -7.843
  204    H    LEU  11           H        LEU  11  -0.991  -1.782  -6.758
  205    HA   LEU  11           HA       LEU  11   0.472  -2.569  -4.381
  206   1HB   LEU  11          1HB       LEU  11  -2.188  -1.467  -5.008
  207   2HB   LEU  11          2HB       LEU  11  -2.162  -2.541  -3.611
  208    HG   LEU  11           HG       LEU  11  -0.257  -0.216  -4.000
  209   1HD1  LEU  11          1HD1      LEU  11  -1.814   1.154  -3.122
  210   2HD1  LEU  11          2HD1      LEU  11  -2.122   0.031  -1.797
  211   3HD1  LEU  11          3HD1      LEU  11  -2.991  -0.144  -3.323
  212   1HD2  LEU  11          1HD2      LEU  11  -0.763  -1.252  -1.305
  213   2HD2  LEU  11          2HD2      LEU  11   0.772  -0.935  -2.113
  214   3HD2  LEU  11          3HD2      LEU  11  -0.067  -2.464  -2.379
  215    H    VAL  12           H        VAL  12  -2.063  -4.033  -6.357
  216    HA   VAL  12           HA       VAL  12  -2.282  -6.396  -4.698
  217    HB   VAL  12           HB       VAL  12  -4.125  -5.791  -6.188
  218   1HG1  VAL  12          1HG1      VAL  12  -2.068  -6.201  -8.377
  219   2HG1  VAL  12          2HG1      VAL  12  -2.875  -4.691  -7.955
  220   3HG1  VAL  12          3HG1      VAL  12  -3.799  -6.017  -8.663
  221   1HG2  VAL  12          1HG2      VAL  12  -2.733  -8.317  -7.134
  222   2HG2  VAL  12          2HG2      VAL  12  -4.452  -7.960  -7.306
  223   3HG2  VAL  12          3HG2      VAL  12  -3.756  -8.197  -5.702
  224    H    GLU  13           H        GLU  13  -0.288  -5.425  -7.398
  225    HA   GLU  13           HA       GLU  13   0.773  -7.996  -8.060
  226   1HB   GLU  13          1HB       GLU  13   1.132  -5.813  -9.346
  227   2HB   GLU  13          2HB       GLU  13   2.335  -5.399  -8.123
  228   1HG   GLU  13          1HG       GLU  13   3.778  -7.111  -8.770
  229   2HG   GLU  13          2HG       GLU  13   2.482  -8.075  -9.477
  230    H    ALA  14           H        ALA  14   1.397  -5.705  -5.484
  231    HA   ALA  14           HA       ALA  14   3.735  -7.207  -4.511
  232   1HB   ALA  14          1HB       ALA  14   2.492  -4.612  -3.981
  233   2HB   ALA  14          2HB       ALA  14   4.163  -5.122  -3.743
  234   3HB   ALA  14          3HB       ALA  14   2.957  -5.451  -2.499
  235    H    LEU  15           H        LEU  15   0.314  -7.243  -4.156
  236    HA   LEU  15           HA       LEU  15   0.413  -8.592  -1.529
  237   1HB   LEU  15          1HB       LEU  15  -1.816  -7.769  -3.398
  238   2HB   LEU  15          2HB       LEU  15  -2.117  -8.834  -2.025
  239    HG   LEU  15           HG       LEU  15  -0.852  -6.083  -1.855
  240   1HD1  LEU  15          1HD1      LEU  15  -3.142  -5.930  -0.424
  241   2HD1  LEU  15          2HD1      LEU  15  -3.642  -7.085  -1.660
  242   3HD1  LEU  15          3HD1      LEU  15  -3.047  -5.492  -2.130
  243   1HD2  LEU  15          1HD2      LEU  15  -1.627  -6.713   0.660
  244   2HD2  LEU  15          2HD2      LEU  15  -0.016  -7.074   0.040
  245   3HD2  LEU  15          3HD2      LEU  15  -1.257  -8.328   0.054
  246    H    TYR  16           H        TYR  16   0.253  -9.288  -4.904
  247    HA   TYR  16           HA       TYR  16  -0.540 -12.093  -4.539
  248   1HB   TYR  16          1HB       TYR  16  -1.297 -11.270  -6.593
  249   2HB   TYR  16          2HB       TYR  16   0.154 -10.306  -6.856
  250    HD1  TYR  16           HD1      TYR  16  -0.993 -13.874  -6.606
  251    HD2  TYR  16           HD2      TYR  16   1.850 -11.107  -8.258
  252    HE1  TYR  16           HE1      TYR  16  -0.022 -15.693  -7.987
  253    HE2  TYR  16           HE2      TYR  16   2.820 -12.926  -9.639
  254    HH   TYR  16           HH       TYR  16   1.332 -15.717 -10.303
  255    H    LEU  17           H        LEU  17   2.330 -10.197  -4.536
  256    HA   LEU  17           HA       LEU  17   4.068 -12.559  -5.013
  257   1HB   LEU  17          1HB       LEU  17   4.605 -10.432  -6.175
  258   2HB   LEU  17          2HB       LEU  17   4.769  -9.634  -4.612
  259    HG   LEU  17           HG       LEU  17   6.466 -11.637  -4.164
  260   1HD1  LEU  17          1HD1      LEU  17   6.437 -12.902  -6.107
  261   2HD1  LEU  17          2HD1      LEU  17   7.736 -11.775  -6.494
  262   3HD1  LEU  17          3HD1      LEU  17   6.114 -11.506  -7.133
  263   1HD2  LEU  17          1HD2      LEU  17   6.794  -9.055  -4.365
  264   2HD2  LEU  17          2HD2      LEU  17   7.394  -9.421  -5.983
  265   3HD2  LEU  17          3HD2      LEU  17   8.201 -10.098  -4.568
  266    H    VAL  18           H        VAL  18   2.753 -10.665  -2.467
  267    HA   VAL  18           HA       VAL  18   4.864 -11.390  -0.550
  268    HB   VAL  18           HB       VAL  18   2.345  -9.754  -0.410
  269   1HG1  VAL  18          1HG1      VAL  18   2.850  -9.423   2.025
  270   2HG1  VAL  18          2HG1      VAL  18   4.022 -10.736   1.918
  271   3HG1  VAL  18          3HG1      VAL  18   2.310 -11.058   1.642
  272   1HG2  VAL  18          1HG2      VAL  18   4.470  -8.737  -1.203
  273   2HG2  VAL  18          2HG2      VAL  18   5.238  -9.198   0.316
  274   3HG2  VAL  18          3HG2      VAL  18   3.925  -8.020   0.314
  275    H    CYS  19           H        CYS  19   1.428 -12.110  -1.041
  276    HA   CYS  19           HA       CYS  19   1.316 -14.027   1.127
  277   1HB   CYS  19          1HB       CYS  19  -0.547 -14.089  -1.239
  278   2HB   CYS  19          2HB       CYS  19  -0.894 -14.435   0.457
  279    H    GLY  20           H        GLY  20   1.268 -14.467  -2.428
  280   1HA   GLY  20          1HA       GLY  20   2.167 -16.206  -3.727
  281   2HA   GLY  20          2HA       GLY  20   3.134 -16.663  -2.326
  282    H    GLU  21           H        GLU  21   2.151 -18.099  -0.729
  283    HA   GLU  21           HA       GLU  21  -0.158 -19.634  -1.860
  284   1HB   GLU  21          1HB       GLU  21   1.842 -20.983  -1.978
  285   2HB   GLU  21          2HB       GLU  21   2.252 -20.605  -0.304
  286   1HG   GLU  21          1HG       GLU  21  -0.340 -21.613  -0.137
  287   2HG   GLU  21          2HG       GLU  21   0.432 -22.634  -1.350
  288    H    ARG  22           H        ARG  22   1.309 -18.271   1.043
  289    HA   ARG  22           HA       ARG  22  -0.194 -19.362   3.099
  290   1HB   ARG  22          1HB       ARG  22   1.343 -17.028   2.758
  291   2HB   ARG  22          2HB       ARG  22  -0.224 -16.470   3.346
  292   1HG   ARG  22          1HG       ARG  22  -0.029 -18.343   5.107
  293   2HG   ARG  22          2HG       ARG  22   1.671 -18.426   4.648
  294   1HD   ARG  22          1HD       ARG  22   0.278 -15.880   5.523
  295   2HD   ARG  22          2HD       ARG  22   1.236 -16.900   6.596
  296    HE   ARG  22           HE       ARG  22   2.297 -15.215   4.408
  297   1HH1  ARG  22          1HH1      ARG  22   3.363 -15.026   7.164
  298   2HH1  ARG  22          2HH1      ARG  22   4.810 -15.975   7.080
  299   1HH2  ARG  22          1HH2      ARG  22   3.902 -17.576   4.140
  300   2HH2  ARG  22          2HH2      ARG  22   5.114 -17.421   5.368
  301    H    GLY  23           H        GLY  23  -1.257 -17.289   0.519
  302   1HA   GLY  23          1HA       GLY  23  -3.819 -17.809   0.165
  303   2HA   GLY  23          2HA       GLY  23  -3.957 -17.022   1.741
  304    H    PHE  24           H        PHE  24  -5.057 -15.171   1.005
  305    HA   PHE  24           HA       PHE  24  -3.726 -12.877   0.376
  306   1HB   PHE  24          1HB       PHE  24  -2.770 -13.715  -1.642
  307   2HB   PHE  24          2HB       PHE  24  -4.298 -14.423  -2.160
  308    HD1  PHE  24           HD1      PHE  24  -3.452 -11.035  -0.799
  309    HD2  PHE  24           HD2      PHE  24  -4.973 -13.317  -4.106
  310    HE1  PHE  24           HE1      PHE  24  -3.983  -8.934  -2.004
  311    HE2  PHE  24           HE2      PHE  24  -5.502 -11.217  -5.314
  312    HZ   PHE  24           HZ       PHE  24  -5.009  -9.024  -4.262
  313    H    PHE  25           H        PHE  25  -5.194 -11.143   0.172
  314    HA   PHE  25           HA       PHE  25  -7.962 -11.687  -0.663
  315   1HB   PHE  25          1HB       PHE  25  -7.144 -11.301   2.185
  316   2HB   PHE  25          2HB       PHE  25  -8.642 -10.541   1.647
  317    HD1  PHE  25           HD1      PHE  25  -7.537 -13.321   3.267
  318    HD2  PHE  25           HD2      PHE  25  -9.901 -12.290  -0.171
  319    HE1  PHE  25           HE1      PHE  25  -8.700 -15.507   3.412
  320    HE2  PHE  25           HE2      PHE  25 -11.063 -14.478  -0.026
  321    HZ   PHE  25           HZ       PHE  25 -10.463 -16.088   1.765
  322    H    TYR  26           H        TYR  26  -9.161  -9.722  -1.009
  323    HA   TYR  26           HA       TYR  26  -8.097  -7.123  -0.366
  324   1HB   TYR  26          1HB       TYR  26  -6.455  -7.783  -2.111
  325   2HB   TYR  26          2HB       TYR  26  -7.783  -8.024  -3.247
  326    HD1  TYR  26           HD1      TYR  26  -6.882  -5.399  -0.717
  327    HD2  TYR  26           HD2      TYR  26  -7.994  -6.275  -4.775
  328    HE1  TYR  26           HE1      TYR  26  -6.860  -2.976  -1.246
  329    HE2  TYR  26           HE2      TYR  26  -7.972  -3.851  -5.303
  330    HH   TYR  26           HH       TYR  26  -8.107  -1.489  -3.108
  331    H    THR  27           H        THR  27  -9.566  -5.455  -1.006
  332    HA   THR  27           HA       THR  27 -12.236  -6.489  -1.746
  333    HB   THR  27           HB       THR  27 -12.201  -5.023   0.168
  334    HG1  THR  27           HG1      THR  27 -13.965  -4.584  -1.033
  335   1HG2  THR  27          1HG2      THR  27 -10.288  -3.744   0.132
  336   2HG2  THR  27          2HG2      THR  27 -11.435  -2.542  -0.456
  337   3HG2  THR  27          3HG2      THR  27 -10.413  -3.417  -1.596
  338    H    LYS  28           H        LYS  28 -12.279  -3.314  -2.667
  339    HA   LYS  28           HA       LYS  28 -11.992  -4.098  -5.509
  340   1HB   LYS  28          1HB       LYS  28 -13.237  -2.088  -6.017
  341   2HB   LYS  28          2HB       LYS  28 -14.059  -2.907  -4.689
  342   1HG   LYS  28          1HG       LYS  28 -12.406  -1.369  -3.243
  343   2HG   LYS  28          2HG       LYS  28 -12.522  -0.352  -4.679
  344   1HD   LYS  28          1HD       LYS  28 -15.052  -0.614  -4.509
  345   2HD   LYS  28          2HD       LYS  28 -14.781  -1.321  -2.917
  346   1HE   LYS  28          1HE       LYS  28 -15.228   1.082  -2.702
  347   2HE   LYS  28          2HE       LYS  28 -13.564   0.731  -2.231
  348   1HZ   LYS  28          1HZ       LYS  28 -12.752   1.868  -3.959
  349   2HZ   LYS  28          2HZ       LYS  28 -14.284   2.599  -4.019
  350   3HZ   LYS  28          3HZ       LYS  28 -13.925   1.288  -5.039
  351    HA   PRO  29           HA       PRO  29  -8.146  -1.953  -5.758
  352   1HB   PRO  29          1HB       PRO  29  -7.973  -1.892  -8.501
  353   2HB   PRO  29          2HB       PRO  29  -7.651  -3.340  -7.530
  354   1HG   PRO  29          1HG       PRO  29 -10.021  -2.707  -9.222
  355   2HG   PRO  29          2HG       PRO  29  -9.368  -4.284  -8.752
  356   1HD   PRO  29          1HD       PRO  29 -11.625  -3.004  -7.608
  357   2HD   PRO  29          2HD       PRO  29 -10.783  -4.426  -6.955
  358    H    THR  30           H        THR  30  -7.332  -0.080  -7.517
  359    HA   THR  30           HA       THR  30  -8.600   2.312  -6.754
  360    HB   THR  30           HB       THR  30  -6.429   2.502  -7.694
  361    HG1  THR  30           HG1      THR  30  -8.068   3.336  -9.832
  362   1HG2  THR  30          1HG2      THR  30  -6.436   1.850 -10.340
  363   2HG2  THR  30          2HG2      THR  30  -7.559   0.650  -9.701
  364   3HG2  THR  30          3HG2      THR  30  -5.919   0.754  -9.060
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1 -12.652   4.526  -5.116
    2   2H    GLY   1          2H        GLY   1 -12.885   4.288  -6.781
    3   3H    GLY   1          3H        GLY   1 -11.383   3.932  -6.074
    4   1HA   GLY   1          1HA       GLY   1 -13.709   2.481  -5.148
    5   2HA   GLY   1          2HA       GLY   1 -12.975   1.965  -6.696
    6    H    GLY   2           H        GLY   2 -11.089   3.232  -4.030
    7   1HA   GLY   2          1HA       GLY   2 -10.743   2.350  -1.770
    8   2HA   GLY   2          2HA       GLY   2 -11.461   0.828  -2.301
    9    H    GLY   3           H        GLY   3  -9.235   2.390  -4.444
   10   1HA   GLY   3          1HA       GLY   3  -7.357   0.134  -4.079
   11   2HA   GLY   3          2HA       GLY   3  -7.322   1.307  -5.398
   12    H    GLU   4           H        GLU   4  -7.621   2.371  -2.081
   13    HA   GLU   4           HA       GLU   4  -5.141   3.908  -2.353
   14   1HB   GLU   4          1HB       GLU   4  -5.736   4.847  -0.174
   15   2HB   GLU   4          2HB       GLU   4  -7.159   4.840  -1.217
   16   1HG   GLU   4          1HG       GLU   4  -6.935   2.330   0.215
   17   2HG   GLU   4          2HG       GLU   4  -6.943   3.689   1.340
   18    H    GLN   5           H        GLN   5  -4.477   3.686   0.533
   19    HA   GLN   5           HA       GLN   5  -3.162   2.347   1.951
   20   1HB   GLN   5          1HB       GLN   5  -5.073   0.609   0.985
   21   2HB   GLN   5          2HB       GLN   5  -3.572  -0.178   0.497
   22   1HG   GLN   5          1HG       GLN   5  -4.112  -0.970   2.710
   23   2HG   GLN   5          2HG       GLN   5  -2.743   0.132   2.864
   24   1HE2  GLN   5          1HE2      GLN   5  -5.076  -0.576   4.777
   25   2HE2  GLN   5          2HE2      GLN   5  -5.691   0.937   5.237
   26    H    CYS   6           H        CYS   6  -0.979   2.283   1.809
   27    HA   CYS   6           HA       CYS   6   1.173   2.022   0.929
   28   1HB   CYS   6          1HB       CYS   6  -0.404   0.129  -0.799
   29   2HB   CYS   6          2HB       CYS   6   1.288   0.461  -1.161
   30    H    CYS   7           H        CYS   7  -1.199   3.763  -0.449
   31    HA   CYS   7           HA       CYS   7   0.462   4.576  -2.792
   32   1HB   CYS   7          1HB       CYS   7  -1.970   3.873  -3.143
   33   2HB   CYS   7          2HB       CYS   7  -2.419   5.334  -2.264
   34    H    THR   8           H        THR   8  -1.587   5.946  -0.201
   35    HA   THR   8           HA       THR   8  -0.417   8.601  -0.549
   36    HB   THR   8           HB       THR   8  -2.766   8.266   0.220
   37    HG1  THR   8           HG1      THR   8  -2.373   9.600   2.247
   38   1HG2  THR   8          1HG2      THR   8  -2.361   7.736   2.962
   39   2HG2  THR   8          2HG2      THR   8  -1.424   6.524   2.088
   40   3HG2  THR   8          3HG2      THR   8  -3.151   6.694   1.778
   41    H    SER   9           H        SER   9   0.449   5.747   1.132
   42    HA   SER   9           HA       SER   9   2.517   7.297   2.619
   43   1HB   SER   9          1HB       SER   9   0.793   6.705   4.250
   44   2HB   SER   9          2HB       SER   9   0.839   5.025   3.724
   45    HG   SER   9           HG       SER   9   2.759   6.528   5.138
   46    H    ILE  10           H        ILE  10   3.992   5.321   3.692
   47    HA   ILE  10           HA       ILE  10   4.821   3.741   1.302
   48    HB   ILE  10           HB       ILE  10   6.523   4.063   3.758
   49   1HG1  ILE  10          1HG1      ILE  10   5.804   6.337   3.305
   50   2HG1  ILE  10          2HG1      ILE  10   7.448   6.152   2.692
   51   1HG2  ILE  10          1HG2      ILE  10   7.312   4.136   0.845
   52   2HG2  ILE  10          2HG2      ILE  10   7.044   2.608   1.682
   53   3HG2  ILE  10          3HG2      ILE  10   8.305   3.708   2.239
   54   1HD1  ILE  10          1HD1      ILE  10   6.623   6.966   0.744
   55   2HD1  ILE  10          2HD1      ILE  10   4.954   6.665   1.226
   56   3HD1  ILE  10          3HD1      ILE  10   5.921   5.363   0.534
   57    H    CYS  11           H        CYS  11   5.534   1.505   1.703
   58    HA   CYS  11           HA       CYS  11   4.892   0.238   4.245
   59   1HB   CYS  11          1HB       CYS  11   3.083  -1.193   3.370
   60   2HB   CYS  11          2HB       CYS  11   2.623   0.508   3.310
   61    H    SER  12           H        SER  12   4.821  -2.334   3.694
   62    HA   SER  12           HA       SER  12   6.595  -3.041   1.467
   63   1HB   SER  12          1HB       SER  12   8.294  -2.391   3.025
   64   2HB   SER  12          2HB       SER  12   7.481  -3.206   4.355
   65    HG   SER  12           HG       SER  12   9.021  -4.603   3.700
   66    H    LEU  13           H        LEU  13   7.292  -5.585   2.142
   67    HA   LEU  13           HA       LEU  13   4.815  -6.972   1.924
   68   1HB   LEU  13          1HB       LEU  13   6.186  -9.063   2.439
   69   2HB   LEU  13          2HB       LEU  13   6.660  -8.134   1.028
   70    HG   LEU  13           HG       LEU  13   8.428  -9.013   2.833
   71   1HD1  LEU  13          1HD1      LEU  13   9.397  -8.049   1.007
   72   2HD1  LEU  13          2HD1      LEU  13   9.709  -6.767   2.173
   73   3HD1  LEU  13          3HD1      LEU  13   8.352  -6.631   1.056
   74   1HD2  LEU  13          1HD2      LEU  13   7.369  -7.680   4.680
   75   2HD2  LEU  13          2HD2      LEU  13   7.826  -6.213   3.823
   76   3HD2  LEU  13          3HD2      LEU  13   9.068  -7.306   4.414
   77    H    TYR  14           H        TYR  14   6.195  -5.593   4.643
   78    HA   TYR  14           HA       TYR  14   5.299  -7.502   6.623
   79   1HB   TYR  14          1HB       TYR  14   6.380  -4.761   6.562
   80   2HB   TYR  14          2HB       TYR  14   5.373  -5.149   7.954
   81    HD1  TYR  14           HD1      TYR  14   8.375  -6.207   6.028
   82    HD2  TYR  14           HD2      TYR  14   6.126  -6.618   9.661
   83    HE1  TYR  14           HE1      TYR  14  10.243  -7.494   7.035
   84    HE2  TYR  14           HE2      TYR  14   7.995  -7.897  10.677
   85    HH   TYR  14           HH       TYR  14  10.554  -8.039  10.285
   86    H    GLN  15           H        GLN  15   4.086  -4.302   5.681
   87    HA   GLN  15           HA       GLN  15   1.592  -4.631   7.082
   88   1HB   GLN  15          1HB       GLN  15   1.368  -2.436   6.585
   89   2HB   GLN  15          2HB       GLN  15   2.904  -2.533   5.732
   90   1HG   GLN  15          1HG       GLN  15   1.451  -1.673   4.100
   91   2HG   GLN  15          2HG       GLN  15   1.465  -3.396   3.729
   92   1HE2  GLN  15          1HE2      GLN  15  -0.438  -0.875   5.420
   93   2HE2  GLN  15          2HE2      GLN  15  -1.916  -1.703   5.324
   94    H    LEU  16           H        LEU  16   2.726  -5.329   3.863
   95    HA   LEU  16           HA       LEU  16   0.140  -6.004   2.752
   96   1HB   LEU  16          1HB       LEU  16   2.876  -6.994   1.885
   97   2HB   LEU  16          2HB       LEU  16   1.407  -6.962   0.910
   98    HG   LEU  16           HG       LEU  16   2.534  -4.441   2.122
   99   1HD1  LEU  16          1HD1      LEU  16   3.507  -4.091  -0.229
  100   2HD1  LEU  16          2HD1      LEU  16   3.308  -5.829  -0.448
  101   3HD1  LEU  16          3HD1      LEU  16   4.368  -5.216   0.820
  102   1HD2  LEU  16          1HD2      LEU  16   0.419  -3.952   1.310
  103   2HD2  LEU  16          2HD2      LEU  16   0.492  -5.206   0.071
  104   3HD2  LEU  16          3HD2      LEU  16   1.366  -3.691  -0.155
  105    H    GLU  17           H        GLU  17   2.376  -7.554   4.882
  106    HA   GLU  17           HA       GLU  17   1.457 -10.275   4.303
  107   1HB   GLU  17          1HB       GLU  17   3.442  -9.000   6.035
  108   2HB   GLU  17          2HB       GLU  17   2.573 -10.297   6.856
  109   1HG   GLU  17          1HG       GLU  17   4.054 -10.497   4.218
  110   2HG   GLU  17          2HG       GLU  17   4.508 -11.255   5.746
  111    H    ASN  18           H        ASN  18   0.273  -7.603   6.051
  112    HA   ASN  18           HA       ASN  18  -1.270  -9.198   7.970
  113   1HB   ASN  18          1HB       ASN  18  -0.365  -6.650   8.061
  114   2HB   ASN  18          2HB       ASN  18  -1.996  -6.365   7.452
  115   1HD2  ASN  18          1HD2      ASN  18  -1.144  -5.589  10.114
  116   2HD2  ASN  18          2HD2      ASN  18  -2.042  -6.503  11.226
  117    H    TYR  19           H        TYR  19  -1.524  -8.608   4.718
  118    HA   TYR  19           HA       TYR  19  -4.499  -8.457   4.726
  119   1HB   TYR  19          1HB       TYR  19  -2.355  -7.932   2.702
  120   2HB   TYR  19          2HB       TYR  19  -3.937  -8.454   2.122
  121    HD1  TYR  19           HD1      TYR  19  -3.467  -6.501   5.230
  122    HD2  TYR  19           HD2      TYR  19  -4.534  -6.358   1.069
  123    HE1  TYR  19           HE1      TYR  19  -4.344  -4.198   5.532
  124    HE2  TYR  19           HE2      TYR  19  -5.410  -4.057   1.372
  125    HH   TYR  19           HH       TYR  19  -5.747  -2.392   2.788
  126    H    CYS  20           H        CYS  20  -1.944 -10.706   4.501
  127    HA   CYS  20           HA       CYS  20  -3.883 -12.752   3.546
  128   1HB   CYS  20          1HB       CYS  20  -1.061 -12.853   2.545
  129   2HB   CYS  20          2HB       CYS  20  -2.526 -13.513   1.826
  130    H    ASN  21           H        ASN  21  -2.399 -14.967   3.565
  131    HA   ASN  21           HA       ASN  21  -1.458 -15.122   6.395
  132   1HB   ASN  21          1HB       ASN  21  -3.311 -16.664   5.181
  133   2HB   ASN  21          2HB       ASN  21  -1.866 -17.597   4.793
  134   1HD2  ASN  21          1HD2      ASN  21  -4.004 -18.376   6.699
  135   2HD2  ASN  21          2HD2      ASN  21  -3.251 -18.544   8.211
  136   1H    PHE   1          1H        PHE   1  11.226  -1.483   2.923
  137   2H    PHE   1          2H        PHE   1  11.542   0.096   3.467
  138   3H    PHE   1          3H        PHE   1  12.103  -1.241   4.354
  139    HA   PHE   1           HA       PHE   1  13.972  -1.323   3.189
  140   1HB   PHE   1          1HB       PHE   1  12.216  -1.138   0.724
  141   2HB   PHE   1          2HB       PHE   1  13.913  -1.619   0.745
  142    HD1  PHE   1           HD1      PHE   1  10.505  -2.722   1.141
  143    HD2  PHE   1           HD2      PHE   1  14.574  -3.678   2.129
  144    HE1  PHE   1           HE1      PHE   1   9.840  -5.055   1.605
  145    HE2  PHE   1           HE2      PHE   1  13.908  -6.020   2.602
  146    HZ   PHE   1           HZ       PHE   1  11.541  -6.710   2.343
  147    H    VAL   2           H        VAL   2  12.116   0.785   0.985
  148    HA   VAL   2           HA       VAL   2  13.443   3.186   1.974
  149    HB   VAL   2           HB       VAL   2  15.089   1.847   0.447
  150   1HG1  VAL   2          1HG1      VAL   2  13.726   3.350  -1.750
  151   2HG1  VAL   2          2HG1      VAL   2  13.151   1.739  -1.316
  152   3HG1  VAL   2          3HG1      VAL   2  14.817   1.966  -1.847
  153   1HG2  VAL   2          1HG2      VAL   2  16.187   3.797   0.586
  154   2HG2  VAL   2          2HG2      VAL   2  14.672   4.599   0.999
  155   3HG2  VAL   2          3HG2      VAL   2  15.172   4.474  -0.688
  156    H    ASN   3           H        ASN   3  13.149   4.696  -0.388
  157    HA   ASN   3           HA       ASN   3  10.472   5.518  -0.264
  158   1HB   ASN   3          1HB       ASN   3  12.757   6.034  -1.995
  159   2HB   ASN   3          2HB       ASN   3  11.241   6.068  -2.894
  160   1HD2  ASN   3          1HD2      ASN   3   9.404   7.236  -1.343
  161   2HD2  ASN   3          2HD2      ASN   3   9.907   8.745  -0.753
  162    H    GLN   4           H        GLN   4   8.643   4.502  -0.868
  163    HA   GLN   4           HA       GLN   4   8.654   2.837  -3.323
  164   1HB   GLN   4          1HB       GLN   4   8.326   1.847  -0.568
  165   2HB   GLN   4          2HB       GLN   4   7.022   1.366  -1.656
  166   1HG   GLN   4          1HG       GLN   4   8.362  -0.051  -2.807
  167   2HG   GLN   4          2HG       GLN   4   9.677   1.124  -2.879
  168   1HE2  GLN   4          1HE2      GLN   4   8.065  -1.025  -0.467
  169   2HE2  GLN   4          2HE2      GLN   4   9.492  -1.396   0.372
  170    H    HIS   5           H        HIS   5   6.429   2.519  -4.151
  171    HA   HIS   5           HA       HIS   5   4.217   3.901  -2.861
  172   1HB   HIS   5          1HB       HIS   5   5.959   5.411  -4.575
  173   2HB   HIS   5          2HB       HIS   5   4.383   5.258  -5.350
  174    HD2  HIS   5           HD2      HIS   5   4.418   5.406  -1.459
  175    HE1  HIS   5           HE1      HIS   5   3.051   9.139  -2.898
  176    HE2  HIS   5           HE2      HIS   5   3.365   7.698  -0.816
  177    H    LEU   6           H        LEU   6   2.722   2.343  -3.315
  178    HA   LEU   6           HA       LEU   6   2.463   1.486  -6.171
  179   1HB   LEU   6          1HB       LEU   6   1.732  -0.172  -3.739
  180   2HB   LEU   6          2HB       LEU   6   1.745  -0.698  -5.424
  181    HG   LEU   6           HG       LEU   6   4.194   0.284  -3.941
  182   1HD1  LEU   6          1HD1      LEU   6   4.790  -2.232  -4.158
  183   2HD1  LEU   6          2HD1      LEU   6   3.057  -2.476  -4.373
  184   3HD1  LEU   6          3HD1      LEU   6   3.669  -1.760  -2.882
  185   1HD2  LEU   6          1HD2      LEU   6   4.149   0.509  -6.442
  186   2HD2  LEU   6          2HD2      LEU   6   3.911  -1.235  -6.550
  187   3HD2  LEU   6          3HD2      LEU   6   5.400  -0.591  -5.862
  188    H    CYS   7           H        CYS   7   0.362   1.487  -7.001
  189    HA   CYS   7           HA       CYS   7  -1.889   2.084  -5.167
  190   1HB   CYS   7          1HB       CYS   7  -1.382   3.839  -7.583
  191   2HB   CYS   7          2HB       CYS   7  -2.556   4.085  -6.290
  192    H    GLY   8           H        GLY   8  -3.432   0.640  -5.761
  193   1HA   GLY   8          1HA       GLY   8  -5.001  -0.406  -7.186
  194   2HA   GLY   8          2HA       GLY   8  -4.272   0.439  -8.550
  195    H    SER   9           H        SER   9  -3.715  -1.121  -9.984
  196    HA   SER   9           HA       SER   9  -3.193  -3.806  -9.575
  197   1HB   SER   9          1HB       SER   9  -3.208  -2.360 -11.767
  198   2HB   SER   9          2HB       SER   9  -1.466  -2.296 -11.512
  199    HG   SER   9           HG       SER   9  -2.079  -4.095 -12.781
  200    H    ASP  10           H        ASP  10  -0.559  -1.388  -9.887
  201    HA   ASP  10           HA       ASP  10   1.598  -2.952  -9.187
  202   1HB   ASP  10          1HB       ASP  10   0.934  -0.083  -8.704
  203   2HB   ASP  10          2HB       ASP  10   2.329  -0.749  -7.853
  204    H    LEU  11           H        LEU  11  -0.903  -1.768  -7.041
  205    HA   LEU  11           HA       LEU  11   0.429  -2.472  -4.585
  206   1HB   LEU  11          1HB       LEU  11  -2.164  -1.448  -5.382
  207   2HB   LEU  11          2HB       LEU  11  -2.341  -2.699  -4.153
  208    HG   LEU  11           HG       LEU  11  -0.511  -0.290  -3.947
  209   1HD1  LEU  11          1HD1      LEU  11  -2.590  -0.506  -1.947
  210   2HD1  LEU  11          2HD1      LEU  11  -3.298  -0.497  -3.562
  211   3HD1  LEU  11          3HD1      LEU  11  -2.250   0.827  -3.050
  212   1HD2  LEU  11          1HD2      LEU  11  -1.238  -1.867  -1.558
  213   2HD2  LEU  11          2HD2      LEU  11   0.323  -1.197  -2.030
  214   3HD2  LEU  11          3HD2      LEU  11  -0.225  -2.724  -2.721
  215    H    VAL  12           H        VAL  12  -1.687  -4.185  -6.805
  216    HA   VAL  12           HA       VAL  12  -2.006  -6.531  -5.157
  217    HB   VAL  12           HB       VAL  12  -2.120  -6.388  -8.182
  218   1HG1  VAL  12          1HG1      VAL  12  -4.072  -8.114  -7.248
  219   2HG1  VAL  12          2HG1      VAL  12  -2.726  -8.411  -6.147
  220   3HG1  VAL  12          3HG1      VAL  12  -2.501  -8.601  -7.886
  221   1HG2  VAL  12          1HG2      VAL  12  -3.572  -4.656  -7.352
  222   2HG2  VAL  12          2HG2      VAL  12  -4.192  -5.707  -6.079
  223   3HG2  VAL  12          3HG2      VAL  12  -4.599  -6.029  -7.765
  224    H    GLU  13           H        GLU  13   0.260  -5.577  -7.670
  225    HA   GLU  13           HA       GLU  13   1.693  -8.009  -7.915
  226   1HB   GLU  13          1HB       GLU  13   2.037  -5.876  -9.278
  227   2HB   GLU  13          2HB       GLU  13   2.959  -5.253  -7.909
  228   1HG   GLU  13          1HG       GLU  13   4.709  -6.718  -8.239
  229   2HG   GLU  13          2HG       GLU  13   3.670  -7.968  -8.924
  230    H    ALA  14           H        ALA  14   1.544  -5.630  -5.390
  231    HA   ALA  14           HA       ALA  14   3.905  -6.682  -3.992
  232   1HB   ALA  14          1HB       ALA  14   3.802  -4.750  -2.813
  233   2HB   ALA  14          2HB       ALA  14   2.090  -4.973  -2.454
  234   3HB   ALA  14          3HB       ALA  14   2.583  -4.245  -3.983
  235    H    LEU  15           H        LEU  15   0.469  -7.178  -4.069
  236    HA   LEU  15           HA       LEU  15   0.521  -8.638  -1.492
  237   1HB   LEU  15          1HB       LEU  15  -1.668  -7.864  -3.421
  238   2HB   LEU  15          2HB       LEU  15  -1.952  -9.027  -2.127
  239    HG   LEU  15           HG       LEU  15  -0.664  -6.399  -1.470
  240   1HD1  LEU  15          1HD1      LEU  15  -3.229  -5.825  -0.932
  241   2HD1  LEU  15          2HD1      LEU  15  -3.481  -6.869  -2.331
  242   3HD1  LEU  15          3HD1      LEU  15  -2.489  -5.420  -2.480
  243   1HD2  LEU  15          1HD2      LEU  15  -2.308  -6.931   0.555
  244   2HD2  LEU  15          2HD2      LEU  15  -0.743  -7.735   0.426
  245   3HD2  LEU  15          3HD2      LEU  15  -2.209  -8.567  -0.096
  246    H    TYR  16           H        TYR  16   0.089  -9.145  -4.927
  247    HA   TYR  16           HA       TYR  16  -0.431 -11.960  -4.816
  248   1HB   TYR  16          1HB       TYR  16  -0.972 -11.172  -6.898
  249   2HB   TYR  16          2HB       TYR  16   0.283  -9.939  -6.869
  250    HD1  TYR  16           HD1      TYR  16   0.038 -13.699  -6.902
  251    HD2  TYR  16           HD2      TYR  16   2.027 -10.187  -8.379
  252    HE1  TYR  16           HE1      TYR  16   1.477 -15.118  -8.343
  253    HE2  TYR  16           HE2      TYR  16   3.465 -11.606  -9.819
  254    HH   TYR  16           HH       TYR  16   4.201 -13.787 -10.097
  255    H    LEU  17           H        LEU  17   2.489 -10.041  -4.638
  256    HA   LEU  17           HA       LEU  17   4.205 -12.437  -4.945
  257   1HB   LEU  17          1HB       LEU  17   5.030 -10.419  -6.003
  258   2HB   LEU  17          2HB       LEU  17   4.836  -9.504  -4.507
  259    HG   LEU  17           HG       LEU  17   6.430 -11.839  -3.983
  260   1HD1  LEU  17          1HD1      LEU  17   7.290 -10.105  -6.310
  261   2HD1  LEU  17          2HD1      LEU  17   7.083 -11.855  -6.299
  262   3HD1  LEU  17          3HD1      LEU  17   8.404 -11.117  -5.395
  263   1HD2  LEU  17          1HD2      LEU  17   7.674 -10.305  -2.800
  264   2HD2  LEU  17          2HD2      LEU  17   6.221  -9.330  -3.025
  265   3HD2  LEU  17          3HD2      LEU  17   7.609  -9.103  -4.089
  266    H    VAL  18           H        VAL  18   2.733 -10.496  -2.523
  267    HA   VAL  18           HA       VAL  18   4.542 -11.396  -0.380
  268    HB   VAL  18           HB       VAL  18   2.196  -9.539  -0.599
  269   1HG1  VAL  18          1HG1      VAL  18   2.364  -9.329   1.960
  270   2HG1  VAL  18          2HG1      VAL  18   3.152 -10.907   1.917
  271   3HG1  VAL  18          3HG1      VAL  18   1.499 -10.731   1.329
  272   1HG2  VAL  18          1HG2      VAL  18   4.910  -9.186  -0.601
  273   2HG2  VAL  18          2HG2      VAL  18   4.530  -8.927   1.103
  274   3HG2  VAL  18          3HG2      VAL  18   3.749  -7.942  -0.135
  275    H    CYS  19           H        CYS  19   1.269 -11.921  -1.518
  276    HA   CYS  19           HA       CYS  19   0.909 -14.108   0.467
  277   1HB   CYS  19          1HB       CYS  19  -1.337 -13.410  -1.333
  278   2HB   CYS  19          2HB       CYS  19  -1.337 -13.703   0.401
  279    H    GLY  20           H        GLY  20   2.616 -14.331  -1.907
  280   1HA   GLY  20          1HA       GLY  20   1.719 -15.530  -4.177
  281   2HA   GLY  20          2HA       GLY  20   3.095 -16.200  -3.302
  282    H    GLU  21           H        GLU  21   2.493 -17.749  -1.475
  283    HA   GLU  21           HA       GLU  21  -0.088 -19.139  -2.008
  284   1HB   GLU  21          1HB       GLU  21   2.039 -20.169  -3.163
  285   2HB   GLU  21          2HB       GLU  21   2.398 -20.759  -1.540
  286   1HG   GLU  21          1HG       GLU  21   0.111 -21.764  -1.446
  287   2HG   GLU  21          2HG       GLU  21  -0.141 -21.266  -3.119
  288    H    ARG  22           H        ARG  22  -1.130 -19.145  -0.118
  289    HA   ARG  22           HA       ARG  22  -0.486 -20.451   2.210
  290   1HB   ARG  22          1HB       ARG  22   1.147 -18.048   1.922
  291   2HB   ARG  22          2HB       ARG  22   0.176 -18.000   3.394
  292   1HG   ARG  22          1HG       ARG  22   1.316 -19.728   4.355
  293   2HG   ARG  22          2HG       ARG  22   1.470 -20.602   2.831
  294   1HD   ARG  22          1HD       ARG  22   3.334 -19.287   2.147
  295   2HD   ARG  22          2HD       ARG  22   3.041 -18.084   3.403
  296    HE   ARG  22           HE       ARG  22   4.459 -20.610   3.750
  297   1HH1  ARG  22          1HH1      ARG  22   4.864 -17.863   5.114
  298   2HH1  ARG  22          2HH1      ARG  22   4.462 -18.268   6.750
  299   1HH2  ARG  22          1HH2      ARG  22   2.941 -21.271   5.912
  300   2HH2  ARG  22          2HH2      ARG  22   3.374 -20.199   7.202
  301    H    GLY  23           H        GLY  23  -1.796 -17.553   0.778
  302   1HA   GLY  23          1HA       GLY  23  -4.424 -17.783   1.413
  303   2HA   GLY  23          2HA       GLY  23  -3.759 -17.127   2.913
  304    H    PHE  24           H        PHE  24  -5.560 -15.580   1.472
  305    HA   PHE  24           HA       PHE  24  -4.225 -13.119   1.199
  306   1HB   PHE  24          1HB       PHE  24  -3.128 -14.165  -0.765
  307   2HB   PHE  24          2HB       PHE  24  -4.708 -14.490  -1.467
  308    HD1  PHE  24           HD1      PHE  24  -4.699 -11.419   0.356
  309    HD2  PHE  24           HD2      PHE  24  -3.591 -13.166  -3.409
  310    HE1  PHE  24           HE1      PHE  24  -4.665  -9.166  -0.684
  311    HE2  PHE  24           HE2      PHE  24  -3.561 -10.916  -4.451
  312    HZ   PHE  24           HZ       PHE  24  -4.102  -8.914  -3.085
  313    H    PHE  25           H        PHE  25  -5.952 -11.811   1.685
  314    HA   PHE  25           HA       PHE  25  -8.626 -12.615   0.621
  315   1HB   PHE  25          1HB       PHE  25  -7.955 -10.837   2.982
  316   2HB   PHE  25          2HB       PHE  25  -9.570 -11.353   2.498
  317    HD1  PHE  25           HD1      PHE  25  -7.046 -12.005   4.772
  318    HD2  PHE  25           HD2      PHE  25  -9.636 -14.065   2.031
  319    HE1  PHE  25           HE1      PHE  25  -6.773 -14.094   6.085
  320    HE2  PHE  25           HE2      PHE  25  -9.364 -16.154   3.343
  321    HZ   PHE  25           HZ       PHE  25  -7.933 -16.168   5.369
  322    H    TYR  26           H        TYR  26  -8.033 -11.500  -1.440
  323    HA   TYR  26           HA       TYR  26  -9.297  -9.066  -1.839
  324   1HB   TYR  26          1HB       TYR  26  -7.724  -7.958  -0.347
  325   2HB   TYR  26          2HB       TYR  26  -6.357  -8.650  -1.216
  326    HD1  TYR  26           HD1      TYR  26  -8.795  -5.982  -1.092
  327    HD2  TYR  26           HD2      TYR  26  -5.974  -7.988  -3.637
  328    HE1  TYR  26           HE1      TYR  26  -8.828  -4.051  -2.646
  329    HE2  TYR  26           HE2      TYR  26  -6.006  -6.055  -5.194
  330    HH   TYR  26           HH       TYR  26  -6.822  -3.195  -4.555
  331    H    THR  27           H        THR  27  -9.713  -9.504  -3.966
  332    HA   THR  27           HA       THR  27  -7.363 -10.125  -5.708
  333    HB   THR  27           HB       THR  27  -8.947 -12.084  -5.236
  334    HG1  THR  27           HG1      THR  27  -8.058 -11.100  -7.653
  335   1HG2  THR  27          1HG2      THR  27 -10.739 -10.429  -7.037
  336   2HG2  THR  27          2HG2      THR  27 -11.040 -10.780  -5.334
  337   3HG2  THR  27          3HG2      THR  27 -11.050 -12.086  -6.519
  338    H    LYS  28           H        LYS  28  -9.714  -7.888  -5.038
  339    HA   LYS  28           HA       LYS  28 -10.916  -7.137  -7.426
  340   1HB   LYS  28          1HB       LYS  28 -10.867  -5.974  -5.061
  341   2HB   LYS  28          2HB       LYS  28  -9.584  -5.008  -5.789
  342   1HG   LYS  28          1HG       LYS  28 -11.320  -3.720  -6.522
  343   2HG   LYS  28          2HG       LYS  28 -11.430  -4.948  -7.784
  344   1HD   LYS  28          1HD       LYS  28 -13.543  -5.321  -7.085
  345   2HD   LYS  28          2HD       LYS  28 -12.841  -6.046  -5.639
  346   1HE   LYS  28          1HE       LYS  28 -13.129  -4.117  -4.364
  347   2HE   LYS  28          2HE       LYS  28 -13.138  -3.063  -5.778
  348   1HZ   LYS  28          1HZ       LYS  28 -15.350  -3.332  -4.791
  349   2HZ   LYS  28          2HZ       LYS  28 -15.280  -5.003  -5.090
  350   3HZ   LYS  28          3HZ       LYS  28 -15.294  -3.905  -6.386
  351    HA   PRO  29           HA       PRO  29  -7.183  -6.542  -9.851
  352   1HB   PRO  29          1HB       PRO  29  -8.498  -6.433 -12.260
  353   2HB   PRO  29          2HB       PRO  29  -8.083  -7.947 -11.438
  354   1HG   PRO  29          1HG       PRO  29 -10.739  -6.614 -11.689
  355   2HG   PRO  29          2HG       PRO  29 -10.360  -8.331 -11.469
  356   1HD   PRO  29          1HD       PRO  29 -11.245  -6.560  -9.445
  357   2HD   PRO  29          2HD       PRO  29 -10.544  -8.173  -9.189
  358    H    THR  30           H        THR  30  -7.275  -4.957 -12.160
  359    HA   THR  30           HA       THR  30  -7.097  -2.699 -12.777
  360    HB   THR  30           HB       THR  30  -9.105  -1.537 -12.773
  361    HG1  THR  30           HG1      THR  30  -9.863  -2.773 -10.347
  362   1HG2  THR  30          1HG2      THR  30 -10.951  -3.156 -12.867
  363   2HG2  THR  30          2HG2      THR  30  -9.963  -4.342 -12.015
  364   3HG2  THR  30          3HG2      THR  30  -9.508  -3.817 -13.635
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1  -6.970   8.493  -6.857
    2   2H    GLY   1          2H        GLY   1  -7.032   6.818  -6.580
    3   3H    GLY   1          3H        GLY   1  -5.828   7.758  -5.839
    4   1HA   GLY   1          1HA       GLY   1  -7.319   7.679  -4.123
    5   2HA   GLY   1          2HA       GLY   1  -8.012   9.108  -4.950
    6    H    GLY   2           H        GLY   2  -9.186   7.842  -2.886
    7   1HA   GLY   2          1HA       GLY   2 -10.722   6.273  -2.047
    8   2HA   GLY   2          2HA       GLY   2 -11.296   6.199  -3.714
    9    H    GLY   3           H        GLY   3  -8.779   4.870  -1.562
   10   1HA   GLY   3          1HA       GLY   3  -8.366   2.487  -1.390
   11   2HA   GLY   3          2HA       GLY   3  -9.087   2.280  -2.987
   12    H    GLU   4           H        GLU   4  -6.219   3.526  -1.311
   13    HA   GLU   4           HA       GLU   4  -4.497   2.569  -3.457
   14   1HB   GLU   4          1HB       GLU   4  -3.650   4.675  -4.224
   15   2HB   GLU   4          2HB       GLU   4  -5.408   4.802  -4.298
   16   1HG   GLU   4          1HG       GLU   4  -3.658   5.829  -2.043
   17   2HG   GLU   4          2HG       GLU   4  -4.439   6.823  -3.273
   18    H    GLN   5           H        GLN   5  -4.849   2.348  -0.513
   19    HA   GLN   5           HA       GLN   5  -3.043   3.767   1.045
   20   1HB   GLN   5          1HB       GLN   5  -4.565   1.689   1.608
   21   2HB   GLN   5          2HB       GLN   5  -3.091   0.774   1.293
   22   1HG   GLN   5          1HG       GLN   5  -1.884   2.186   2.943
   23   2HG   GLN   5          2HG       GLN   5  -3.388   3.041   3.288
   24   1HE2  GLN   5          1HE2      GLN   5  -3.955   2.291   5.361
   25   2HE2  GLN   5          2HE2      GLN   5  -4.100   0.652   5.777
   26    H    CYS   6           H        CYS   6  -0.825   3.148   1.753
   27    HA   CYS   6           HA       CYS   6   1.432   2.822   1.242
   28   1HB   CYS   6          1HB       CYS   6   0.244   0.574  -0.400
   29   2HB   CYS   6          2HB       CYS   6   1.947   0.725   0.033
   30    H    CYS   7           H        CYS   7  -0.405   4.433  -0.640
   31    HA   CYS   7           HA       CYS   7   1.405   4.341  -3.020
   32   1HB   CYS   7          1HB       CYS   7  -0.984   3.847  -3.526
   33   2HB   CYS   7          2HB       CYS   7  -1.429   5.416  -2.856
   34    H    THR   8           H        THR   8   0.367   6.160  -0.322
   35    HA   THR   8           HA       THR   8   1.504   8.662  -1.497
   36    HB   THR   8           HB       THR   8  -0.833   8.814  -0.629
   37    HG1  THR   8           HG1      THR   8   1.278  10.199   0.614
   38   1HG2  THR   8          1HG2      THR   8   0.164   8.592   2.168
   39   2HG2  THR   8          2HG2      THR   8  -0.074   7.087   1.280
   40   3HG2  THR   8          3HG2      THR   8  -1.422   8.202   1.505
   41    H    SER   9           H        SER   9   1.686   6.388   1.190
   42    HA   SER   9           HA       SER   9   4.079   7.860   2.205
   43   1HB   SER   9          1HB       SER   9   1.981   7.203   3.687
   44   2HB   SER   9          2HB       SER   9   2.778   5.634   3.736
   45    HG   SER   9           HG       SER   9   3.311   7.633   5.254
   46    H    ILE  10           H        ILE  10   4.772   5.282   3.687
   47    HA   ILE  10           HA       ILE  10   5.726   3.684   1.355
   48    HB   ILE  10           HB       ILE  10   7.432   4.445   3.743
   49   1HG1  ILE  10          1HG1      ILE  10   7.630   5.425   0.880
   50   2HG1  ILE  10          2HG1      ILE  10   6.875   6.350   2.177
   51   1HG2  ILE  10          1HG2      ILE  10   7.979   2.272   2.699
   52   2HG2  ILE  10          2HG2      ILE  10   9.245   3.462   2.392
   53   3HG2  ILE  10          3HG2      ILE  10   8.086   3.060   1.125
   54   1HD1  ILE  10          1HD1      ILE  10   9.150   5.877   3.429
   55   2HD1  ILE  10          2HD1      ILE  10   9.046   7.184   2.250
   56   3HD1  ILE  10          3HD1      ILE  10   9.764   5.639   1.792
   57    H    CYS  11           H        CYS  11   5.144   1.599   1.618
   58    HA   CYS  11           HA       CYS  11   4.597   0.610   4.387
   59   1HB   CYS  11          1HB       CYS  11   3.585  -0.290   1.677
   60   2HB   CYS  11          2HB       CYS  11   3.313  -1.203   3.159
   61    H    SER  12           H        SER  12   4.739  -2.095   3.974
   62    HA   SER  12           HA       SER  12   7.293  -2.733   2.654
   63   1HB   SER  12          1HB       SER  12   8.197  -2.120   4.771
   64   2HB   SER  12          2HB       SER  12   6.888  -2.910   5.642
   65    HG   SER  12           HG       SER  12   9.094  -4.011   4.301
   66    H    LEU  13           H        LEU  13   7.739  -5.184   3.156
   67    HA   LEU  13           HA       LEU  13   5.623  -6.699   2.081
   68   1HB   LEU  13          1HB       LEU  13   7.700  -7.845   3.957
   69   2HB   LEU  13          2HB       LEU  13   6.903  -8.651   2.605
   70    HG   LEU  13           HG       LEU  13   8.035  -6.430   1.406
   71   1HD1  LEU  13          1HD1      LEU  13  10.185  -7.582   3.177
   72   2HD1  LEU  13          2HD1      LEU  13   9.237  -6.191   3.705
   73   3HD1  LEU  13          3HD1      LEU  13  10.209  -6.089   2.237
   74   1HD2  LEU  13          1HD2      LEU  13   9.846  -8.201   0.755
   75   2HD2  LEU  13          2HD2      LEU  13   8.167  -8.504   0.307
   76   3HD2  LEU  13          3HD2      LEU  13   8.866  -9.311   1.711
   77    H    TYR  14           H        TYR  14   6.193  -5.664   5.314
   78    HA   TYR  14           HA       TYR  14   4.578  -7.552   6.722
   79   1HB   TYR  14          1HB       TYR  14   5.488  -4.746   7.212
   80   2HB   TYR  14          2HB       TYR  14   4.298  -5.468   8.291
   81    HD1  TYR  14           HD1      TYR  14   6.946  -7.348   6.507
   82    HD2  TYR  14           HD2      TYR  14   5.694  -5.660  10.256
   83    HE1  TYR  14           HE1      TYR  14   8.759  -8.581   7.670
   84    HE2  TYR  14           HE2      TYR  14   7.507  -6.893  11.418
   85    HH   TYR  14           HH       TYR  14   8.898  -9.333  10.584
   86    H    GLN  15           H        GLN  15   3.760  -4.208   5.879
   87    HA   GLN  15           HA       GLN  15   0.996  -4.382   6.364
   88   1HB   GLN  15          1HB       GLN  15   2.707  -2.654   4.636
   89   2HB   GLN  15          2HB       GLN  15   0.972  -2.643   4.315
   90   1HG   GLN  15          1HG       GLN  15   1.132  -2.506   7.095
   91   2HG   GLN  15          2HG       GLN  15   2.445  -1.463   6.543
   92   1HE2  GLN  15          1HE2      GLN  15   0.018  -0.450   7.791
   93   2HE2  GLN  15          2HE2      GLN  15  -0.797   0.484   6.632
   94    H    LEU  16           H        LEU  16   2.894  -5.525   3.688
   95    HA   LEU  16           HA       LEU  16   0.596  -6.114   1.984
   96   1HB   LEU  16          1HB       LEU  16   3.475  -7.076   1.881
   97   2HB   LEU  16          2HB       LEU  16   2.267  -7.385   0.633
   98    HG   LEU  16           HG       LEU  16   2.999  -4.599   1.561
   99   1HD1  LEU  16          1HD1      LEU  16   4.276  -4.513  -0.629
  100   2HD1  LEU  16          2HD1      LEU  16   4.108  -6.266  -0.714
  101   3HD1  LEU  16          3HD1      LEU  16   5.008  -5.530   0.612
  102   1HD2  LEU  16          1HD2      LEU  16   2.010  -4.101  -0.753
  103   2HD2  LEU  16          2HD2      LEU  16   0.868  -4.632   0.481
  104   3HD2  LEU  16          3HD2      LEU  16   1.428  -5.766  -0.747
  105    H    GLU  17           H        GLU  17   2.569  -7.801   4.375
  106    HA   GLU  17           HA       GLU  17   1.312 -10.390   3.855
  107   1HB   GLU  17          1HB       GLU  17   3.109  -9.338   6.049
  108   2HB   GLU  17          2HB       GLU  17   2.416 -10.959   6.107
  109   1HG   GLU  17          1HG       GLU  17   3.368 -11.065   3.621
  110   2HG   GLU  17          2HG       GLU  17   4.473  -9.842   4.249
  111    H    ASN  18           H        ASN  18   0.237  -7.558   5.274
  112    HA   ASN  18           HA       ASN  18  -1.322  -8.832   7.411
  113   1HB   ASN  18          1HB       ASN  18  -0.449  -6.214   6.861
  114   2HB   ASN  18          2HB       ASN  18  -2.206  -6.166   6.710
  115   1HD2  ASN  18          1HD2      ASN  18  -1.566  -4.765   8.832
  116   2HD2  ASN  18          2HD2      ASN  18  -1.679  -5.629  10.290
  117    H    TYR  19           H        TYR  19  -1.615  -8.643   4.092
  118    HA   TYR  19           HA       TYR  19  -4.595  -8.548   4.198
  119   1HB   TYR  19          1HB       TYR  19  -2.618  -8.193   1.938
  120   2HB   TYR  19          2HB       TYR  19  -4.345  -8.409   1.656
  121    HD1  TYR  19           HD1      TYR  19  -2.209  -5.932   1.401
  122    HD2  TYR  19           HD2      TYR  19  -5.512  -6.950   3.955
  123    HE1  TYR  19           HE1      TYR  19  -2.586  -3.527   1.873
  124    HE2  TYR  19           HE2      TYR  19  -5.888  -4.544   4.428
  125    HH   TYR  19           HH       TYR  19  -5.384  -2.338   3.227
  126    H    CYS  20           H        CYS  20  -2.081 -10.774   4.158
  127    HA   CYS  20           HA       CYS  20  -2.943 -12.724   2.293
  128   1HB   CYS  20          1HB       CYS  20  -1.957 -13.546   5.014
  129   2HB   CYS  20          2HB       CYS  20  -1.633 -14.290   3.452
  130    H    ASN  21           H        ASN  21  -3.727 -14.998   3.447
  131    HA   ASN  21           HA       ASN  21  -6.510 -14.479   4.113
  132   1HB   ASN  21          1HB       ASN  21  -5.696 -16.491   2.824
  133   2HB   ASN  21          2HB       ASN  21  -5.007 -17.103   4.329
  134   1HD2  ASN  21          1HD2      ASN  21  -6.578 -18.943   4.154
  135   2HD2  ASN  21          2HD2      ASN  21  -8.193 -18.707   4.621
  136   1H    PHE   1          1H        PHE   1  15.763  -3.535   1.256
  137   2H    PHE   1          2H        PHE   1  15.674  -5.147   0.726
  138   3H    PHE   1          3H        PHE   1  14.531  -4.549   1.832
  139    HA   PHE   1           HA       PHE   1  14.821  -3.307  -0.824
  140   1HB   PHE   1          1HB       PHE   1  12.753  -4.890  -1.304
  141   2HB   PHE   1          2HB       PHE   1  14.397  -5.463  -1.582
  142    HD1  PHE   1           HD1      PHE   1  12.290  -5.021   1.496
  143    HD2  PHE   1           HD2      PHE   1  14.622  -7.691  -0.933
  144    HE1  PHE   1           HE1      PHE   1  11.938  -6.835   3.152
  145    HE2  PHE   1           HE2      PHE   1  14.271  -9.504   0.722
  146    HZ   PHE   1           HZ       PHE   1  12.929  -9.077   2.766
  147    H    VAL   2           H        VAL   2  14.315  -1.793   1.322
  148    HA   VAL   2           HA       VAL   2  11.385  -1.735   1.769
  149    HB   VAL   2           HB       VAL   2  13.319  -1.374   3.554
  150   1HG1  VAL   2          1HG1      VAL   2  14.150   0.764   3.801
  151   2HG1  VAL   2          2HG1      VAL   2  12.767   1.507   2.999
  152   3HG1  VAL   2          3HG1      VAL   2  14.012   0.704   2.044
  153   1HG2  VAL   2          1HG2      VAL   2  10.581  -0.858   3.413
  154   2HG2  VAL   2          2HG2      VAL   2  11.273   0.621   4.080
  155   3HG2  VAL   2          3HG2      VAL   2  11.558  -0.924   4.882
  156    H    ASN   3           H        ASN   3  11.177   1.044   2.177
  157    HA   ASN   3           HA       ASN   3  10.527   2.926   0.923
  158   1HB   ASN   3          1HB       ASN   3  13.299   2.245   0.189
  159   2HB   ASN   3          2HB       ASN   3  12.459   3.229  -1.011
  160   1HD2  ASN   3          1HD2      ASN   3  11.609   3.415   2.416
  161   2HD2  ASN   3          2HD2      ASN   3  12.234   4.972   2.671
  162    H    GLN   4           H        GLN   4   8.698   1.682   0.020
  163    HA   GLN   4           HA       GLN   4   8.915   1.522  -2.922
  164   1HB   GLN   4          1HB       GLN   4   8.458  -0.806  -1.109
  165   2HB   GLN   4          2HB       GLN   4   7.512  -0.733  -2.597
  166   1HG   GLN   4          1HG       GLN   4   9.590  -0.471  -3.906
  167   2HG   GLN   4          2HG       GLN   4  10.535  -0.557  -2.418
  168   1HE2  GLN   4          1HE2      GLN   4   9.230  -2.451  -4.932
  169   2HE2  GLN   4          2HE2      GLN   4   9.381  -3.970  -4.191
  170    H    HIS   5           H        HIS   5   7.205   2.650  -3.680
  171    HA   HIS   5           HA       HIS   5   4.775   2.850  -1.962
  172   1HB   HIS   5          1HB       HIS   5   4.580   4.650  -4.147
  173   2HB   HIS   5          2HB       HIS   5   4.865   5.048  -2.455
  174    HD2  HIS   5           HD2      HIS   5   7.738   5.069  -1.773
  175    HE1  HIS   5           HE1      HIS   5   8.873   5.799  -5.779
  176    HE2  HIS   5           HE2      HIS   5   9.672   5.792  -3.356
  177    H    LEU   6           H        LEU   6   3.182   1.473  -2.560
  178    HA   LEU   6           HA       LEU   6   3.005   0.651  -5.417
  179   1HB   LEU   6          1HB       LEU   6   1.832  -0.500  -2.871
  180   2HB   LEU   6          2HB       LEU   6   1.365  -1.060  -4.476
  181    HG   LEU   6           HG       LEU   6   3.142  -2.491  -3.588
  182   1HD1  LEU   6          1HD1      LEU   6   4.353  -0.664  -5.674
  183   2HD1  LEU   6          2HD1      LEU   6   3.074  -1.821  -6.045
  184   3HD1  LEU   6          3HD1      LEU   6   4.635  -2.392  -5.457
  185   1HD2  LEU   6          1HD2      LEU   6   4.047  -0.240  -2.338
  186   2HD2  LEU   6          2HD2      LEU   6   5.188  -0.353  -3.677
  187   3HD2  LEU   6          3HD2      LEU   6   5.015  -1.698  -2.551
  188    H    CYS   7           H        CYS   7   0.732   0.541  -6.331
  189    HA   CYS   7           HA       CYS   7  -1.221   2.318  -5.023
  190   1HB   CYS   7          1HB       CYS   7  -0.127   2.950  -7.778
  191   2HB   CYS   7          2HB       CYS   7  -1.394   3.837  -6.930
  192    H    GLY   8           H        GLY   8  -2.758   0.695  -5.022
  193   1HA   GLY   8          1HA       GLY   8  -4.412  -0.726  -5.876
  194   2HA   GLY   8          2HA       GLY   8  -4.363   0.297  -7.311
  195    H    SER   9           H        SER   9  -3.610  -0.604  -9.160
  196    HA   SER   9           HA       SER   9  -3.244  -3.278  -9.626
  197   1HB   SER   9          1HB       SER   9  -2.136  -0.844 -10.947
  198   2HB   SER   9          2HB       SER   9  -1.468  -2.403 -11.422
  199    HG   SER   9           HG       SER   9  -3.301  -2.901 -12.345
  200    H    ASP  10           H        ASP  10  -0.529  -1.050  -8.897
  201    HA   ASP  10           HA       ASP  10   1.369  -3.229  -8.725
  202   1HB   ASP  10          1HB       ASP  10   1.597  -0.395  -7.677
  203   2HB   ASP  10          2HB       ASP  10   2.930  -1.526  -7.906
  204    H    LEU  11           H        LEU  11  -0.979  -2.006  -6.555
  205    HA   LEU  11           HA       LEU  11   0.444  -2.693  -4.111
  206   1HB   LEU  11          1HB       LEU  11  -2.146  -1.565  -4.820
  207   2HB   LEU  11          2HB       LEU  11  -2.282  -2.752  -3.523
  208    HG   LEU  11           HG       LEU  11  -0.229  -0.530  -3.503
  209   1HD1  LEU  11          1HD1      LEU  11  -3.062  -0.339  -3.149
  210   2HD1  LEU  11          2HD1      LEU  11  -1.848   0.920  -2.928
  211   3HD1  LEU  11          3HD1      LEU  11  -2.294  -0.121  -1.578
  212   1HD2  LEU  11          1HD2      LEU  11   0.280  -2.441  -2.062
  213   2HD2  LEU  11          2HD2      LEU  11  -1.344  -2.386  -1.376
  214   3HD2  LEU  11          3HD2      LEU  11  -0.211  -1.072  -1.066
  215    H    VAL  12           H        VAL  12  -2.039  -4.247  -6.092
  216    HA   VAL  12           HA       VAL  12  -2.169  -6.604  -4.408
  217    HB   VAL  12           HB       VAL  12  -4.062  -6.075  -5.854
  218   1HG1  VAL  12          1HG1      VAL  12  -1.949  -6.194  -8.006
  219   2HG1  VAL  12          2HG1      VAL  12  -3.096  -4.897  -7.665
  220   3HG1  VAL  12          3HG1      VAL  12  -3.658  -6.404  -8.389
  221   1HG2  VAL  12          1HG2      VAL  12  -4.030  -8.265  -7.287
  222   2HG2  VAL  12          2HG2      VAL  12  -3.969  -8.401  -5.529
  223   3HG2  VAL  12          3HG2      VAL  12  -2.492  -8.570  -6.478
  224    H    GLU  13           H        GLU  13  -0.289  -5.595  -7.176
  225    HA   GLU  13           HA       GLU  13   0.859  -8.130  -7.825
  226   1HB   GLU  13          1HB       GLU  13   1.129  -5.586  -8.822
  227   2HB   GLU  13          2HB       GLU  13   2.670  -5.798  -7.988
  228   1HG   GLU  13          1HG       GLU  13   3.317  -7.574  -9.338
  229   2HG   GLU  13          2HG       GLU  13   1.655  -8.018  -9.727
  230    H    ALA  14           H        ALA  14   1.401  -5.805  -5.277
  231    HA   ALA  14           HA       ALA  14   3.865  -7.102  -4.348
  232   1HB   ALA  14          1HB       ALA  14   2.874  -5.491  -2.285
  233   2HB   ALA  14          2HB       ALA  14   2.385  -4.658  -3.761
  234   3HB   ALA  14          3HB       ALA  14   4.087  -5.024  -3.478
  235    H    LEU  15           H        LEU  15   0.468  -7.512  -3.986
  236    HA   LEU  15           HA       LEU  15   0.781  -8.982  -1.431
  237   1HB   LEU  15          1HB       LEU  15  -1.554  -8.034  -3.066
  238   2HB   LEU  15          2HB       LEU  15  -1.782  -9.352  -1.916
  239    HG   LEU  15           HG       LEU  15  -0.521  -6.699  -1.181
  240   1HD1  LEU  15          1HD1      LEU  15  -2.573  -5.813  -0.779
  241   2HD1  LEU  15          2HD1      LEU  15  -3.203  -7.336  -0.146
  242   3HD1  LEU  15          3HD1      LEU  15  -3.160  -7.055  -1.887
  243   1HD2  LEU  15          1HD2      LEU  15   0.047  -8.631   0.259
  244   2HD2  LEU  15          2HD2      LEU  15  -1.671  -8.971   0.474
  245   3HD2  LEU  15          3HD2      LEU  15  -0.980  -7.480   1.115
  246    H    TYR  16           H        TYR  16   0.327  -9.460  -4.834
  247    HA   TYR  16           HA       TYR  16  -0.344 -12.289  -4.640
  248   1HB   TYR  16          1HB       TYR  16  -1.134 -11.534  -6.657
  249   2HB   TYR  16          2HB       TYR  16   0.092 -10.278  -6.777
  250    HD1  TYR  16           HD1      TYR  16  -0.797 -13.724  -7.639
  251    HD2  TYR  16           HD2      TYR  16   2.372 -10.820  -7.608
  252    HE1  TYR  16           HE1      TYR  16   0.501 -15.121  -9.227
  253    HE2  TYR  16           HE2      TYR  16   3.667 -12.215  -9.197
  254    HH   TYR  16           HH       TYR  16   3.495 -15.077  -9.690
  255    H    LEU  17           H        LEU  17   2.545 -10.406  -4.568
  256    HA   LEU  17           HA       LEU  17   4.189 -12.819  -5.147
  257   1HB   LEU  17          1HB       LEU  17   4.876 -10.941  -6.473
  258   2HB   LEU  17          2HB       LEU  17   4.852  -9.869  -5.072
  259    HG   LEU  17           HG       LEU  17   6.566 -12.190  -4.646
  260   1HD1  LEU  17          1HD1      LEU  17   8.320 -10.947  -6.242
  261   2HD1  LEU  17          2HD1      LEU  17   6.847 -10.567  -7.133
  262   3HD1  LEU  17          3HD1      LEU  17   7.287 -12.248  -6.834
  263   1HD2  LEU  17          1HD2      LEU  17   6.368  -9.861  -3.461
  264   2HD2  LEU  17          2HD2      LEU  17   7.417  -9.304  -4.764
  265   3HD2  LEU  17          3HD2      LEU  17   7.967 -10.577  -3.673
  266    H    VAL  18           H        VAL  18   3.114 -10.790  -2.604
  267    HA   VAL  18           HA       VAL  18   5.316 -11.463  -0.789
  268    HB   VAL  18           HB       VAL  18   2.734  -9.937  -0.538
  269   1HG1  VAL  18          1HG1      VAL  18   3.252  -9.622   1.884
  270   2HG1  VAL  18          2HG1      VAL  18   4.514 -10.845   1.746
  271   3HG1  VAL  18          3HG1      VAL  18   2.826 -11.289   1.495
  272   1HG2  VAL  18          1HG2      VAL  18   5.405  -9.044   0.476
  273   2HG2  VAL  18          2HG2      VAL  18   4.110  -8.095  -0.254
  274   3HG2  VAL  18          3HG2      VAL  18   5.152  -9.092  -1.269
  275    H    CYS  19           H        CYS  19   1.825 -12.064  -0.714
  276    HA   CYS  19           HA       CYS  19   2.368 -14.567   0.810
  277   1HB   CYS  19          1HB       CYS  19   0.221 -12.538   0.885
  278   2HB   CYS  19          2HB       CYS  19  -0.330 -14.209   0.997
  279    H    GLY  20           H        GLY  20   2.607 -14.321  -2.107
  280   1HA   GLY  20          1HA       GLY  20   0.275 -15.411  -3.388
  281   2HA   GLY  20          2HA       GLY  20   1.912 -15.462  -4.043
  282    H    GLU  21           H        GLU  21   0.231 -16.953  -1.239
  283    HA   GLU  21           HA       GLU  21   0.284 -19.611  -2.143
  284   1HB   GLU  21          1HB       GLU  21   2.745 -19.368  -2.230
  285   2HB   GLU  21          2HB       GLU  21   2.756 -18.918  -0.525
  286   1HG   GLU  21          1HG       GLU  21   1.570 -21.142  -0.081
  287   2HG   GLU  21          2HG       GLU  21   1.983 -21.576  -1.740
  288    H    ARG  22           H        ARG  22   1.133 -17.732   0.791
  289    HA   ARG  22           HA       ARG  22  -0.021 -19.565   2.651
  290   1HB   ARG  22          1HB       ARG  22   0.240 -16.550   2.890
  291   2HB   ARG  22          2HB       ARG  22  -0.039 -17.667   4.226
  292   1HG   ARG  22          1HG       ARG  22   2.105 -18.772   3.783
  293   2HG   ARG  22          2HG       ARG  22   2.381 -17.717   2.398
  294   1HD   ARG  22          1HD       ARG  22   3.616 -16.859   4.319
  295   2HD   ARG  22          2HD       ARG  22   2.304 -15.748   3.928
  296    HE   ARG  22           HE       ARG  22   1.081 -17.212   5.805
  297   1HH1  ARG  22          1HH1      ARG  22   4.043 -18.093   6.373
  298   2HH1  ARG  22          2HH1      ARG  22   4.372 -17.107   7.760
  299   1HH2  ARG  22          1HH2      ARG  22   1.621 -15.054   7.285
  300   2HH2  ARG  22          2HH2      ARG  22   3.002 -15.389   8.274
  301    H    GLY  23           H        GLY  23  -1.408 -16.801   0.910
  302   1HA   GLY  23          1HA       GLY  23  -3.974 -17.762   0.558
  303   2HA   GLY  23          2HA       GLY  23  -4.016 -17.073   2.183
  304    H    PHE  24           H        PHE  24  -5.569 -15.491   1.241
  305    HA   PHE  24           HA       PHE  24  -4.304 -13.007   0.637
  306   1HB   PHE  24          1HB       PHE  24  -4.068 -14.420  -1.557
  307   2HB   PHE  24          2HB       PHE  24  -5.779 -14.062  -1.768
  308    HD1  PHE  24           HD1      PHE  24  -4.085 -13.091  -3.839
  309    HD2  PHE  24           HD2      PHE  24  -4.846 -11.326   0.006
  310    HE1  PHE  24           HE1      PHE  24  -3.508 -10.857  -4.750
  311    HE2  PHE  24           HE2      PHE  24  -4.269  -9.091  -0.909
  312    HZ   PHE  24           HZ       PHE  24  -3.601  -8.859  -3.286
  313    H    PHE  25           H        PHE  25  -5.729 -11.661   1.607
  314    HA   PHE  25           HA       PHE  25  -8.647 -12.123   1.135
  315   1HB   PHE  25          1HB       PHE  25  -7.909 -12.763   3.454
  316   2HB   PHE  25          2HB       PHE  25  -7.405 -11.091   3.699
  317    HD1  PHE  25           HD1      PHE  25 -10.337 -13.256   2.925
  318    HD2  PHE  25           HD2      PHE  25  -8.986  -9.382   4.205
  319    HE1  PHE  25           HE1      PHE  25 -12.668 -12.635   3.509
  320    HE2  PHE  25           HE2      PHE  25 -11.316  -8.762   4.789
  321    HZ   PHE  25           HZ       PHE  25 -13.156 -10.389   4.442
  322    H    TYR  26           H        TYR  26  -8.024 -10.500  -0.648
  323    HA   TYR  26           HA       TYR  26  -8.065  -7.728   0.481
  324   1HB   TYR  26          1HB       TYR  26  -6.032  -8.463  -0.916
  325   2HB   TYR  26          2HB       TYR  26  -7.127  -8.454  -2.298
  326    HD1  TYR  26           HD1      TYR  26  -6.660  -6.228   0.694
  327    HD2  TYR  26           HD2      TYR  26  -6.870  -6.535  -3.587
  328    HE1  TYR  26           HE1      TYR  26  -6.401  -3.767   0.505
  329    HE2  TYR  26           HE2      TYR  26  -6.611  -4.076  -3.777
  330    HH   TYR  26           HH       TYR  26  -6.690  -1.998  -0.950
  331    H    THR  27           H        THR  27  -9.875  -6.555   0.009
  332    HA   THR  27           HA       THR  27 -11.391  -7.085  -2.457
  333    HB   THR  27           HB       THR  27 -12.179  -8.711  -0.642
  334    HG1  THR  27           HG1      THR  27 -13.804  -6.870  -2.006
  335   1HG2  THR  27          1HG2      THR  27 -12.205  -6.431   0.917
  336   2HG2  THR  27          2HG2      THR  27 -13.012  -7.947   1.316
  337   3HG2  THR  27          3HG2      THR  27 -13.909  -6.653   0.522
  338    H    LYS  28           H        LYS  28  -9.975  -4.893  -0.777
  339    HA   LYS  28           HA       LYS  28 -10.236  -2.554  -0.672
  340   1HB   LYS  28          1HB       LYS  28 -11.546  -2.971  -2.852
  341   2HB   LYS  28          2HB       LYS  28 -12.996  -2.909  -1.849
  342   1HG   LYS  28          1HG       LYS  28 -12.423  -0.664  -1.085
  343   2HG   LYS  28          2HG       LYS  28 -10.898  -0.724  -1.971
  344   1HD   LYS  28          1HD       LYS  28 -11.895  -0.275  -3.962
  345   2HD   LYS  28          2HD       LYS  28 -13.277  -1.315  -3.611
  346   1HE   LYS  28          1HE       LYS  28 -14.230   0.834  -3.622
  347   2HE   LYS  28          2HE       LYS  28 -13.942   0.537  -1.907
  348   1HZ   LYS  28          1HZ       LYS  28 -11.731   1.660  -2.266
  349   2HZ   LYS  28          2HZ       LYS  28 -13.098   2.666  -2.342
  350   3HZ   LYS  28          3HZ       LYS  28 -12.324   2.171  -3.770
  351    HA   PRO  29           HA       PRO  29 -12.962  -3.480   2.978
  352   1HB   PRO  29          1HB       PRO  29 -10.948  -3.414   4.849
  353   2HB   PRO  29          2HB       PRO  29 -11.462  -4.888   4.013
  354   1HG   PRO  29          1HG       PRO  29  -9.008  -3.249   3.582
  355   2HG   PRO  29          2HG       PRO  29  -9.272  -4.974   3.280
  356   1HD   PRO  29          1HD       PRO  29  -9.269  -2.933   1.321
  357   2HD   PRO  29          2HD       PRO  29  -9.865  -4.592   1.098
  358    H    THR  30           H        THR  30 -11.305  -0.972   1.672
  359    HA   THR  30           HA       THR  30 -11.302   1.325   2.087
  360    HB   THR  30           HB       THR  30 -13.690   0.302   3.230
  361    HG1  THR  30           HG1      THR  30 -13.253   3.039   2.995
  362   1HG2  THR  30          1HG2      THR  30 -14.107   1.708   5.142
  363   2HG2  THR  30          2HG2      THR  30 -12.555   2.521   4.951
  364   3HG2  THR  30          3HG2      THR  30 -12.609   0.833   5.456
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1 -15.463   2.677  -3.219
    2   2H    GLY   1          2H        GLY   1 -14.935   2.369  -1.633
    3   3H    GLY   1          3H        GLY   1 -14.689   1.211  -2.853
    4   1HA   GLY   1          1HA       GLY   1 -12.636   2.341  -2.593
    5   2HA   GLY   1          2HA       GLY   1 -13.310   2.956  -4.132
    6    H    GLY   2           H        GLY   2 -11.668   4.642  -3.545
    7   1HA   GLY   2          1HA       GLY   2 -11.671   6.812  -2.217
    8   2HA   GLY   2          2HA       GLY   2 -11.753   5.789  -0.781
    9    H    GLY   3           H        GLY   3  -9.918   3.802  -2.139
   10   1HA   GLY   3          1HA       GLY   3  -7.490   4.449  -2.997
   11   2HA   GLY   3          2HA       GLY   3  -7.403   5.192  -1.400
   12    H    GLU   4           H        GLU   4  -6.469   3.901   0.104
   13    HA   GLU   4           HA       GLU   4  -7.212   1.378   0.911
   14   1HB   GLU   4          1HB       GLU   4  -5.958   1.236  -1.676
   15   2HB   GLU   4          2HB       GLU   4  -4.912   0.458  -0.489
   16   1HG   GLU   4          1HG       GLU   4  -6.435  -1.194  -0.017
   17   2HG   GLU   4          2HG       GLU   4  -7.823  -0.148  -0.319
   18    H    GLN   5           H        GLN   5  -5.545   0.394   2.325
   19    HA   GLN   5           HA       GLN   5  -3.845   2.464   3.482
   20   1HB   GLN   5          1HB       GLN   5  -5.156   0.424   4.581
   21   2HB   GLN   5          2HB       GLN   5  -3.622  -0.398   4.288
   22   1HG   GLN   5          1HG       GLN   5  -2.488   1.587   5.422
   23   2HG   GLN   5          2HG       GLN   5  -4.100   2.101   5.925
   24   1HE2  GLN   5          1HE2      GLN   5  -5.406   0.279   7.100
   25   2HE2  GLN   5          2HE2      GLN   5  -4.529  -0.712   8.164
   26    H    CYS   6           H        CYS   6  -2.669   2.630   1.340
   27    HA   CYS   6           HA       CYS   6  -0.026   1.876   1.419
   28   1HB   CYS   6          1HB       CYS   6  -1.737  -0.370   0.513
   29   2HB   CYS   6          2HB       CYS   6  -0.362  -0.021  -0.529
   30    H    CYS   7           H        CYS   7  -2.883   2.465  -0.449
   31    HA   CYS   7           HA       CYS   7  -1.549   3.103  -2.944
   32   1HB   CYS   7          1HB       CYS   7  -3.898   2.446  -2.956
   33   2HB   CYS   7          2HB       CYS   7  -4.305   3.755  -1.856
   34    H    THR   8           H        THR   8  -0.263   4.867  -3.150
   35    HA   THR   8           HA       THR   8   0.301   7.160  -3.130
   36    HB   THR   8           HB       THR   8  -2.368   7.327  -2.593
   37    HG1  THR   8           HG1      THR   8  -0.504   8.874  -3.394
   38   1HG2  THR   8          1HG2      THR   8  -1.497   7.216  -0.052
   39   2HG2  THR   8          2HG2      THR   8  -2.882   8.197  -0.528
   40   3HG2  THR   8          3HG2      THR   8  -1.299   8.947  -0.331
   41    H    SER   9           H        SER   9   0.428   4.906  -0.772
   42    HA   SER   9           HA       SER   9   1.950   6.691   1.085
   43   1HB   SER   9          1HB       SER   9  -0.115   5.485   1.992
   44   2HB   SER   9          2HB       SER   9   0.776   3.983   1.764
   45    HG   SER   9           HG       SER   9   1.119   6.022   3.609
   46    H    ILE  10           H        ILE  10   2.907   4.028   2.326
   47    HA   ILE  10           HA       ILE  10   4.699   3.076   0.168
   48    HB   ILE  10           HB       ILE  10   5.777   4.063   2.822
   49   1HG1  ILE  10          1HG1      ILE  10   5.827   5.380   0.086
   50   2HG1  ILE  10          2HG1      ILE  10   4.923   5.952   1.489
   51   1HG2  ILE  10          1HG2      ILE  10   6.828   2.331   0.883
   52   2HG2  ILE  10          2HG2      ILE  10   7.730   3.146   2.161
   53   3HG2  ILE  10          3HG2      ILE  10   7.601   3.884   0.564
   54   1HD1  ILE  10          1HD1      ILE  10   7.379   5.766   2.595
   55   2HD1  ILE  10          2HD1      ILE  10   6.805   7.229   1.795
   56   3HD1  ILE  10          3HD1      ILE  10   7.840   6.096   0.925
   57    H    CYS  11           H        CYS  11   3.717   2.800   3.577
   58    HA   CYS  11           HA       CYS  11   3.787   0.932   5.017
   59   1HB   CYS  11          1HB       CYS  11   2.712  -1.120   3.578
   60   2HB   CYS  11          2HB       CYS  11   1.770   0.159   4.333
   61    H    SER  12           H        SER  12   4.117  -1.780   4.578
   62    HA   SER  12           HA       SER  12   6.781  -1.991   3.244
   63   1HB   SER  12          1HB       SER  12   7.397  -1.860   5.537
   64   2HB   SER  12          2HB       SER  12   6.041  -2.843   6.040
   65    HG   SER  12           HG       SER  12   8.097  -3.949   5.943
   66    H    LEU  13           H        LEU  13   7.418  -4.358   3.164
   67    HA   LEU  13           HA       LEU  13   5.375  -5.852   1.819
   68   1HB   LEU  13          1HB       LEU  13   8.191  -6.215   2.524
   69   2HB   LEU  13          2HB       LEU  13   7.271  -7.714   2.674
   70    HG   LEU  13           HG       LEU  13   6.287  -7.089   0.361
   71   1HD1  LEU  13          1HD1      LEU  13   8.155  -5.809  -0.946
   72   2HD1  LEU  13          2HD1      LEU  13   8.608  -5.196   0.644
   73   3HD1  LEU  13          3HD1      LEU  13   6.996  -4.882   0.005
   74   1HD2  LEU  13          1HD2      LEU  13   7.606  -8.905   0.021
   75   2HD2  LEU  13          2HD2      LEU  13   8.844  -8.312   1.129
   76   3HD2  LEU  13          3HD2      LEU  13   8.818  -7.754  -0.543
   77    H    TYR  14           H        TYR  14   6.089  -5.260   5.082
   78    HA   TYR  14           HA       TYR  14   5.020  -7.735   6.176
   79   1HB   TYR  14          1HB       TYR  14   5.880  -5.086   7.175
   80   2HB   TYR  14          2HB       TYR  14   4.758  -5.985   8.188
   81    HD1  TYR  14           HD1      TYR  14   8.174  -5.696   7.029
   82    HD2  TYR  14           HD2      TYR  14   5.343  -8.368   8.845
   83    HE1  TYR  14           HE1      TYR  14  10.039  -7.138   7.813
   84    HE2  TYR  14           HE2      TYR  14   7.205  -9.810   9.632
   85    HH   TYR  14           HH       TYR  14  10.235  -9.711   8.435
   86    H    GLN  15           H        GLN  15   3.825  -4.403   6.084
   87    HA   GLN  15           HA       GLN  15   1.207  -4.915   6.993
   88   1HB   GLN  15          1HB       GLN  15   2.476  -2.797   5.320
   89   2HB   GLN  15          2HB       GLN  15   0.716  -2.908   5.265
   90   1HG   GLN  15          1HG       GLN  15   0.743  -2.907   7.804
   91   2HG   GLN  15          2HG       GLN  15   2.457  -2.502   7.709
   92   1HE2  GLN  15          1HE2      GLN  15   2.556  -0.295   8.228
   93   2HE2  GLN  15          2HE2      GLN  15   1.604   0.907   7.501
   94    H    LEU  16           H        LEU  16   2.714  -5.496   3.924
   95    HA   LEU  16           HA       LEU  16   0.228  -6.026   2.497
   96   1HB   LEU  16          1HB       LEU  16   3.081  -6.820   1.825
   97   2HB   LEU  16          2HB       LEU  16   1.706  -6.892   0.724
   98    HG   LEU  16           HG       LEU  16   2.447  -4.314   2.094
   99   1HD1  LEU  16          1HD1      LEU  16   4.294  -4.063   0.833
  100   2HD1  LEU  16          2HD1      LEU  16   3.380  -4.432  -0.630
  101   3HD1  LEU  16          3HD1      LEU  16   4.118  -5.735   0.302
  102   1HD2  LEU  16          1HD2      LEU  16   1.466  -3.567  -0.234
  103   2HD2  LEU  16          2HD2      LEU  16   0.371  -4.090   1.045
  104   3HD2  LEU  16          3HD2      LEU  16   0.797  -5.198  -0.258
  105    H    GLU  17           H        GLU  17   2.611  -7.909   4.332
  106    HA   GLU  17           HA       GLU  17   1.372 -10.454   3.545
  107   1HB   GLU  17          1HB       GLU  17   2.986 -11.507   4.924
  108   2HB   GLU  17          2HB       GLU  17   3.830 -10.107   4.265
  109   1HG   GLU  17          1HG       GLU  17   4.261  -9.436   6.369
  110   2HG   GLU  17          2HG       GLU  17   2.530  -9.214   6.617
  111    H    ASN  18           H        ASN  18   0.506  -7.967   5.604
  112    HA   ASN  18           HA       ASN  18  -0.723  -9.682   7.654
  113   1HB   ASN  18          1HB       ASN  18  -0.571  -6.713   7.166
  114   2HB   ASN  18          2HB       ASN  18  -1.712  -7.373   8.340
  115   1HD2  ASN  18          1HD2      ASN  18  -0.466  -9.234   9.766
  116   2HD2  ASN  18          2HD2      ASN  18   1.013  -8.706  10.411
  117    H    TYR  19           H        TYR  19  -1.465  -8.931   4.529
  118    HA   TYR  19           HA       TYR  19  -4.375  -8.640   4.987
  119   1HB   TYR  19          1HB       TYR  19  -2.694  -8.535   2.472
  120   2HB   TYR  19          2HB       TYR  19  -4.450  -8.385   2.487
  121    HD1  TYR  19           HD1      TYR  19  -3.398  -7.022   5.512
  122    HD2  TYR  19           HD2      TYR  19  -3.414  -6.153   1.302
  123    HE1  TYR  19           HE1      TYR  19  -3.190  -4.599   6.012
  124    HE2  TYR  19           HE2      TYR  19  -3.207  -3.731   1.803
  125    HH   TYR  19           HH       TYR  19  -2.150  -2.411   4.103
  126    H    CYS  20           H        CYS  20  -2.015 -10.984   3.911
  127    HA   CYS  20           HA       CYS  20  -3.882 -12.766   2.638
  128   1HB   CYS  20          1HB       CYS  20  -1.438 -13.784   4.047
  129   2HB   CYS  20          2HB       CYS  20  -2.149 -14.329   2.532
  130    H    ASN  21           H        ASN  21  -3.813 -15.171   3.742
  131    HA   ASN  21           HA       ASN  21  -4.546 -14.934   6.609
  132   1HB   ASN  21          1HB       ASN  21  -6.523 -14.864   4.692
  133   2HB   ASN  21          2HB       ASN  21  -6.441 -16.584   5.077
  134   1HD2  ASN  21          1HD2      ASN  21  -6.467 -17.081   7.542
  135   2HD2  ASN  21          2HD2      ASN  21  -7.442 -16.089   8.516
  136   1H    PHE   1          1H        PHE   1  13.246  -3.493   1.523
  137   2H    PHE   1          2H        PHE   1  12.928  -2.086   2.420
  138   3H    PHE   1          3H        PHE   1  14.407  -2.259   1.600
  139    HA   PHE   1           HA       PHE   1  13.274  -2.209  -0.529
  140   1HB   PHE   1          1HB       PHE   1  10.946  -2.411   1.286
  141   2HB   PHE   1          2HB       PHE   1  10.757  -1.270  -0.044
  142    HD1  PHE   1           HD1      PHE   1  12.360  -4.648   0.395
  143    HD2  PHE   1           HD2      PHE   1   9.699  -2.175  -1.901
  144    HE1  PHE   1           HE1      PHE   1  11.969  -6.528  -1.172
  145    HE2  PHE   1           HE2      PHE   1   9.307  -4.057  -3.470
  146    HZ   PHE   1           HZ       PHE   1  10.440  -6.233  -3.105
  147    H    VAL   2           H        VAL   2  12.688  -0.087  -1.514
  148    HA   VAL   2           HA       VAL   2  13.720   2.119   0.172
  149    HB   VAL   2           HB       VAL   2  14.368   1.510  -2.334
  150   1HG1  VAL   2          1HG1      VAL   2  12.435   3.673  -2.992
  151   2HG1  VAL   2          2HG1      VAL   2  11.783   2.043  -2.827
  152   3HG1  VAL   2          3HG1      VAL   2  13.053   2.368  -4.006
  153   1HG2  VAL   2          1HG2      VAL   2  14.585   3.781  -0.660
  154   2HG2  VAL   2          2HG2      VAL   2  14.189   4.381  -2.270
  155   3HG2  VAL   2          3HG2      VAL   2  15.608   3.360  -2.034
  156    H    ASN   3           H        ASN   3  12.451   4.220  -1.199
  157    HA   ASN   3           HA       ASN   3   9.863   4.204   0.201
  158   1HB   ASN   3          1HB       ASN   3   9.780   6.594  -0.833
  159   2HB   ASN   3          2HB       ASN   3  10.961   6.269   0.437
  160   1HD2  ASN   3          1HD2      ASN   3  10.733   7.784  -2.490
  161   2HD2  ASN   3          2HD2      ASN   3  12.326   7.588  -3.045
  162    H    GLN   4           H        GLN   4   8.887   2.530  -1.199
  163    HA   GLN   4           HA       GLN   4   8.113   3.571  -3.890
  164   1HB   GLN   4          1HB       GLN   4   9.234   1.349  -3.864
  165   2HB   GLN   4          2HB       GLN   4   7.954   0.736  -2.815
  166   1HG   GLN   4          1HG       GLN   4   6.285   1.114  -4.522
  167   2HG   GLN   4          2HG       GLN   4   7.452   1.948  -5.547
  168   1HE2  GLN   4          1HE2      GLN   4   7.172  -1.242  -3.866
  169   2HE2  GLN   4          2HE2      GLN   4   7.824  -2.138  -5.152
  170    H    HIS   5           H        HIS   5   5.804   3.038  -4.519
  171    HA   HIS   5           HA       HIS   5   3.975   2.838  -2.175
  172   1HB   HIS   5          1HB       HIS   5   3.246   4.814  -4.284
  173   2HB   HIS   5          2HB       HIS   5   2.903   4.842  -2.557
  174    HD2  HIS   5           HD2      HIS   5   4.444   6.693  -1.265
  175    HE1  HIS   5           HE1      HIS   5   7.692   6.750  -3.972
  176    HE2  HIS   5           HE2      HIS   5   6.745   7.769  -1.833
  177    H    LEU   6           H        LEU   6   1.820   2.115  -2.768
  178    HA   LEU   6           HA       LEU   6   1.686   0.931  -5.519
  179   1HB   LEU   6          1HB       LEU   6   0.461  -0.144  -2.952
  180   2HB   LEU   6          2HB       LEU   6   0.334  -0.885  -4.548
  181    HG   LEU   6           HG       LEU   6   2.085  -2.045  -3.398
  182   1HD1  LEU   6          1HD1      LEU   6   2.573  -1.472  -5.749
  183   2HD1  LEU   6          2HD1      LEU   6   4.053  -1.504  -4.788
  184   3HD1  LEU   6          3HD1      LEU   6   3.318   0.038  -5.226
  185   1HD2  LEU   6          1HD2      LEU   6   2.370   0.227  -1.922
  186   2HD2  LEU   6          2HD2      LEU   6   3.791   0.340  -2.960
  187   3HD2  LEU   6          3HD2      LEU   6   3.555  -1.079  -1.940
  188    H    CYS   7           H        CYS   7  -1.020   0.242  -5.435
  189    HA   CYS   7           HA       CYS   7  -2.810   2.144  -4.397
  190   1HB   CYS   7          1HB       CYS   7  -1.289   3.106  -6.731
  191   2HB   CYS   7          2HB       CYS   7  -3.036   3.278  -6.885
  192    H    GLY   8           H        GLY   8  -2.154   0.681  -7.603
  193   1HA   GLY   8          1HA       GLY   8  -4.791  -0.707  -7.344
  194   2HA   GLY   8          2HA       GLY   8  -4.313   0.053  -8.864
  195    H    SER   9           H        SER   9  -3.254  -1.229 -10.303
  196    HA   SER   9           HA       SER   9  -2.836  -3.983  -9.918
  197   1HB   SER   9          1HB       SER   9  -1.923  -1.964 -11.889
  198   2HB   SER   9          2HB       SER   9  -0.949  -3.428 -11.794
  199    HG   SER   9           HG       SER   9  -3.247  -4.415 -11.783
  200    H    ASP  10           H        ASP  10  -0.914  -1.299  -8.865
  201    HA   ASP  10           HA       ASP  10   1.521  -2.877  -8.483
  202   1HB   ASP  10          1HB       ASP  10   0.992  -0.171  -8.656
  203   2HB   ASP  10          2HB       ASP  10   1.286  -0.395  -6.932
  204    H    LEU  11           H        LEU  11  -1.342  -2.140  -6.670
  205    HA   LEU  11           HA       LEU  11  -0.207  -2.772  -4.070
  206   1HB   LEU  11          1HB       LEU  11  -2.751  -1.878  -5.101
  207   2HB   LEU  11          2HB       LEU  11  -2.991  -3.230  -3.994
  208    HG   LEU  11           HG       LEU  11  -1.225  -0.873  -3.308
  209   1HD1  LEU  11          1HD1      LEU  11  -3.913  -1.095  -2.081
  210   2HD1  LEU  11          2HD1      LEU  11  -3.889  -0.597  -3.773
  211   3HD1  LEU  11          3HD1      LEU  11  -3.011   0.341  -2.565
  212   1HD2  LEU  11          1HD2      LEU  11  -2.589  -3.052  -1.692
  213   2HD2  LEU  11          2HD2      LEU  11  -1.702  -1.698  -0.991
  214   3HD2  LEU  11          3HD2      LEU  11  -0.857  -2.888  -1.980
  215    H    VAL  12           H        VAL  12  -2.162  -4.515  -6.441
  216    HA   VAL  12           HA       VAL  12  -2.166  -6.971  -4.887
  217    HB   VAL  12           HB       VAL  12  -3.968  -6.723  -6.448
  218   1HG1  VAL  12          1HG1      VAL  12  -1.765  -5.831  -8.247
  219   2HG1  VAL  12          2HG1      VAL  12  -3.396  -5.185  -8.061
  220   3HG1  VAL  12          3HG1      VAL  12  -3.131  -6.656  -8.997
  221   1HG2  VAL  12          1HG2      VAL  12  -3.887  -8.812  -7.389
  222   2HG2  VAL  12          2HG2      VAL  12  -2.415  -8.946  -6.427
  223   3HG2  VAL  12          3HG2      VAL  12  -2.316  -8.525  -8.137
  224    H    GLU  13           H        GLU  13  -0.091  -5.478  -7.234
  225    HA   GLU  13           HA       GLU  13   1.427  -7.815  -7.950
  226   1HB   GLU  13          1HB       GLU  13   1.466  -5.443  -9.025
  227   2HB   GLU  13          2HB       GLU  13   2.607  -5.042  -7.740
  228   1HG   GLU  13          1HG       GLU  13   3.700  -7.360  -8.573
  229   2HG   GLU  13          2HG       GLU  13   2.950  -6.844 -10.083
  230    H    ALA  14           H        ALA  14   1.456  -5.561  -5.246
  231    HA   ALA  14           HA       ALA  14   3.911  -6.748  -4.127
  232   1HB   ALA  14          1HB       ALA  14   2.166  -5.006  -2.462
  233   2HB   ALA  14          2HB       ALA  14   2.866  -4.264  -3.901
  234   3HB   ALA  14          3HB       ALA  14   3.916  -4.970  -2.672
  235    H    LEU  15           H        LEU  15   0.508  -7.301  -4.043
  236    HA   LEU  15           HA       LEU  15   0.675  -8.753  -1.467
  237   1HB   LEU  15          1HB       LEU  15  -1.531  -7.862  -3.277
  238   2HB   LEU  15          2HB       LEU  15  -1.821  -9.261  -2.243
  239    HG   LEU  15           HG       LEU  15  -0.601  -6.793  -1.053
  240   1HD1  LEU  15          1HD1      LEU  15  -3.563  -7.070  -0.969
  241   2HD1  LEU  15          2HD1      LEU  15  -2.868  -6.478  -2.478
  242   3HD1  LEU  15          3HD1      LEU  15  -2.569  -5.614  -0.970
  243   1HD2  LEU  15          1HD2      LEU  15  -0.876  -9.030   0.145
  244   2HD2  LEU  15          2HD2      LEU  15  -2.617  -8.761   0.059
  245   3HD2  LEU  15          3HD2      LEU  15  -1.596  -7.640   0.959
  246    H    TYR  16           H        TYR  16   0.213  -9.301  -4.892
  247    HA   TYR  16           HA       TYR  16  -0.151 -12.165  -4.682
  248   1HB   TYR  16          1HB       TYR  16  -0.993 -11.220  -6.670
  249   2HB   TYR  16          2HB       TYR  16   0.446 -10.232  -6.918
  250    HD1  TYR  16           HD1      TYR  16  -0.799 -13.754  -6.931
  251    HD2  TYR  16           HD2      TYR  16   2.283 -11.030  -8.179
  252    HE1  TYR  16           HE1      TYR  16   0.189 -15.524  -8.363
  253    HE2  TYR  16           HE2      TYR  16   3.270 -12.801  -9.609
  254    HH   TYR  16           HH       TYR  16   3.292 -15.252  -9.745
  255    H    LEU  17           H        LEU  17   2.564 -10.032  -4.625
  256    HA   LEU  17           HA       LEU  17   4.441 -12.287  -5.147
  257   1HB   LEU  17          1HB       LEU  17   4.836 -10.192  -6.404
  258   2HB   LEU  17          2HB       LEU  17   4.958  -9.307  -4.885
  259    HG   LEU  17           HG       LEU  17   6.756 -11.319  -4.460
  260   1HD1  LEU  17          1HD1      LEU  17   7.843 -11.973  -6.387
  261   2HD1  LEU  17          2HD1      LEU  17   7.413 -10.499  -7.254
  262   3HD1  LEU  17          3HD1      LEU  17   6.216 -11.776  -7.038
  263   1HD2  LEU  17          1HD2      LEU  17   6.775  -8.589  -4.601
  264   2HD2  LEU  17          2HD2      LEU  17   7.839  -9.000  -5.946
  265   3HD2  LEU  17          3HD2      LEU  17   8.215  -9.567  -4.318
  266    H    VAL  18           H        VAL  18   3.074 -10.374  -2.658
  267    HA   VAL  18           HA       VAL  18   5.220 -10.630  -0.742
  268    HB   VAL  18           HB       VAL  18   2.429  -9.648  -0.754
  269   1HG1  VAL  18          1HG1      VAL  18   2.310 -11.316   1.088
  270   2HG1  VAL  18          2HG1      VAL  18   2.227  -9.666   1.697
  271   3HG1  VAL  18          3HG1      VAL  18   3.731 -10.578   1.828
  272   1HG2  VAL  18          1HG2      VAL  18   4.736  -8.425  -0.808
  273   2HG2  VAL  18          2HG2      VAL  18   4.708  -8.689   0.937
  274   3HG2  VAL  18          3HG2      VAL  18   3.424  -7.757   0.164
  275    H    CYS  19           H        CYS  19   2.048 -12.206  -0.927
  276    HA   CYS  19           HA       CYS  19   3.100 -14.332   0.818
  277   1HB   CYS  19          1HB       CYS  19   0.346 -13.576  -0.134
  278   2HB   CYS  19          2HB       CYS  19   0.640 -15.151   0.604
  279    H    GLY  20           H        GLY  20   1.044 -14.407  -2.122
  280   1HA   GLY  20          1HA       GLY  20   1.220 -15.759  -4.039
  281   2HA   GLY  20          2HA       GLY  20   2.881 -16.113  -3.564
  282    H    GLU  21           H        GLU  21   0.899 -16.763  -0.962
  283    HA   GLU  21           HA       GLU  21  -0.363 -19.207  -1.521
  284   1HB   GLU  21          1HB       GLU  21   1.768 -20.114  -2.249
  285   2HB   GLU  21          2HB       GLU  21   2.565 -19.534  -0.786
  286   1HG   GLU  21          1HG       GLU  21   0.385 -21.056   0.124
  287   2HG   GLU  21          2HG       GLU  21   1.076 -21.988  -1.203
  288    H    ARG  22           H        ARG  22  -1.720 -18.533   0.126
  289    HA   ARG  22           HA       ARG  22  -1.160 -19.336   2.789
  290   1HB   ARG  22          1HB       ARG  22   0.297 -17.136   2.369
  291   2HB   ARG  22          2HB       ARG  22  -1.238 -16.346   2.729
  292   1HG   ARG  22          1HG       ARG  22  -0.849 -16.664   4.920
  293   2HG   ARG  22          2HG       ARG  22  -0.922 -18.407   4.651
  294   1HD   ARG  22          1HD       ARG  22   1.585 -17.843   3.724
  295   2HD   ARG  22          2HD       ARG  22   1.429 -16.652   5.015
  296    HE   ARG  22           HE       ARG  22   0.558 -19.206   5.978
  297   1HH1  ARG  22          1HH1      ARG  22   2.722 -17.040   6.867
  298   2HH1  ARG  22          2HH1      ARG  22   4.080 -18.097   7.069
  299   1HH2  ARG  22          1HH2      ARG  22   2.588 -20.762   5.431
  300   2HH2  ARG  22          2HH2      ARG  22   4.004 -20.203   6.257
  301    H    GLY  23           H        GLY  23  -2.905 -17.151   0.651
  302   1HA   GLY  23          1HA       GLY  23  -5.408 -17.754   0.629
  303   2HA   GLY  23          2HA       GLY  23  -5.326 -17.480   2.371
  304    H    PHE  24           H        PHE  24  -3.607 -15.589  -0.058
  305    HA   PHE  24           HA       PHE  24  -4.668 -13.119   1.052
  306   1HB   PHE  24          1HB       PHE  24  -2.576 -12.622   0.286
  307   2HB   PHE  24          2HB       PHE  24  -2.593 -13.933  -0.887
  308    HD1  PHE  24           HD1      PHE  24  -4.052 -10.537  -0.258
  309    HD2  PHE  24           HD2      PHE  24  -2.842 -13.459  -3.169
  310    HE1  PHE  24           HE1      PHE  24  -4.486  -8.906  -2.079
  311    HE2  PHE  24           HE2      PHE  24  -3.275 -11.829  -4.987
  312    HZ   PHE  24           HZ       PHE  24  -4.096  -9.552  -4.443
  313    H    PHE  25           H        PHE  25  -6.248 -11.787   0.148
  314    HA   PHE  25           HA       PHE  25  -7.518 -12.733  -2.384
  315   1HB   PHE  25          1HB       PHE  25  -9.683 -12.617  -1.482
  316   2HB   PHE  25          2HB       PHE  25  -8.759 -13.312  -0.154
  317    HD1  PHE  25           HD1      PHE  25 -10.910 -10.637  -1.162
  318    HD2  PHE  25           HD2      PHE  25  -7.777 -11.655   1.598
  319    HE1  PHE  25           HE1      PHE  25 -11.565  -8.731   0.284
  320    HE2  PHE  25           HE2      PHE  25  -8.432  -9.748   3.044
  321    HZ   PHE  25           HZ       PHE  25 -10.326  -8.285   2.386
  322    H    TYR  26           H        TYR  26  -8.121 -11.072  -3.783
  323    HA   TYR  26           HA       TYR  26  -7.917  -8.280  -2.762
  324   1HB   TYR  26          1HB       TYR  26  -5.748  -8.848  -3.796
  325   2HB   TYR  26          2HB       TYR  26  -6.577  -9.312  -5.281
  326    HD1  TYR  26           HD1      TYR  26  -6.616  -6.422  -2.877
  327    HD2  TYR  26           HD2      TYR  26  -6.564  -7.719  -6.973
  328    HE1  TYR  26           HE1      TYR  26  -6.582  -4.056  -3.626
  329    HE2  TYR  26           HE2      TYR  26  -6.531  -5.355  -7.723
  330    HH   TYR  26           HH       TYR  26  -5.964  -2.745  -5.547
  331    H    THR  27           H        THR  27  -9.097  -6.749  -4.076
  332    HA   THR  27           HA       THR  27 -11.086  -8.060  -5.888
  333    HB   THR  27           HB       THR  27 -12.788  -6.660  -5.045
  334    HG1  THR  27           HG1      THR  27 -10.811  -5.154  -3.692
  335   1HG2  THR  27          1HG2      THR  27 -10.993  -7.161  -2.657
  336   2HG2  THR  27          2HG2      THR  27 -11.997  -8.394  -3.420
  337   3HG2  THR  27          3HG2      THR  27 -12.749  -7.001  -2.643
  338    H    LYS  28           H        LYS  28 -12.244  -5.873  -7.004
  339    HA   LYS  28           HA       LYS  28  -9.978  -4.318  -8.178
  340   1HB   LYS  28          1HB       LYS  28 -11.684  -4.459 -10.285
  341   2HB   LYS  28          2HB       LYS  28 -10.358  -5.596 -10.043
  342   1HG   LYS  28          1HG       LYS  28 -11.924  -7.091  -8.792
  343   2HG   LYS  28          2HG       LYS  28 -13.239  -5.983  -9.182
  344   1HD   LYS  28          1HD       LYS  28 -13.171  -6.490 -11.463
  345   2HD   LYS  28          2HD       LYS  28 -11.507  -7.072 -11.384
  346   1HE   LYS  28          1HE       LYS  28 -12.241  -9.038 -10.105
  347   2HE   LYS  28          2HE       LYS  28 -13.903  -8.450 -10.139
  348   1HZ   LYS  28          1HZ       LYS  28 -13.314 -10.138 -11.875
  349   2HZ   LYS  28          2HZ       LYS  28 -12.323  -8.960 -12.593
  350   3HZ   LYS  28          3HZ       LYS  28 -13.996  -8.702 -12.467
  351    HA   PRO  29           HA       PRO  29 -12.570  -0.863  -7.403
  352   1HB   PRO  29          1HB       PRO  29 -11.432   0.901  -9.172
  353   2HB   PRO  29          2HB       PRO  29 -10.674   0.426  -7.642
  354   1HG   PRO  29          1HG       PRO  29  -9.972  -0.400 -10.419
  355   2HG   PRO  29          2HG       PRO  29  -8.945  -0.323  -8.978
  356   1HD   PRO  29          1HD       PRO  29 -10.088  -2.669 -10.087
  357   2HD   PRO  29          2HD       PRO  29  -9.322  -2.530  -8.491
  358    H    THR  30           H        THR  30 -11.917  -0.103 -10.748
  359    HA   THR  30           HA       THR  30 -14.800  -0.597 -11.378
  360    HB   THR  30           HB       THR  30 -13.364   1.303 -13.105
  361    HG1  THR  30           HG1      THR  30 -13.067   2.843 -11.604
  362   1HG2  THR  30          1HG2      THR  30 -15.440   2.259 -13.233
  363   2HG2  THR  30          2HG2      THR  30 -15.758   2.043 -11.512
  364   3HG2  THR  30          3HG2      THR  30 -15.948   0.685 -12.621
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1 -13.530   6.382  -0.835
    2   2H    GLY   1          2H        GLY   1 -14.752   7.166  -1.718
    3   3H    GLY   1          3H        GLY   1 -13.667   6.124  -2.507
    4   1HA   GLY   1          1HA       GLY   1 -15.577   5.198  -0.503
    5   2HA   GLY   1          2HA       GLY   1 -15.889   5.079  -2.261
    6    H    GLY   2           H        GLY   2 -13.344   4.844   0.390
    7   1HA   GLY   2          1HA       GLY   2 -13.699   2.417   1.561
    8   2HA   GLY   2          2HA       GLY   2 -13.027   1.947  -0.003
    9    H    GLY   3           H        GLY   3 -11.230   4.087  -0.388
   10   1HA   GLY   3          1HA       GLY   3  -9.057   4.759   0.186
   11   2HA   GLY   3          2HA       GLY   3  -9.550   4.598   1.872
   12    H    GLU   4           H        GLU   4  -6.984   3.839   1.101
   13    HA   GLU   4           HA       GLU   4  -7.139   0.886   1.493
   14   1HB   GLU   4          1HB       GLU   4  -6.369   1.905  -0.886
   15   2HB   GLU   4          2HB       GLU   4  -4.824   1.966  -0.037
   16   1HG   GLU   4          1HG       GLU   4  -4.563  -0.249  -0.329
   17   2HG   GLU   4          2HG       GLU   4  -6.064  -0.546   0.549
   18    H    GLN   5           H        GLN   5  -4.205   0.723   1.549
   19    HA   GLN   5           HA       GLN   5  -3.531   2.473   3.855
   20   1HB   GLN   5          1HB       GLN   5  -4.512   0.179   4.554
   21   2HB   GLN   5          2HB       GLN   5  -2.978  -0.484   3.990
   22   1HG   GLN   5          1HG       GLN   5  -2.957   0.047   6.432
   23   2HG   GLN   5          2HG       GLN   5  -1.743   0.952   5.526
   24   1HE2  GLN   5          1HE2      GLN   5  -4.916   1.244   7.126
   25   2HE2  GLN   5          2HE2      GLN   5  -4.899   2.939   7.216
   26    H    CYS   6           H        CYS   6  -2.628   1.340   0.896
   27    HA   CYS   6           HA       CYS   6   0.246   1.790   1.546
   28   1HB   CYS   6          1HB       CYS   6  -0.982  -0.518   0.069
   29   2HB   CYS   6          2HB       CYS   6   0.638   0.030  -0.363
   30    H    CYS   7           H        CYS   7  -2.406   2.712  -0.271
   31    HA   CYS   7           HA       CYS   7  -1.056   3.293  -2.775
   32   1HB   CYS   7          1HB       CYS   7  -3.540   2.965  -2.533
   33   2HB   CYS   7          2HB       CYS   7  -3.609   4.520  -1.702
   34    H    THR   8           H        THR   8  -2.617   5.672  -0.614
   35    HA   THR   8           HA       THR   8  -0.715   7.718  -1.447
   36    HB   THR   8           HB       THR   8  -3.012   8.362  -0.953
   37    HG1  THR   8           HG1      THR   8  -2.503  10.096   0.243
   38   1HG2  THR   8          1HG2      THR   8  -4.132   7.366   0.719
   39   2HG2  THR   8          2HG2      THR   8  -3.069   8.145   1.891
   40   3HG2  THR   8          3HG2      THR   8  -2.650   6.563   1.237
   41    H    SER   9           H        SER   9  -1.073   5.550   1.289
   42    HA   SER   9           HA       SER   9   1.144   6.927   2.716
   43   1HB   SER   9          1HB       SER   9  -1.092   5.977   3.774
   44   2HB   SER   9          2HB       SER   9  -0.198   4.460   3.760
   45    HG   SER   9           HG       SER   9   0.153   5.605   5.692
   46    H    ILE  10           H        ILE  10   2.817   5.374   3.700
   47    HA   ILE  10           HA       ILE  10   3.668   3.492   1.555
   48    HB   ILE  10           HB       ILE  10   5.499   4.150   3.809
   49   1HG1  ILE  10          1HG1      ILE  10   4.686   6.152   1.675
   50   2HG1  ILE  10          2HG1      ILE  10   4.490   6.342   3.418
   51   1HG2  ILE  10          1HG2      ILE  10   6.420   2.809   2.094
   52   2HG2  ILE  10          2HG2      ILE  10   7.010   4.430   1.725
   53   3HG2  ILE  10          3HG2      ILE  10   5.652   3.758   0.822
   54   1HD1  ILE  10          1HD1      ILE  10   6.829   6.853   1.771
   55   2HD1  ILE  10          2HD1      ILE  10   7.201   5.717   3.068
   56   3HD1  ILE  10          3HD1      ILE  10   6.529   7.303   3.449
   57    H    CYS  11           H        CYS  11   4.970   1.546   2.499
   58    HA   CYS  11           HA       CYS  11   4.210   0.574   5.124
   59   1HB   CYS  11          1HB       CYS  11   2.990  -1.471   3.963
   60   2HB   CYS  11          2HB       CYS  11   2.095  -0.008   4.365
   61    H    SER  12           H        SER  12   4.525  -2.134   4.783
   62    HA   SER  12           HA       SER  12   6.978  -2.501   3.158
   63   1HB   SER  12          1HB       SER  12   7.986  -1.986   5.236
   64   2HB   SER  12          2HB       SER  12   6.755  -2.853   6.144
   65    HG   SER  12           HG       SER  12   8.582  -4.128   6.031
   66    H    LEU  13           H        LEU  13   7.640  -4.969   3.538
   67    HA   LEU  13           HA       LEU  13   5.577  -6.537   2.425
   68   1HB   LEU  13          1HB       LEU  13   7.859  -7.616   4.096
   69   2HB   LEU  13          2HB       LEU  13   6.997  -8.452   2.804
   70    HG   LEU  13           HG       LEU  13   7.841  -6.155   1.539
   71   1HD1  LEU  13          1HD1      LEU  13  10.362  -7.012   2.820
   72   2HD1  LEU  13          2HD1      LEU  13   9.273  -6.106   3.871
   73   3HD1  LEU  13          3HD1      LEU  13   9.828  -5.398   2.353
   74   1HD2  LEU  13          1HD2      LEU  13   9.224  -8.846   1.781
   75   2HD2  LEU  13          2HD2      LEU  13   9.564  -7.659   0.522
   76   3HD2  LEU  13          3HD2      LEU  13   7.971  -8.411   0.618
   77    H    TYR  14           H        TYR  14   6.097  -5.587   5.663
   78    HA   TYR  14           HA       TYR  14   4.672  -7.760   6.934
   79   1HB   TYR  14          1HB       TYR  14   5.677  -5.076   7.709
   80   2HB   TYR  14          2HB       TYR  14   4.395  -5.769   8.699
   81    HD1  TYR  14           HD1      TYR  14   7.463  -7.055   6.942
   82    HD2  TYR  14           HD2      TYR  14   5.166  -6.913  10.571
   83    HE1  TYR  14           HE1      TYR  14   9.122  -8.532   8.050
   84    HE2  TYR  14           HE2      TYR  14   6.826  -8.391  11.682
   85    HH   TYR  14           HH       TYR  14   9.479  -8.855  11.204
   86    H    GLN  15           H        GLN  15   3.770  -4.376   6.378
   87    HA   GLN  15           HA       GLN  15   1.034  -4.623   6.999
   88   1HB   GLN  15          1HB       GLN  15   2.141  -2.900   4.767
   89   2HB   GLN  15          2HB       GLN  15   0.681  -2.608   5.711
   90   1HG   GLN  15          1HG       GLN  15   2.531  -2.801   7.702
   91   2HG   GLN  15          2HG       GLN  15   3.510  -2.100   6.414
   92   1HE2  GLN  15          1HE2      GLN  15   3.590   0.029   7.415
   93   2HE2  GLN  15          2HE2      GLN  15   2.216   1.022   7.510
   94    H    LEU  16           H        LEU  16   2.825  -5.483   4.133
   95    HA   LEU  16           HA       LEU  16   0.480  -6.107   2.520
   96   1HB   LEU  16          1HB       LEU  16   3.329  -7.094   2.166
   97   2HB   LEU  16          2HB       LEU  16   2.066  -7.036   0.935
   98    HG   LEU  16           HG       LEU  16   2.867  -4.513   2.355
   99   1HD1  LEU  16          1HD1      LEU  16   4.974  -4.713   1.565
  100   2HD1  LEU  16          2HD1      LEU  16   4.278  -4.525  -0.045
  101   3HD1  LEU  16          3HD1      LEU  16   4.556  -6.138   0.612
  102   1HD2  LEU  16          1HD2      LEU  16   2.417  -4.157  -0.405
  103   2HD2  LEU  16          2HD2      LEU  16   1.314  -3.747   0.909
  104   3HD2  LEU  16          3HD2      LEU  16   1.203  -5.322   0.123
  105    H    GLU  17           H        GLU  17   2.643  -7.833   4.714
  106    HA   GLU  17           HA       GLU  17   1.528 -10.454   4.073
  107   1HB   GLU  17          1HB       GLU  17   3.625  -9.380   5.799
  108   2HB   GLU  17          2HB       GLU  17   2.673 -10.621   6.616
  109   1HG   GLU  17          1HG       GLU  17   3.811 -10.986   3.834
  110   2HG   GLU  17          2HG       GLU  17   4.663 -11.489   5.294
  111    H    ASN  18           H        ASN  18   0.644  -7.778   6.024
  112    HA   ASN  18           HA       ASN  18  -1.006  -9.294   7.895
  113   1HB   ASN  18          1HB       ASN  18  -0.028  -6.652   7.736
  114   2HB   ASN  18          2HB       ASN  18  -1.783  -6.517   7.619
  115   1HD2  ASN  18          1HD2      ASN  18  -1.352  -5.480   9.893
  116   2HD2  ASN  18          2HD2      ASN  18  -1.366  -6.542  11.217
  117    H    TYR  19           H        TYR  19  -1.274  -8.645   4.656
  118    HA   TYR  19           HA       TYR  19  -4.204  -8.222   4.685
  119   1HB   TYR  19          1HB       TYR  19  -2.028  -7.984   2.659
  120   2HB   TYR  19          2HB       TYR  19  -3.639  -8.393   2.071
  121    HD1  TYR  19           HD1      TYR  19  -2.312  -6.142   4.777
  122    HD2  TYR  19           HD2      TYR  19  -4.782  -6.526   1.280
  123    HE1  TYR  19           HE1      TYR  19  -2.997  -3.767   4.998
  124    HE2  TYR  19           HE2      TYR  19  -5.466  -4.153   1.502
  125    HH   TYR  19           HH       TYR  19  -5.467  -2.364   2.888
  126    H    CYS  20           H        CYS  20  -1.869 -10.742   4.295
  127    HA   CYS  20           HA       CYS  20  -3.828 -12.517   2.968
  128   1HB   CYS  20          1HB       CYS  20  -1.169 -13.487   3.947
  129   2HB   CYS  20          2HB       CYS  20  -2.068 -13.960   2.507
  130    H    ASN  21           H        ASN  21  -3.449 -14.934   4.029
  131    HA   ASN  21           HA       ASN  21  -3.857 -14.677   6.971
  132   1HB   ASN  21          1HB       ASN  21  -6.101 -14.731   6.190
  133   2HB   ASN  21          2HB       ASN  21  -5.728 -15.939   4.960
  134   1HD2  ASN  21          1HD2      ASN  21  -5.847 -15.524   8.533
  135   2HD2  ASN  21          2HD2      ASN  21  -6.204 -17.151   8.861
  136   1H    PHE   1          1H        PHE   1  10.229  -1.579   3.429
  137   2H    PHE   1          2H        PHE   1  10.837  -3.009   2.741
  138   3H    PHE   1          3H        PHE   1   9.682  -2.085   1.905
  139    HA   PHE   1           HA       PHE   1  12.542  -1.532   2.341
  140   1HB   PHE   1          1HB       PHE   1  10.782  -1.144  -0.092
  141   2HB   PHE   1          2HB       PHE   1  12.544  -1.200  -0.034
  142    HD1  PHE   1           HD1      PHE   1   9.649  -3.074  -0.725
  143    HD2  PHE   1           HD2      PHE   1  13.532  -3.419   1.078
  144    HE1  PHE   1           HE1      PHE   1   9.583  -5.533  -1.054
  145    HE2  PHE   1           HE2      PHE   1  13.469  -5.876   0.748
  146    HZ   PHE   1           HZ       PHE   1  11.493  -6.934  -0.317
  147    H    VAL   2           H        VAL   2  12.764   0.700   0.775
  148    HA   VAL   2           HA       VAL   2  11.691   2.782   2.533
  149    HB   VAL   2           HB       VAL   2  14.023   2.627   1.317
  150   1HG1  VAL   2          1HG1      VAL   2  12.401   2.859  -0.916
  151   2HG1  VAL   2          2HG1      VAL   2  14.134   3.173  -0.868
  152   3HG1  VAL   2          3HG1      VAL   2  12.993   4.502  -0.673
  153   1HG2  VAL   2          1HG2      VAL   2  13.655   5.335   1.074
  154   2HG2  VAL   2          2HG2      VAL   2  13.979   4.502   2.595
  155   3HG2  VAL   2          3HG2      VAL   2  12.320   4.886   2.136
  156    H    ASN   3           H        ASN   3  11.452   4.759   0.423
  157    HA   ASN   3           HA       ASN   3   8.821   5.139   0.022
  158   1HB   ASN   3          1HB       ASN   3   9.266   6.335  -1.995
  159   2HB   ASN   3          2HB       ASN   3  10.733   6.468  -1.024
  160   1HD2  ASN   3          1HD2      ASN   3   9.613   5.656  -4.116
  161   2HD2  ASN   3          2HD2      ASN   3  10.970   4.791  -4.655
  162    H    GLN   4           H        GLN   4   7.211   3.752  -0.479
  163    HA   GLN   4           HA       GLN   4   7.431   2.121  -2.933
  164   1HB   GLN   4          1HB       GLN   4   7.829   1.008  -0.327
  165   2HB   GLN   4          2HB       GLN   4   6.284   0.421  -0.943
  166   1HG   GLN   4          1HG       GLN   4   8.109   0.339  -3.113
  167   2HG   GLN   4          2HG       GLN   4   8.936  -0.366  -1.724
  168   1HE2  GLN   4          1HE2      GLN   4   6.432  -0.895  -4.082
  169   2HE2  GLN   4          2HE2      GLN   4   5.912  -2.400  -3.495
  170    H    HIS   5           H        HIS   5   5.725   3.452  -3.728
  171    HA   HIS   5           HA       HIS   5   3.148   3.263  -2.235
  172   1HB   HIS   5          1HB       HIS   5   3.077   4.986  -4.579
  173   2HB   HIS   5          2HB       HIS   5   2.713   5.377  -2.899
  174    HD2  HIS   5           HD2      HIS   5   4.563   7.067  -1.781
  175    HE1  HIS   5           HE1      HIS   5   7.732   6.316  -4.478
  176    HE2  HIS   5           HE2      HIS   5   6.992   7.702  -2.468
  177    H    LEU   6           H        LEU   6   1.543   2.017  -3.073
  178    HA   LEU   6           HA       LEU   6   1.628   1.317  -5.963
  179   1HB   LEU   6          1HB       LEU   6   0.999  -0.842  -3.976
  180   2HB   LEU   6          2HB       LEU   6   1.626  -0.986  -5.619
  181    HG   LEU   6           HG       LEU   6   3.699   0.307  -4.601
  182   1HD1  LEU   6          1HD1      LEU   6   3.271  -1.251  -2.156
  183   2HD1  LEU   6          2HD1      LEU   6   2.120   0.074  -2.332
  184   3HD1  LEU   6          3HD1      LEU   6   3.852   0.403  -2.345
  185   1HD2  LEU   6          1HD2      LEU   6   4.660  -1.691  -5.016
  186   2HD2  LEU   6          2HD2      LEU   6   3.047  -2.396  -5.118
  187   3HD2  LEU   6          3HD2      LEU   6   3.911  -2.388  -3.580
  188    H    CYS   7           H        CYS   7  -0.461   0.910  -6.833
  189    HA   CYS   7           HA       CYS   7  -2.763   0.939  -4.972
  190   1HB   CYS   7          1HB       CYS   7  -2.590   2.948  -7.230
  191   2HB   CYS   7          2HB       CYS   7  -3.809   2.857  -5.959
  192    H    GLY   8           H        GLY   8  -4.100  -0.640  -5.687
  193   1HA   GLY   8          1HA       GLY   8  -5.363  -1.959  -7.163
  194   2HA   GLY   8          2HA       GLY   8  -4.991  -0.786  -8.424
  195    H    SER   9           H        SER   9  -4.199  -1.951 -10.098
  196    HA   SER   9           HA       SER   9  -3.053  -4.427 -10.223
  197   1HB   SER   9          1HB       SER   9  -3.445  -2.984 -12.197
  198   2HB   SER   9          2HB       SER   9  -2.041  -2.016 -11.757
  199    HG   SER   9           HG       SER   9  -0.757  -3.576 -12.414
  200    H    ASP  10           H        ASP  10  -1.364  -1.476  -9.194
  201    HA   ASP  10           HA       ASP  10   1.200  -2.854  -8.990
  202   1HB   ASP  10          1HB       ASP  10   0.230  -0.129  -8.731
  203   2HB   ASP  10          2HB       ASP  10   1.332  -0.541  -7.417
  204    H    LEU  11           H        LEU  11  -1.480  -2.146  -6.869
  205    HA   LEU  11           HA       LEU  11  -0.068  -2.785  -4.424
  206   1HB   LEU  11          1HB       LEU  11  -2.736  -1.946  -5.174
  207   2HB   LEU  11          2HB       LEU  11  -2.802  -3.257  -3.997
  208    HG   LEU  11           HG       LEU  11  -1.210  -0.693  -3.702
  209   1HD1  LEU  11          1HD1      LEU  11  -3.050   0.161  -2.723
  210   2HD1  LEU  11          2HD1      LEU  11  -3.123  -1.212  -1.618
  211   3HD1  LEU  11          3HD1      LEU  11  -3.940  -1.292  -3.180
  212   1HD2  LEU  11          1HD2      LEU  11   0.013  -1.854  -2.203
  213   2HD2  LEU  11          2HD2      LEU  11  -0.978  -3.292  -2.456
  214   3HD2  LEU  11          3HD2      LEU  11  -1.457  -2.091  -1.257
  215    H    VAL  12           H        VAL  12  -2.152  -4.591  -6.631
  216    HA   VAL  12           HA       VAL  12  -2.103  -7.008  -5.030
  217    HB   VAL  12           HB       VAL  12  -3.893  -6.687  -6.667
  218   1HG1  VAL  12          1HG1      VAL  12  -2.240  -7.163  -9.043
  219   2HG1  VAL  12          2HG1      VAL  12  -1.881  -5.628  -8.253
  220   3HG1  VAL  12          3HG1      VAL  12  -3.524  -5.981  -8.788
  221   1HG2  VAL  12          1HG2      VAL  12  -2.785  -9.009  -6.186
  222   2HG2  VAL  12          2HG2      VAL  12  -2.176  -8.869  -7.835
  223   3HG2  VAL  12          3HG2      VAL  12  -3.914  -8.870  -7.534
  224    H    GLU  13           H        GLU  13  -0.072  -5.613  -7.491
  225    HA   GLU  13           HA       GLU  13   1.454  -7.955  -8.127
  226   1HB   GLU  13          1HB       GLU  13   1.503  -5.666  -9.308
  227   2HB   GLU  13          2HB       GLU  13   2.567  -5.141  -8.002
  228   1HG   GLU  13          1HG       GLU  13   3.358  -7.719  -9.151
  229   2HG   GLU  13          2HG       GLU  13   3.391  -6.400 -10.324
  230    H    ALA  14           H        ALA  14   1.496  -5.646  -5.487
  231    HA   ALA  14           HA       ALA  14   3.952  -6.810  -4.345
  232   1HB   ALA  14          1HB       ALA  14   2.077  -4.724  -3.192
  233   2HB   ALA  14          2HB       ALA  14   3.489  -4.361  -4.185
  234   3HB   ALA  14          3HB       ALA  14   3.693  -5.118  -2.605
  235    H    LEU  15           H        LEU  15   0.559  -7.336  -4.226
  236    HA   LEU  15           HA       LEU  15   0.687  -8.615  -1.556
  237   1HB   LEU  15          1HB       LEU  15  -1.513  -7.953  -3.495
  238   2HB   LEU  15          2HB       LEU  15  -1.786  -9.182  -2.261
  239    HG   LEU  15           HG       LEU  15  -0.534  -6.666  -1.315
  240   1HD1  LEU  15          1HD1      LEU  15  -2.881  -5.644  -1.159
  241   2HD1  LEU  15          2HD1      LEU  15  -3.362  -6.826  -2.378
  242   3HD1  LEU  15          3HD1      LEU  15  -2.126  -5.624  -2.753
  243   1HD2  LEU  15          1HD2      LEU  15  -2.979  -7.779  -0.079
  244   2HD2  LEU  15          2HD2      LEU  15  -1.439  -7.347   0.665
  245   3HD2  LEU  15          3HD2      LEU  15  -1.618  -8.898  -0.154
  246    H    TYR  16           H        TYR  16   0.454  -9.383  -4.944
  247    HA   TYR  16           HA       TYR  16   0.079 -12.246  -4.547
  248   1HB   TYR  16          1HB       TYR  16  -0.767 -11.532  -6.606
  249   2HB   TYR  16          2HB       TYR  16   0.562 -10.408  -6.873
  250    HD1  TYR  16           HD1      TYR  16   0.222 -14.109  -6.244
  251    HD2  TYR  16           HD2      TYR  16   1.965 -10.986  -8.629
  252    HE1  TYR  16           HE1      TYR  16   1.414 -15.810  -7.604
  253    HE2  TYR  16           HE2      TYR  16   3.157 -12.686  -9.987
  254    HH   TYR  16           HH       TYR  16   3.968 -15.200  -9.486
  255    H    LEU  17           H        LEU  17   2.741 -10.033  -4.678
  256    HA   LEU  17           HA       LEU  17   4.697 -12.207  -5.132
  257   1HB   LEU  17          1HB       LEU  17   5.001 -10.016  -6.264
  258   2HB   LEU  17          2HB       LEU  17   5.134  -9.240  -4.686
  259    HG   LEU  17           HG       LEU  17   6.928 -11.391  -4.584
  260   1HD1  LEU  17          1HD1      LEU  17   7.997 -11.588  -6.587
  261   2HD1  LEU  17          2HD1      LEU  17   7.778  -9.884  -6.986
  262   3HD1  LEU  17          3HD1      LEU  17   6.458 -11.026  -7.240
  263   1HD2  LEU  17          1HD2      LEU  17   8.588  -9.637  -4.402
  264   2HD2  LEU  17          2HD2      LEU  17   7.110  -9.058  -3.633
  265   3HD2  LEU  17          3HD2      LEU  17   7.543  -8.496  -5.248
  266    H    VAL  18           H        VAL  18   3.282 -10.393  -2.564
  267    HA   VAL  18           HA       VAL  18   5.435 -10.862  -0.655
  268    HB   VAL  18           HB       VAL  18   2.613  -9.824  -0.424
  269   1HG1  VAL  18          1HG1      VAL  18   3.623  -9.316   2.027
  270   2HG1  VAL  18          2HG1      VAL  18   4.429 -10.850   1.701
  271   3HG1  VAL  18          3HG1      VAL  18   2.669 -10.756   1.675
  272   1HG2  VAL  18          1HG2      VAL  18   3.637  -7.746  -0.031
  273   2HG2  VAL  18          2HG2      VAL  18   4.686  -8.471  -1.251
  274   3HG2  VAL  18          3HG2      VAL  18   5.166  -8.483   0.447
  275    H    CYS  19           H        CYS  19   2.145 -12.150  -1.043
  276    HA   CYS  19           HA       CYS  19   2.949 -14.435   0.693
  277   1HB   CYS  19          1HB       CYS  19   0.197 -13.477  -0.144
  278   2HB   CYS  19          2HB       CYS  19   0.515 -14.854   0.912
  279    H    GLY  20           H        GLY  20   1.140 -13.795  -2.338
  280   1HA   GLY  20          1HA       GLY  20   1.029 -15.100  -4.294
  281   2HA   GLY  20          2HA       GLY  20   2.409 -16.017  -3.683
  282    H    GLU  21           H        GLU  21   1.826 -17.517  -1.773
  283    HA   GLU  21           HA       GLU  21  -0.925 -18.618  -2.119
  284   1HB   GLU  21          1HB       GLU  21   1.221 -19.841  -3.232
  285   2HB   GLU  21          2HB       GLU  21   1.256 -20.567  -1.625
  286   1HG   GLU  21          1HG       GLU  21  -1.113 -21.214  -1.860
  287   2HG   GLU  21          2HG       GLU  21  -1.151 -20.491  -3.468
  288    H    ARG  22           H        ARG  22  -1.882 -18.500  -0.170
  289    HA   ARG  22           HA       ARG  22  -0.984 -19.796   2.166
  290   1HB   ARG  22          1HB       ARG  22   0.515 -17.474   1.732
  291   2HB   ARG  22          2HB       ARG  22  -0.693 -16.993   2.924
  292   1HG   ARG  22          1HG       ARG  22   0.050 -18.532   4.503
  293   2HG   ARG  22          2HG       ARG  22   0.756 -19.595   3.286
  294   1HD   ARG  22          1HD       ARG  22   2.673 -18.293   3.062
  295   2HD   ARG  22          2HD       ARG  22   1.867 -16.829   3.625
  296    HE   ARG  22           HE       ARG  22   3.372 -18.478   5.300
  297   1HH1  ARG  22          1HH1      ARG  22   1.442 -15.997   5.815
  298   2HH1  ARG  22          2HH1      ARG  22   0.604 -16.603   7.204
  299   1HH2  ARG  22          1HH2      ARG  22   1.720 -19.860   6.787
  300   2HH2  ARG  22          2HH2      ARG  22   0.761 -18.791   7.753
  301    H    GLY  23           H        GLY  23  -2.751 -17.116   0.753
  302   1HA   GLY  23          1HA       GLY  23  -5.295 -17.565   1.272
  303   2HA   GLY  23          2HA       GLY  23  -4.771 -17.255   2.929
  304    H    PHE  24           H        PHE  24  -3.579 -15.630   0.010
  305    HA   PHE  24           HA       PHE  24  -4.183 -13.041   1.256
  306   1HB   PHE  24          1HB       PHE  24  -2.175 -12.760   0.194
  307   2HB   PHE  24          2HB       PHE  24  -2.504 -14.032  -0.977
  308    HD1  PHE  24           HD1      PHE  24  -4.113 -10.742  -0.094
  309    HD2  PHE  24           HD2      PHE  24  -2.487 -13.271  -3.164
  310    HE1  PHE  24           HE1      PHE  24  -4.689  -9.038  -1.805
  311    HE2  PHE  24           HE2      PHE  24  -3.062 -11.568  -4.873
  312    HZ   PHE  24           HZ       PHE  24  -4.163  -9.452  -4.194
  313    H    PHE  25           H        PHE  25  -5.820 -11.663   0.628
  314    HA   PHE  25           HA       PHE  25  -7.270 -12.124  -1.884
  315   1HB   PHE  25          1HB       PHE  25  -9.349 -12.736  -0.988
  316   2HB   PHE  25          2HB       PHE  25  -8.229 -13.662   0.008
  317    HD1  PHE  25           HD1      PHE  25 -11.143 -11.995   0.315
  318    HD2  PHE  25           HD2      PHE  25  -7.161 -11.806   1.925
  319    HE1  PHE  25           HE1      PHE  25 -12.014 -10.853   2.338
  320    HE2  PHE  25           HE2      PHE  25  -8.035 -10.666   3.948
  321    HZ   PHE  25           HZ       PHE  25 -10.461 -10.189   4.153
  322    H    TYR  26           H        TYR  26  -8.321 -10.249  -2.572
  323    HA   TYR  26           HA       TYR  26  -8.735  -8.034  -0.677
  324   1HB   TYR  26          1HB       TYR  26  -7.257  -6.488  -1.643
  325   2HB   TYR  26          2HB       TYR  26  -6.305  -7.969  -1.637
  326    HD1  TYR  26           HD1      TYR  26  -7.300  -5.257  -3.610
  327    HD2  TYR  26           HD2      TYR  26  -6.722  -9.509  -3.818
  328    HE1  TYR  26           HE1      TYR  26  -7.053  -5.100  -6.073
  329    HE2  TYR  26           HE2      TYR  26  -6.476  -9.356  -6.283
  330    HH   TYR  26           HH       TYR  26  -5.994  -6.423  -7.902
  331    H    THR  27           H        THR  27  -9.964  -6.236  -1.758
  332    HA   THR  27           HA       THR  27 -11.719  -7.396  -3.858
  333    HB   THR  27           HB       THR  27 -12.807  -6.479  -1.837
  334    HG1  THR  27           HG1      THR  27 -14.265  -5.195  -2.954
  335   1HG2  THR  27          1HG2      THR  27 -11.912  -4.647  -0.892
  336   2HG2  THR  27          2HG2      THR  27 -12.556  -3.704  -2.235
  337   3HG2  THR  27          3HG2      THR  27 -10.916  -4.345  -2.316
  338    H    LYS  28           H        LYS  28 -12.378  -5.959  -5.667
  339    HA   LYS  28           HA       LYS  28 -10.348  -3.869  -6.303
  340   1HB   LYS  28          1HB       LYS  28 -10.197  -4.699  -8.607
  341   2HB   LYS  28          2HB       LYS  28  -9.748  -5.980  -7.479
  342   1HG   LYS  28          1HG       LYS  28 -12.302  -6.590  -7.592
  343   2HG   LYS  28          2HG       LYS  28 -12.255  -5.686  -9.107
  344   1HD   LYS  28          1HD       LYS  28 -10.530  -7.130  -9.992
  345   2HD   LYS  28          2HD       LYS  28 -10.347  -7.944  -8.439
  346   1HE   LYS  28          1HE       LYS  28 -12.428  -9.031  -8.623
  347   2HE   LYS  28          2HE       LYS  28 -13.010  -7.906  -9.849
  348   1HZ   LYS  28          1HZ       LYS  28 -10.990  -8.843 -11.174
  349   2HZ   LYS  28          2HZ       LYS  28 -12.456  -9.700 -11.126
  350   3HZ   LYS  28          3HZ       LYS  28 -11.162 -10.168 -10.129
  351    HA   PRO  29           HA       PRO  29 -14.030  -1.656  -7.348
  352   1HB   PRO  29          1HB       PRO  29 -12.788   0.501  -8.513
  353   2HB   PRO  29          2HB       PRO  29 -12.868   0.249  -6.760
  354   1HG   PRO  29          1HG       PRO  29 -10.551  -0.098  -8.602
  355   2HG   PRO  29          2HG       PRO  29 -10.562   0.259  -6.867
  356   1HD   PRO  29          1HD       PRO  29 -10.056  -2.271  -8.046
  357   2HD   PRO  29          2HD       PRO  29 -10.366  -1.958  -6.325
  358    H    THR  30           H        THR  30 -14.540  -0.157  -9.544
  359    HA   THR  30           HA       THR  30 -14.997  -2.019 -11.628
  360    HB   THR  30           HB       THR  30 -15.471  -0.018 -13.040
  361    HG1  THR  30           HG1      THR  30 -14.928   1.617 -10.852
  362   1HG2  THR  30          1HG2      THR  30 -16.645   0.784 -10.452
  363   2HG2  THR  30          2HG2      THR  30 -16.844  -0.920 -10.859
  364   3HG2  THR  30          3HG2      THR  30 -17.441   0.324 -11.958
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1 -11.672   8.394  -1.082
    2   2H    GLY   1          2H        GLY   1 -12.961   7.462  -0.487
    3   3H    GLY   1          3H        GLY   1 -13.269   8.795  -1.493
    4   1HA   GLY   1          1HA       GLY   1 -13.363   7.101  -3.026
    5   2HA   GLY   1          2HA       GLY   1 -11.619   7.481  -3.162
    6    H    GLY   2           H        GLY   2 -11.246   5.170  -3.536
    7   1HA   GLY   2          1HA       GLY   2 -13.139   3.163  -2.380
    8   2HA   GLY   2          2HA       GLY   2 -12.254   2.922  -3.887
    9    H    GLY   3           H        GLY   3  -9.947   2.543  -3.763
   10   1HA   GLY   3          1HA       GLY   3  -9.101   1.543  -1.073
   11   2HA   GLY   3          2HA       GLY   3  -8.561   0.836  -2.597
   12    H    GLU   4           H        GLU   4  -7.243   2.388  -0.204
   13    HA   GLU   4           HA       GLU   4  -5.122   3.549  -1.775
   14   1HB   GLU   4          1HB       GLU   4  -5.444   5.908  -1.017
   15   2HB   GLU   4          2HB       GLU   4  -6.725   5.365  -2.101
   16   1HG   GLU   4          1HG       GLU   4  -7.990   4.696   0.057
   17   2HG   GLU   4          2HG       GLU   4  -6.827   5.729   0.890
   18    H    GLN   5           H        GLN   5  -4.393   1.838  -0.117
   19    HA   GLN   5           HA       GLN   5  -4.079   3.003   2.601
   20   1HB   GLN   5          1HB       GLN   5  -4.922   0.581   2.133
   21   2HB   GLN   5          2HB       GLN   5  -3.223   0.230   1.815
   22   1HG   GLN   5          1HG       GLN   5  -2.877   0.054   4.030
   23   2HG   GLN   5          2HG       GLN   5  -3.303   1.757   4.204
   24   1HE2  GLN   5          1HE2      GLN   5  -4.165   0.696   6.377
   25   2HE2  GLN   5          2HE2      GLN   5  -5.781   0.178   6.345
   26    H    CYS   6           H        CYS   6  -2.106   1.197   0.266
   27    HA   CYS   6           HA       CYS   6   0.312   2.518   1.373
   28   1HB   CYS   6          1HB       CYS   6   0.018   0.222  -0.585
   29   2HB   CYS   6          2HB       CYS   6   1.553   0.842   0.027
   30    H    CYS   7           H        CYS   7  -1.680   3.893  -0.369
   31    HA   CYS   7           HA       CYS   7  -0.155   4.291  -2.878
   32   1HB   CYS   7          1HB       CYS   7  -2.714   4.111  -2.778
   33   2HB   CYS   7          2HB       CYS   7  -2.691   5.714  -2.047
   34    H    THR   8           H        THR   8  -0.879   5.872   0.164
   35    HA   THR   8           HA       THR   8   0.604   8.296  -0.745
   36    HB   THR   8           HB       THR   8  -0.283   9.086   1.622
   37    HG1  THR   8           HG1      THR   8  -2.185   7.122   0.882
   38   1HG2  THR   8          1HG2      THR   8  -2.496   8.836  -0.342
   39   2HG2  THR   8          2HG2      THR   8  -1.009   9.580  -0.929
   40   3HG2  THR   8          3HG2      THR   8  -1.853  10.271   0.456
   41    H    SER   9           H        SER   9   0.513   5.801   1.785
   42    HA   SER   9           HA       SER   9   3.041   6.831   2.930
   43   1HB   SER   9          1HB       SER   9   1.337   6.076   4.506
   44   2HB   SER   9          2HB       SER   9   1.261   4.503   3.716
   45    HG   SER   9           HG       SER   9   2.788   5.135   5.690
   46    H    ILE  10           H        ILE  10   3.825   4.032   3.696
   47    HA   ILE  10           HA       ILE  10   4.720   3.043   1.024
   48    HB   ILE  10           HB       ILE  10   6.477   3.194   3.487
   49   1HG1  ILE  10          1HG1      ILE  10   6.585   4.922   0.997
   50   2HG1  ILE  10          2HG1      ILE  10   5.853   5.444   2.515
   51   1HG2  ILE  10          1HG2      ILE  10   8.019   2.060   2.273
   52   2HG2  ILE  10          2HG2      ILE  10   7.668   2.980   0.810
   53   3HG2  ILE  10          3HG2      ILE  10   6.665   1.595   1.243
   54   1HD1  ILE  10          1HD1      ILE  10   8.042   4.957   3.657
   55   2HD1  ILE  10          2HD1      ILE  10   8.135   6.256   2.467
   56   3HD1  ILE  10          3HD1      ILE  10   8.744   4.649   2.069
   57    H    CYS  11           H        CYS  11   4.052   2.322   4.429
   58    HA   CYS  11           HA       CYS  11   3.381   0.284   5.415
   59   1HB   CYS  11          1HB       CYS  11   3.240  -0.817   2.603
   60   2HB   CYS  11          2HB       CYS  11   2.364  -1.377   4.026
   61    H    SER  12           H        SER  12   3.999  -2.337   4.606
   62    HA   SER  12           HA       SER  12   6.811  -2.494   3.883
   63   1HB   SER  12          1HB       SER  12   7.201  -1.923   6.179
   64   2HB   SER  12          2HB       SER  12   5.984  -3.064   6.726
   65    HG   SER  12           HG       SER  12   8.585  -3.467   5.924
   66    H    LEU  13           H        LEU  13   7.533  -4.728   3.936
   67    HA   LEU  13           HA       LEU  13   5.688  -6.443   2.659
   68   1HB   LEU  13          1HB       LEU  13   8.106  -6.782   2.450
   69   2HB   LEU  13          2HB       LEU  13   8.215  -7.179   4.165
   70    HG   LEU  13           HG       LEU  13   6.210  -8.778   2.740
   71   1HD1  LEU  13          1HD1      LEU  13   7.466  -9.695   1.091
   72   2HD1  LEU  13          2HD1      LEU  13   8.895  -9.786   2.121
   73   3HD1  LEU  13          3HD1      LEU  13   8.512  -8.287   1.275
   74   1HD2  LEU  13          1HD2      LEU  13   6.726  -9.634   4.824
   75   2HD2  LEU  13          2HD2      LEU  13   8.404  -9.097   4.744
   76   3HD2  LEU  13          3HD2      LEU  13   7.896 -10.536   3.858
   77    H    TYR  14           H        TYR  14   6.058  -5.755   5.971
   78    HA   TYR  14           HA       TYR  14   4.753  -8.237   6.862
   79   1HB   TYR  14          1HB       TYR  14   5.954  -5.834   8.093
   80   2HB   TYR  14          2HB       TYR  14   4.685  -6.640   9.001
   81    HD1  TYR  14           HD1      TYR  14   8.144  -6.543   8.452
   82    HD2  TYR  14           HD2      TYR  14   4.923  -9.337   8.994
   83    HE1  TYR  14           HE1      TYR  14   9.769  -8.281   9.156
   84    HE2  TYR  14           HE2      TYR  14   6.549 -11.073   9.698
   85    HH   TYR  14           HH       TYR  14   9.589 -10.455  10.674
   86    H    GLN  15           H        GLN  15   4.099  -4.778   6.984
   87    HA   GLN  15           HA       GLN  15   1.344  -5.102   7.754
   88   1HB   GLN  15          1HB       GLN  15   3.046  -2.821   6.817
   89   2HB   GLN  15          2HB       GLN  15   1.292  -2.627   6.805
   90   1HG   GLN  15          1HG       GLN  15   1.189  -3.224   9.185
   91   2HG   GLN  15          2HG       GLN  15   2.934  -3.477   9.210
   92   1HE2  GLN  15          1HE2      GLN  15   3.873  -1.269   7.768
   93   2HE2  GLN  15          2HE2      GLN  15   3.447   0.166   8.570
   94    H    LEU  16           H        LEU  16   3.044  -5.018   4.701
   95    HA   LEU  16           HA       LEU  16   0.547  -4.675   3.208
   96   1HB   LEU  16          1HB       LEU  16   1.976  -3.999   1.624
   97   2HB   LEU  16          2HB       LEU  16   3.322  -4.397   2.667
   98    HG   LEU  16           HG       LEU  16   3.548  -5.475   0.508
   99   1HD1  LEU  16          1HD1      LEU  16   2.934  -7.914   1.946
  100   2HD1  LEU  16          2HD1      LEU  16   3.743  -6.738   2.981
  101   3HD1  LEU  16          3HD1      LEU  16   4.499  -7.255   1.475
  102   1HD2  LEU  16          1HD2      LEU  16   1.801  -6.374  -0.590
  103   2HD2  LEU  16          2HD2      LEU  16   0.766  -5.842   0.735
  104   3HD2  LEU  16          3HD2      LEU  16   1.461  -7.463   0.754
  105    H    GLU  17           H        GLU  17   2.615  -7.283   4.362
  106    HA   GLU  17           HA       GLU  17   1.155  -9.291   2.773
  107   1HB   GLU  17          1HB       GLU  17   2.494 -10.930   3.841
  108   2HB   GLU  17          2HB       GLU  17   3.561  -9.539   3.673
  109   1HG   GLU  17          1HG       GLU  17   3.886  -9.561   5.896
  110   2HG   GLU  17          2HG       GLU  17   2.174  -9.215   6.129
  111    H    ASN  18           H        ASN  18   0.371  -7.415   5.414
  112    HA   ASN  18           HA       ASN  18  -1.049  -9.343   7.025
  113   1HB   ASN  18          1HB       ASN  18  -0.700  -6.443   6.935
  114   2HB   ASN  18          2HB       ASN  18  -2.352  -6.899   7.352
  115   1HD2  ASN  18          1HD2      ASN  18  -2.292  -6.527   9.621
  116   2HD2  ASN  18          2HD2      ASN  18  -1.238  -7.341  10.673
  117    H    TYR  19           H        TYR  19  -1.590  -8.204   3.899
  118    HA   TYR  19           HA       TYR  19  -4.500  -8.125   4.002
  119   1HB   TYR  19          1HB       TYR  19  -2.476  -8.139   1.773
  120   2HB   TYR  19          2HB       TYR  19  -4.199  -8.299   1.435
  121    HD1  TYR  19           HD1      TYR  19  -2.018  -6.211   3.684
  122    HD2  TYR  19           HD2      TYR  19  -5.292  -6.319   0.901
  123    HE1  TYR  19           HE1      TYR  19  -2.299  -3.758   3.919
  124    HE2  TYR  19           HE2      TYR  19  -5.571  -3.866   1.136
  125    HH   TYR  19           HH       TYR  19  -4.251  -1.920   1.797
  126    H    CYS  20           H        CYS  20  -2.048 -10.534   3.287
  127    HA   CYS  20           HA       CYS  20  -4.130 -12.450   2.438
  128   1HB   CYS  20          1HB       CYS  20  -1.259 -13.208   2.851
  129   2HB   CYS  20          2HB       CYS  20  -2.414 -13.829   1.676
  130    H    ASN  21           H        ASN  21  -3.384 -14.814   3.407
  131    HA   ASN  21           HA       ASN  21  -3.395 -14.479   6.384
  132   1HB   ASN  21          1HB       ASN  21  -5.648 -15.088   5.202
  133   2HB   ASN  21          2HB       ASN  21  -4.925 -16.687   5.027
  134   1HD2  ASN  21          1HD2      ASN  21  -5.189 -18.062   6.800
  135   2HD2  ASN  21          2HD2      ASN  21  -5.574 -17.554   8.373
  136   1H    PHE   1          1H        PHE   1  10.793  -5.774   0.971
  137   2H    PHE   1          2H        PHE   1  11.413  -4.652  -0.144
  138   3H    PHE   1          3H        PHE   1   9.981  -4.309   0.705
  139    HA   PHE   1           HA       PHE   1  11.055  -3.851   2.659
  140   1HB   PHE   1          1HB       PHE   1  13.393  -5.422   1.529
  141   2HB   PHE   1          2HB       PHE   1  13.372  -4.639   3.110
  142    HD1  PHE   1           HD1      PHE   1  12.240  -7.493   1.142
  143    HD2  PHE   1           HD2      PHE   1  11.772  -5.408   4.871
  144    HE1  PHE   1           HE1      PHE   1  11.108  -9.477   2.109
  145    HE2  PHE   1           HE2      PHE   1  10.640  -7.394   5.838
  146    HZ   PHE   1           HZ       PHE   1  10.309  -9.427   4.458
  147    H    VAL   2           H        VAL   2  10.719  -2.237   0.458
  148    HA   VAL   2           HA       VAL   2  12.934  -0.362   0.781
  149    HB   VAL   2           HB       VAL   2  13.518  -2.106  -1.088
  150   1HG1  VAL   2          1HG1      VAL   2  11.825  -0.203  -2.703
  151   2HG1  VAL   2          2HG1      VAL   2  11.246  -1.784  -2.178
  152   3HG1  VAL   2          3HG1      VAL   2  12.636  -1.668  -3.258
  153   1HG2  VAL   2          1HG2      VAL   2  14.276   0.498  -0.564
  154   2HG2  VAL   2          2HG2      VAL   2  13.858   0.543  -2.277
  155   3HG2  VAL   2          3HG2      VAL   2  15.078  -0.592  -1.695
  156    H    ASN   3           H        ASN   3  12.355   1.257  -1.411
  157    HA   ASN   3           HA       ASN   3   9.991   2.616  -0.519
  158   1HB   ASN   3          1HB       ASN   3  11.750   3.865  -1.624
  159   2HB   ASN   3          2HB       ASN   3  11.599   2.873  -3.075
  160   1HD2  ASN   3          1HD2      ASN   3  10.558   4.069  -4.671
  161   2HD2  ASN   3          2HD2      ASN   3   9.226   5.088  -4.413
  162    H    GLN   4           H        GLN   4   8.203   1.215  -0.631
  163    HA   GLN   4           HA       GLN   4   7.515   0.143  -3.327
  164   1HB   GLN   4          1HB       GLN   4   6.747  -0.632  -0.522
  165   2HB   GLN   4          2HB       GLN   4   5.735  -1.111  -1.885
  166   1HG   GLN   4          1HG       GLN   4   8.519  -1.610  -2.491
  167   2HG   GLN   4          2HG       GLN   4   8.074  -2.398  -0.977
  168   1HE2  GLN   4          1HE2      GLN   4   7.567  -2.415  -4.449
  169   2HE2  GLN   4          2HE2      GLN   4   6.563  -3.781  -4.489
  170    H    HIS   5           H        HIS   5   6.282   1.602  -4.423
  171    HA   HIS   5           HA       HIS   5   4.124   3.011  -2.903
  172   1HB   HIS   5          1HB       HIS   5   5.971   3.878  -5.066
  173   2HB   HIS   5          2HB       HIS   5   4.306   4.445  -5.193
  174    HD2  HIS   5           HD2      HIS   5   4.043   4.644  -1.757
  175    HE1  HIS   5           HE1      HIS   5   6.874   7.723  -2.376
  176    HE2  HIS   5           HE2      HIS   5   5.191   6.740  -0.729
  177    H    LEU   6           H        LEU   6   2.234   1.946  -3.272
  178    HA   LEU   6           HA       LEU   6   1.504   1.383  -6.090
  179   1HB   LEU   6          1HB       LEU   6   0.395  -0.800  -4.874
  180   2HB   LEU   6          2HB       LEU   6   1.911  -0.830  -5.766
  181    HG   LEU   6           HG       LEU   6   2.024  -1.892  -3.487
  182   1HD1  LEU   6          1HD1      LEU   6   3.868  -0.305  -4.798
  183   2HD1  LEU   6          2HD1      LEU   6   4.215  -1.354  -3.425
  184   3HD1  LEU   6          3HD1      LEU   6   3.873   0.356  -3.163
  185   1HD2  LEU   6          1HD2      LEU   6   1.266  -0.806  -1.672
  186   2HD2  LEU   6          2HD2      LEU   6   0.704   0.487  -2.728
  187   3HD2  LEU   6          3HD2      LEU   6   2.311   0.573  -2.011
  188    H    CYS   7           H        CYS   7  -0.901   0.889  -6.250
  189    HA   CYS   7           HA       CYS   7  -2.468   1.968  -3.972
  190   1HB   CYS   7          1HB       CYS   7  -2.856   3.017  -6.784
  191   2HB   CYS   7          2HB       CYS   7  -3.575   3.627  -5.294
  192    H    GLY   8           H        GLY   8  -2.474   0.457  -7.191
  193   1HA   GLY   8          1HA       GLY   8  -4.804  -1.168  -6.299
  194   2HA   GLY   8          2HA       GLY   8  -4.897  -0.334  -7.850
  195    H    SER   9           H        SER   9  -3.982  -1.311  -9.618
  196    HA   SER   9           HA       SER   9  -3.369  -4.013  -9.726
  197   1HB   SER   9          1HB       SER   9  -3.461  -2.066 -11.584
  198   2HB   SER   9          2HB       SER   9  -1.714  -2.261 -11.474
  199    HG   SER   9           HG       SER   9  -3.239  -3.710 -12.892
  200    H    ASP  10           H        ASP  10  -1.204  -1.369  -8.828
  201    HA   ASP  10           HA       ASP  10   1.152  -3.099  -8.771
  202   1HB   ASP  10          1HB       ASP  10   0.661  -0.296  -7.730
  203   2HB   ASP  10          2HB       ASP  10   2.225  -1.108  -7.675
  204    H    LEU  11           H        LEU  11  -1.436  -2.382  -6.627
  205    HA   LEU  11           HA       LEU  11   0.048  -3.001  -4.189
  206   1HB   LEU  11          1HB       LEU  11  -2.612  -2.058  -4.871
  207   2HB   LEU  11          2HB       LEU  11  -2.687  -3.348  -3.670
  208    HG   LEU  11           HG       LEU  11  -0.888  -0.918  -3.446
  209   1HD1  LEU  11          1HD1      LEU  11  -3.561  -0.766  -3.277
  210   2HD1  LEU  11          2HD1      LEU  11  -2.506   0.150  -2.201
  211   3HD1  LEU  11          3HD1      LEU  11  -3.229  -1.361  -1.650
  212   1HD2  LEU  11          1HD2      LEU  11  -0.375  -3.206  -2.282
  213   2HD2  LEU  11          2HD2      LEU  11  -1.726  -2.782  -1.232
  214   3HD2  LEU  11          3HD2      LEU  11  -0.313  -1.731  -1.317
  215    H    VAL  12           H        VAL  12  -2.165  -4.697  -6.343
  216    HA   VAL  12           HA       VAL  12  -2.147  -7.124  -4.746
  217    HB   VAL  12           HB       VAL  12  -3.406  -8.116  -6.524
  218   1HG1  VAL  12          1HG1      VAL  12  -4.769  -5.835  -7.237
  219   2HG1  VAL  12          2HG1      VAL  12  -3.960  -5.329  -5.754
  220   3HG1  VAL  12          3HG1      VAL  12  -5.027  -6.732  -5.741
  221   1HG2  VAL  12          1HG2      VAL  12  -3.554  -7.012  -8.762
  222   2HG2  VAL  12          2HG2      VAL  12  -1.916  -7.543  -8.378
  223   3HG2  VAL  12          3HG2      VAL  12  -2.349  -5.839  -8.232
  224    H    GLU  13           H        GLU  13  -0.346  -5.877  -7.483
  225    HA   GLU  13           HA       GLU  13   1.074  -8.270  -8.130
  226   1HB   GLU  13          1HB       GLU  13   1.072  -5.695  -9.102
  227   2HB   GLU  13          2HB       GLU  13   2.632  -5.765  -8.283
  228   1HG   GLU  13          1HG       GLU  13   2.563  -8.190  -9.577
  229   2HG   GLU  13          2HG       GLU  13   1.736  -7.138 -10.727
  230    H    ALA  14           H        ALA  14   1.411  -5.854  -5.610
  231    HA   ALA  14           HA       ALA  14   3.950  -6.987  -4.642
  232   1HB   ALA  14          1HB       ALA  14   2.103  -4.824  -3.595
  233   2HB   ALA  14          2HB       ALA  14   3.680  -4.609  -4.353
  234   3HB   ALA  14          3HB       ALA  14   3.564  -5.337  -2.750
  235    H    LEU  15           H        LEU  15   0.589  -7.546  -4.283
  236    HA   LEU  15           HA       LEU  15   0.941  -8.870  -1.648
  237   1HB   LEU  15          1HB       LEU  15  -1.344  -7.881  -3.253
  238   2HB   LEU  15          2HB       LEU  15  -1.631  -9.389  -2.386
  239    HG   LEU  15           HG       LEU  15  -0.462  -6.923  -1.079
  240   1HD1  LEU  15          1HD1      LEU  15  -2.546  -6.053  -1.206
  241   2HD1  LEU  15          2HD1      LEU  15  -3.036  -7.326  -0.089
  242   3HD1  LEU  15          3HD1      LEU  15  -3.215  -7.562  -1.827
  243   1HD2  LEU  15          1HD2      LEU  15  -0.157  -9.324  -0.144
  244   2HD2  LEU  15          2HD2      LEU  15  -1.884  -9.253   0.212
  245   3HD2  LEU  15          3HD2      LEU  15  -0.782  -8.092   0.951
  246    H    TYR  16           H        TYR  16   0.732  -9.490  -5.022
  247    HA   TYR  16           HA       TYR  16   0.087 -12.322  -4.764
  248   1HB   TYR  16          1HB       TYR  16  -0.481 -11.910  -6.915
  249   2HB   TYR  16          2HB       TYR  16   0.331 -10.351  -6.874
  250    HD1  TYR  16           HD1      TYR  16   1.139 -14.017  -7.111
  251    HD2  TYR  16           HD2      TYR  16   2.169 -10.009  -8.272
  252    HE1  TYR  16           HE1      TYR  16   2.928 -14.902  -8.584
  253    HE2  TYR  16           HE2      TYR  16   3.957 -10.895  -9.745
  254    HH   TYR  16           HH       TYR  16   5.348 -12.936  -9.924
  255    H    LEU  17           H        LEU  17   2.940 -10.307  -4.853
  256    HA   LEU  17           HA       LEU  17   4.728 -12.630  -5.182
  257   1HB   LEU  17          1HB       LEU  17   5.556 -10.760  -6.346
  258   2HB   LEU  17          2HB       LEU  17   5.122  -9.649  -5.049
  259    HG   LEU  17           HG       LEU  17   7.111 -11.810  -4.466
  260   1HD1  LEU  17          1HD1      LEU  17   8.900 -10.142  -5.189
  261   2HD1  LEU  17          2HD1      LEU  17   7.625  -9.292  -6.063
  262   3HD1  LEU  17          3HD1      LEU  17   8.039 -10.950  -6.499
  263   1HD2  LEU  17          1HD2      LEU  17   7.961  -9.466  -3.336
  264   2HD2  LEU  17          2HD2      LEU  17   6.876 -10.608  -2.541
  265   3HD2  LEU  17          3HD2      LEU  17   6.217  -9.207  -3.385
  266    H    VAL  18           H        VAL  18   3.683 -10.369  -2.707
  267    HA   VAL  18           HA       VAL  18   5.584 -11.143  -0.706
  268    HB   VAL  18           HB       VAL  18   2.846  -9.879  -0.569
  269   1HG1  VAL  18          1HG1      VAL  18   4.104  -9.498   1.900
  270   2HG1  VAL  18          2HG1      VAL  18   4.337 -11.210   1.549
  271   3HG1  VAL  18          3HG1      VAL  18   2.710 -10.531   1.589
  272   1HG2  VAL  18          1HG2      VAL  18   5.428  -8.691   0.402
  273   2HG2  VAL  18          2HG2      VAL  18   3.998  -7.879  -0.233
  274   3HG2  VAL  18          3HG2      VAL  18   5.092  -8.722  -1.329
  275    H    CYS  19           H        CYS  19   2.230 -12.136  -1.256
  276    HA   CYS  19           HA       CYS  19   2.632 -14.412   0.610
  277   1HB   CYS  19          1HB       CYS  19   0.030 -13.799  -0.763
  278   2HB   CYS  19          2HB       CYS  19   0.308 -14.501   0.831
  279    H    GLY  20           H        GLY  20   0.854 -14.077  -2.483
  280   1HA   GLY  20          1HA       GLY  20   0.912 -15.442  -4.398
  281   2HA   GLY  20          2HA       GLY  20   2.443 -16.098  -3.812
  282    H    GLU  21           H        GLU  21   2.077 -17.514  -1.705
  283    HA   GLU  21           HA       GLU  21  -0.418 -19.116  -2.021
  284   1HB   GLU  21          1HB       GLU  21   1.368 -20.295  -3.236
  285   2HB   GLU  21          2HB       GLU  21   2.395 -20.238  -1.802
  286   1HG   GLU  21          1HG       GLU  21   1.490 -22.254  -1.295
  287   2HG   GLU  21          2HG       GLU  21   0.064 -21.334  -0.814
  288    H    ARG  22           H        ARG  22  -1.263 -18.316  -0.119
  289    HA   ARG  22           HA       ARG  22  -0.460 -19.575   2.335
  290   1HB   ARG  22          1HB       ARG  22   0.982 -17.228   1.742
  291   2HB   ARG  22          2HB       ARG  22  -0.245 -16.734   2.911
  292   1HG   ARG  22          1HG       ARG  22   0.772 -17.849   4.595
  293   2HG   ARG  22          2HG       ARG  22   0.988 -19.294   3.607
  294   1HD   ARG  22          1HD       ARG  22   2.929 -18.197   2.488
  295   2HD   ARG  22          2HD       ARG  22   2.744 -16.822   3.575
  296    HE   ARG  22           HE       ARG  22   3.473 -19.578   4.484
  297   1HH1  ARG  22          1HH1      ARG  22   2.302 -17.453   6.402
  298   2HH1  ARG  22          2HH1      ARG  22   3.758 -16.847   7.120
  299   1HH2  ARG  22          1HH2      ARG  22   5.837 -18.244   4.725
  300   2HH2  ARG  22          2HH2      ARG  22   5.757 -17.292   6.169
  301    H    GLY  23           H        GLY  23  -2.141 -16.931   0.725
  302   1HA   GLY  23          1HA       GLY  23  -4.731 -17.567   1.340
  303   2HA   GLY  23          2HA       GLY  23  -4.192 -16.707   2.786
  304    H    PHE  24           H        PHE  24  -6.042 -15.240   1.818
  305    HA   PHE  24           HA       PHE  24  -4.859 -12.848   0.873
  306   1HB   PHE  24          1HB       PHE  24  -4.862 -14.619  -1.169
  307   2HB   PHE  24          2HB       PHE  24  -6.463 -13.915  -1.386
  308    HD1  PHE  24           HD1      PHE  24  -2.915 -13.450  -1.834
  309    HD2  PHE  24           HD2      PHE  24  -6.663 -11.372  -1.524
  310    HE1  PHE  24           HE1      PHE  24  -1.901 -11.460  -2.915
  311    HE2  PHE  24           HE2      PHE  24  -5.648  -9.381  -2.603
  312    HZ   PHE  24           HZ       PHE  24  -3.270  -9.426  -3.298
  313    H    PHE  25           H        PHE  25  -6.489 -11.154   0.549
  314    HA   PHE  25           HA       PHE  25  -9.291 -11.999   1.038
  315   1HB   PHE  25          1HB       PHE  25  -7.995 -11.333   3.200
  316   2HB   PHE  25          2HB       PHE  25  -8.174  -9.688   2.601
  317    HD1  PHE  25           HD1      PHE  25  -9.690 -12.194   4.547
  318    HD2  PHE  25           HD2      PHE  25 -10.632  -9.111   1.705
  319    HE1  PHE  25           HE1      PHE  25 -12.030 -12.151   5.368
  320    HE2  PHE  25           HE2      PHE  25 -12.973  -9.068   2.526
  321    HZ   PHE  25           HZ       PHE  25 -13.671 -10.588   4.358
  322    H    TYR  26           H        TYR  26  -7.822  -8.777   1.124
  323    HA   TYR  26           HA       TYR  26  -8.351  -6.866  -0.143
  324   1HB   TYR  26          1HB       TYR  26  -7.105  -8.582  -1.746
  325   2HB   TYR  26          2HB       TYR  26  -8.675  -8.620  -2.548
  326    HD1  TYR  26           HD1      TYR  26  -6.502  -5.993  -0.954
  327    HD2  TYR  26           HD2      TYR  26  -8.862  -7.169  -4.347
  328    HE1  TYR  26           HE1      TYR  26  -5.994  -3.830  -2.057
  329    HE2  TYR  26           HE2      TYR  26  -8.353  -5.006  -5.451
  330    HH   TYR  26           HH       TYR  26  -7.513  -2.434  -4.156
  331    H    THR  27           H        THR  27 -10.043  -6.083  -1.933
  332    HA   THR  27           HA       THR  27 -12.665  -7.352  -1.258
  333    HB   THR  27           HB       THR  27 -12.082  -4.430  -1.816
  334    HG1  THR  27           HG1      THR  27 -12.635  -5.912   0.522
  335   1HG2  THR  27          1HG2      THR  27 -14.524  -4.314  -0.892
  336   2HG2  THR  27          2HG2      THR  27 -14.603  -6.007  -1.381
  337   3HG2  THR  27          3HG2      THR  27 -14.269  -4.757  -2.580
  338    H    LYS  28           H        LYS  28 -10.772  -5.675  -3.704
  339    HA   LYS  28           HA       LYS  28 -10.976  -5.613  -6.040
  340   1HB   LYS  28          1HB       LYS  28 -11.071  -8.246  -5.227
  341   2HB   LYS  28          2HB       LYS  28 -12.513  -8.104  -6.236
  342   1HG   LYS  28          1HG       LYS  28 -11.242  -7.338  -8.111
  343   2HG   LYS  28          2HG       LYS  28  -9.803  -7.092  -7.120
  344   1HD   LYS  28          1HD       LYS  28  -9.346  -9.372  -6.973
  345   2HD   LYS  28          2HD       LYS  28 -11.023  -9.830  -7.273
  346   1HE   LYS  28          1HE       LYS  28 -10.059  -8.357  -9.539
  347   2HE   LYS  28          2HE       LYS  28  -8.904  -9.636  -9.166
  348   1HZ   LYS  28          1HZ       LYS  28 -10.506 -11.270  -9.421
  349   2HZ   LYS  28          2HZ       LYS  28 -10.883 -10.182 -10.670
  350   3HZ   LYS  28          3HZ       LYS  28 -11.801 -10.190  -9.240
  351    HA   PRO  29           HA       PRO  29 -15.212  -4.062  -6.200
  352   1HB   PRO  29          1HB       PRO  29 -14.630  -2.107  -8.043
  353   2HB   PRO  29          2HB       PRO  29 -14.372  -1.917  -6.301
  354   1HG   PRO  29          1HG       PRO  29 -12.362  -2.377  -8.456
  355   2HG   PRO  29          2HG       PRO  29 -12.163  -1.575  -6.889
  356   1HD   PRO  29          1HD       PRO  29 -11.346  -4.210  -7.511
  357   2HD   PRO  29          2HD       PRO  29 -11.474  -3.515  -5.881
  358    H    THR  30           H        THR  30 -16.188  -3.126  -8.652
  359    HA   THR  30           HA       THR  30 -16.077  -5.615 -10.287
  360    HB   THR  30           HB       THR  30 -18.064  -3.463 -10.853
  361    HG1  THR  30           HG1      THR  30 -18.511  -5.269  -8.748
  362   1HG2  THR  30          1HG2      THR  30 -17.857  -5.730 -12.024
  363   2HG2  THR  30          2HG2      THR  30 -19.457  -5.310 -11.415
  364   3HG2  THR  30          3HG2      THR  30 -18.443  -6.442 -10.521
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1 -11.685   5.159  -4.990
    2   2H    GLY   1          2H        GLY   1 -10.897   6.539  -4.390
    3   3H    GLY   1          3H        GLY   1 -10.700   5.041  -3.613
    4   1HA   GLY   1          1HA       GLY   1  -9.874   5.117  -6.358
    5   2HA   GLY   1          2HA       GLY   1  -8.838   6.061  -5.245
    6    H    GLY   2           H        GLY   2 -10.635   3.112  -4.435
    7   1HA   GLY   2          1HA       GLY   2 -10.314   0.812  -5.036
    8   2HA   GLY   2          2HA       GLY   2  -8.945   1.292  -6.042
    9    H    GLY   3           H        GLY   3  -9.543   2.114  -2.634
   10   1HA   GLY   3          1HA       GLY   3  -8.398   1.330  -0.702
   11   2HA   GLY   3          2HA       GLY   3  -7.458   0.250  -1.734
   12    H    GLU   4           H        GLU   4  -7.122   2.863   0.221
   13    HA   GLU   4           HA       GLU   4  -4.948   4.050  -1.451
   14   1HB   GLU   4          1HB       GLU   4  -6.839   5.529  -0.542
   15   2HB   GLU   4          2HB       GLU   4  -6.122   5.274   1.049
   16   1HG   GLU   4          1HG       GLU   4  -4.260   6.531   0.565
   17   2HG   GLU   4          2HG       GLU   4  -4.272   6.078  -1.140
   18    H    GLN   5           H        GLN   5  -4.634   1.555   0.015
   19    HA   GLN   5           HA       GLN   5  -2.999   2.304   2.365
   20   1HB   GLN   5          1HB       GLN   5  -4.580   0.095   1.784
   21   2HB   GLN   5          2HB       GLN   5  -2.936  -0.510   1.569
   22   1HG   GLN   5          1HG       GLN   5  -2.523  -0.448   3.789
   23   2HG   GLN   5          2HG       GLN   5  -3.177   1.184   3.934
   24   1HE2  GLN   5          1HE2      GLN   5  -5.801   1.047   3.440
   25   2HE2  GLN   5          2HE2      GLN   5  -6.589  -0.114   4.396
   26    H    CYS   6           H        CYS   6  -0.750   1.766   2.497
   27    HA   CYS   6           HA       CYS   6   1.428   1.669   1.636
   28   1HB   CYS   6          1HB       CYS   6  -0.136  -0.281  -0.006
   29   2HB   CYS   6          2HB       CYS   6   1.484   0.146  -0.556
   30    H    CYS   7           H        CYS   7  -0.760   3.581   0.465
   31    HA   CYS   7           HA       CYS   7   0.733   4.283  -2.029
   32   1HB   CYS   7          1HB       CYS   7  -1.794   3.758  -2.112
   33   2HB   CYS   7          2HB       CYS   7  -2.011   5.302  -1.287
   34    H    THR   8           H        THR   8  -1.195   5.969   0.485
   35    HA   THR   8           HA       THR   8   0.191   8.459   0.146
   36    HB   THR   8           HB       THR   8  -0.734   8.684   2.661
   37    HG1  THR   8           HG1      THR   8  -2.792   7.282   2.331
   38   1HG2  THR   8          1HG2      THR   8  -1.584   9.404   0.111
   39   2HG2  THR   8          2HG2      THR   8  -2.268   9.981   1.632
   40   3HG2  THR   8          3HG2      THR   8  -2.988   8.598   0.809
   41    H    SER   9           H        SER   9   0.675   5.694   2.303
   42    HA   SER   9           HA       SER   9   3.098   7.021   3.419
   43   1HB   SER   9          1HB       SER   9   1.199   5.826   4.822
   44   2HB   SER   9          2HB       SER   9   2.078   4.366   4.376
   45    HG   SER   9           HG       SER   9   2.674   5.696   6.376
   46    H    ILE  10           H        ILE  10   4.631   4.828   4.061
   47    HA   ILE  10           HA       ILE  10   5.309   3.752   1.358
   48    HB   ILE  10           HB       ILE  10   7.051   3.935   3.835
   49   1HG1  ILE  10          1HG1      ILE  10   6.849   5.700   1.376
   50   2HG1  ILE  10          2HG1      ILE  10   6.551   6.175   3.049
   51   1HG2  ILE  10          1HG2      ILE  10   8.353   3.766   1.235
   52   2HG2  ILE  10          2HG2      ILE  10   7.305   2.378   1.526
   53   3HG2  ILE  10          3HG2      ILE  10   8.590   2.768   2.670
   54   1HD1  ILE  10          1HD1      ILE  10   9.012   6.261   1.656
   55   2HD1  ILE  10          2HD1      ILE  10   9.157   4.959   2.838
   56   3HD1  ILE  10          3HD1      ILE  10   8.739   6.589   3.367
   57    H    CYS  11           H        CYS  11   4.246   2.922   4.524
   58    HA   CYS  11           HA       CYS  11   4.055   0.851   5.643
   59   1HB   CYS  11          1HB       CYS  11   2.672  -0.712   4.394
   60   2HB   CYS  11          2HB       CYS  11   2.139   0.934   4.059
   61    H    SER  12           H        SER  12   4.248  -1.755   4.734
   62    HA   SER  12           HA       SER  12   6.984  -2.043   3.616
   63   1HB   SER  12          1HB       SER  12   7.512  -2.085   5.931
   64   2HB   SER  12          2HB       SER  12   6.075  -2.997   6.329
   65    HG   SER  12           HG       SER  12   8.176  -4.150   6.186
   66    H    LEU  13           H        LEU  13   7.470  -4.486   3.485
   67    HA   LEU  13           HA       LEU  13   5.347  -5.705   1.979
   68   1HB   LEU  13          1HB       LEU  13   6.822  -7.545   1.626
   69   2HB   LEU  13          2HB       LEU  13   7.868  -6.129   1.686
   70    HG   LEU  13           HG       LEU  13   7.298  -7.647   4.220
   71   1HD1  LEU  13          1HD1      LEU  13   9.663  -8.712   3.431
   72   2HD1  LEU  13          2HD1      LEU  13   8.845  -8.585   1.874
   73   3HD1  LEU  13          3HD1      LEU  13   8.111  -9.511   3.184
   74   1HD2  LEU  13          1HD2      LEU  13   8.750  -6.087   4.957
   75   2HD2  LEU  13          2HD2      LEU  13   9.016  -5.506   3.313
   76   3HD2  LEU  13          3HD2      LEU  13   9.988  -6.834   3.946
   77    H    TYR  14           H        TYR  14   5.886  -5.307   5.244
   78    HA   TYR  14           HA       TYR  14   4.679  -7.827   6.150
   79   1HB   TYR  14          1HB       TYR  14   5.789  -5.350   7.301
   80   2HB   TYR  14          2HB       TYR  14   4.507  -6.108   8.237
   81    HD1  TYR  14           HD1      TYR  14   7.919  -5.955   7.892
   82    HD2  TYR  14           HD2      TYR  14   4.752  -8.834   8.172
   83    HE1  TYR  14           HE1      TYR  14   9.546  -7.653   8.721
   84    HE2  TYR  14           HE2      TYR  14   6.368 -10.541   9.001
   85    HH   TYR  14           HH       TYR  14   9.206 -10.713   8.634
   86    H    GLN  15           H        GLN  15   3.871  -4.423   6.095
   87    HA   GLN  15           HA       GLN  15   1.289  -4.540   7.111
   88   1HB   GLN  15          1HB       GLN  15   1.840  -2.350   6.889
   89   2HB   GLN  15          2HB       GLN  15   2.850  -2.660   5.483
   90   1HG   GLN  15          1HG       GLN  15   1.126  -2.373   4.002
   91   2HG   GLN  15          2HG       GLN  15  -0.094  -2.919   5.151
   92   1HE2  GLN  15          1HE2      GLN  15   2.182  -0.582   6.365
   93   2HE2  GLN  15          2HE2      GLN  15   1.141   0.758   6.326
   94    H    LEU  16           H        LEU  16   2.247  -4.985   3.683
   95    HA   LEU  16           HA       LEU  16  -0.598  -5.532   3.107
   96   1HB   LEU  16          1HB       LEU  16   0.781  -6.478   0.899
   97   2HB   LEU  16          2HB       LEU  16   0.035  -4.893   1.049
   98    HG   LEU  16           HG       LEU  16   2.279  -4.188   2.145
   99   1HD1  LEU  16          1HD1      LEU  16   3.991  -5.802   0.757
  100   2HD1  LEU  16          2HD1      LEU  16   2.748  -6.956   1.240
  101   3HD1  LEU  16          3HD1      LEU  16   3.596  -6.011   2.461
  102   1HD2  LEU  16          1HD2      LEU  16   1.328  -4.253  -0.520
  103   2HD2  LEU  16          2HD2      LEU  16   3.030  -4.709  -0.592
  104   3HD2  LEU  16          3HD2      LEU  16   2.557  -3.180   0.150
  105    H    GLU  17           H        GLU  17   2.222  -7.208   4.060
  106    HA   GLU  17           HA       GLU  17   1.367  -9.847   3.186
  107   1HB   GLU  17          1HB       GLU  17   3.698  -9.631   3.696
  108   2HB   GLU  17          2HB       GLU  17   3.359  -8.867   5.249
  109   1HG   GLU  17          1HG       GLU  17   4.024 -11.213   5.574
  110   2HG   GLU  17          2HG       GLU  17   2.344 -10.973   6.058
  111    H    ASN  18           H        ASN  18   0.592  -7.680   5.754
  112    HA   ASN  18           HA       ASN  18  -0.529  -9.705   7.515
  113   1HB   ASN  18          1HB       ASN  18  -0.520  -6.707   7.411
  114   2HB   ASN  18          2HB       ASN  18  -1.708  -7.518   8.432
  115   1HD2  ASN  18          1HD2      ASN  18   0.154  -6.031   9.797
  116   2HD2  ASN  18          2HD2      ASN  18   1.306  -7.032  10.541
  117    H    TYR  19           H        TYR  19  -1.442  -8.511   4.539
  118    HA   TYR  19           HA       TYR  19  -4.325  -8.401   4.984
  119   1HB   TYR  19          1HB       TYR  19  -2.679  -8.528   2.445
  120   2HB   TYR  19          2HB       TYR  19  -4.427  -8.312   2.484
  121    HD1  TYR  19           HD1      TYR  19  -2.389  -6.381   1.277
  122    HD2  TYR  19           HD2      TYR  19  -4.205  -6.591   5.167
  123    HE1  TYR  19           HE1      TYR  19  -2.080  -3.934   1.554
  124    HE2  TYR  19           HE2      TYR  19  -3.894  -4.146   5.444
  125    HH   TYR  19           HH       TYR  19  -1.857  -2.333   3.598
  126    H    CYS  20           H        CYS  20  -1.980 -10.734   3.766
  127    HA   CYS  20           HA       CYS  20  -3.965 -12.647   2.895
  128   1HB   CYS  20          1HB       CYS  20  -1.225 -13.464   3.825
  129   2HB   CYS  20          2HB       CYS  20  -2.187 -14.121   2.504
  130    H    ASN  21           H        ASN  21  -3.451 -15.018   4.055
  131    HA   ASN  21           HA       ASN  21  -4.230 -14.565   6.910
  132   1HB   ASN  21          1HB       ASN  21  -5.790 -15.731   5.065
  133   2HB   ASN  21          2HB       ASN  21  -4.851 -17.146   5.544
  134   1HD2  ASN  21          1HD2      ASN  21  -6.406 -18.231   6.846
  135   2HD2  ASN  21          2HD2      ASN  21  -7.096 -17.550   8.241
  136   1H    PHE   1          1H        PHE   1  15.658  -5.476   2.604
  137   2H    PHE   1          2H        PHE   1  15.849  -4.173   3.678
  138   3H    PHE   1          3H        PHE   1  16.520  -4.097   2.119
  139    HA   PHE   1           HA       PHE   1  14.174  -4.312   1.244
  140   1HB   PHE   1          1HB       PHE   1  13.658  -3.611   4.151
  141   2HB   PHE   1          2HB       PHE   1  12.452  -3.508   2.868
  142    HD1  PHE   1           HD1      PHE   1  13.795  -5.588   5.378
  143    HD2  PHE   1           HD2      PHE   1  12.234  -5.705   1.377
  144    HE1  PHE   1           HE1      PHE   1  13.314  -8.008   5.637
  145    HE2  PHE   1           HE2      PHE   1  11.752  -8.124   1.635
  146    HZ   PHE   1           HZ       PHE   1  12.289  -9.276   3.765
  147    H    VAL   2           H        VAL   2  12.905  -2.165   1.031
  148    HA   VAL   2           HA       VAL   2  14.584   0.181   1.721
  149    HB   VAL   2           HB       VAL   2  13.574   0.224  -1.042
  150   1HG1  VAL   2          1HG1      VAL   2  15.290   1.676   0.532
  151   2HG1  VAL   2          2HG1      VAL   2  15.221   1.759  -1.229
  152   3HG1  VAL   2          3HG1      VAL   2  16.405   0.715  -0.440
  153   1HG2  VAL   2          1HG2      VAL   2  14.322  -2.011  -1.176
  154   2HG2  VAL   2          2HG2      VAL   2  15.714  -1.689  -0.140
  155   3HG2  VAL   2          3HG2      VAL   2  15.665  -1.041  -1.781
  156    H    ASN   3           H        ASN   3  13.149   1.794  -0.167
  157    HA   ASN   3           HA       ASN   3  10.514   1.900   1.235
  158   1HB   ASN   3          1HB       ASN   3  10.876   4.416   0.137
  159   2HB   ASN   3          2HB       ASN   3  11.181   3.984   1.818
  160   1HD2  ASN   3          1HD2      ASN   3  12.861   3.930  -1.379
  161   2HD2  ASN   3          2HD2      ASN   3  14.393   4.288  -0.742
  162    H    GLN   4           H        GLN   4   8.740   1.653  -0.030
  163    HA   GLN   4           HA       GLN   4   8.965   2.292  -2.933
  164   1HB   GLN   4          1HB       GLN   4   8.839  -0.327  -1.862
  165   2HB   GLN   4          2HB       GLN   4   7.243   0.010  -2.533
  166   1HG   GLN   4          1HG       GLN   4   8.324   0.750  -4.652
  167   2HG   GLN   4          2HG       GLN   4   9.893   0.302  -3.981
  168   1HE2  GLN   4          1HE2      GLN   4   9.924  -1.270  -5.890
  169   2HE2  GLN   4          2HE2      GLN   4   9.146  -2.767  -5.704
  170    H    HIS   5           H        HIS   5   6.484   1.877  -3.816
  171    HA   HIS   5           HA       HIS   5   4.495   2.785  -1.846
  172   1HB   HIS   5          1HB       HIS   5   4.006   4.680  -3.744
  173   2HB   HIS   5          2HB       HIS   5   4.944   4.980  -2.283
  174    HD2  HIS   5           HD2      HIS   5   7.710   5.301  -2.679
  175    HE1  HIS   5           HE1      HIS   5   7.594   4.944  -6.891
  176    HE2  HIS   5           HE2      HIS   5   9.060   5.540  -4.890
  177    H    LEU   6           H        LEU   6   2.616   1.795  -2.353
  178    HA   LEU   6           HA       LEU   6   2.041   1.213  -5.224
  179   1HB   LEU   6          1HB       LEU   6   1.501  -0.713  -2.944
  180   2HB   LEU   6          2HB       LEU   6   1.282  -1.016  -4.668
  181    HG   LEU   6           HG       LEU   6   3.988  -0.188  -3.674
  182   1HD1  LEU   6          1HD1      LEU   6   4.436  -2.728  -3.493
  183   2HD1  LEU   6          2HD1      LEU   6   2.687  -2.893  -3.343
  184   3HD1  LEU   6          3HD1      LEU   6   3.588  -1.959  -2.151
  185   1HD2  LEU   6          1HD2      LEU   6   2.880  -1.877  -5.928
  186   2HD2  LEU   6          2HD2      LEU   6   4.600  -1.809  -5.555
  187   3HD2  LEU   6          3HD2      LEU   6   3.745  -0.349  -6.053
  188    H    CYS   7           H        CYS   7  -0.342   0.831  -5.576
  189    HA   CYS   7           HA       CYS   7  -2.073   1.873  -3.406
  190   1HB   CYS   7          1HB       CYS   7  -2.260   3.079  -6.163
  191   2HB   CYS   7          2HB       CYS   7  -2.944   3.681  -4.653
  192    H    GLY   8           H        GLY   8  -2.009   0.749  -6.813
  193   1HA   GLY   8          1HA       GLY   8  -4.401  -0.911  -6.143
  194   2HA   GLY   8          2HA       GLY   8  -4.383   0.054  -7.618
  195    H    SER   9           H        SER   9  -3.663  -0.955  -9.417
  196    HA   SER   9           HA       SER   9  -3.082  -3.622  -9.695
  197   1HB   SER   9          1HB       SER   9  -2.886  -1.363 -11.350
  198   2HB   SER   9          2HB       SER   9  -1.300  -2.126 -11.430
  199    HG   SER   9           HG       SER   9  -3.589  -3.733 -11.569
  200    H    ASP  10           H        ASP  10  -0.723  -1.091  -8.852
  201    HA   ASP  10           HA       ASP  10   1.498  -2.967  -8.818
  202   1HB   ASP  10          1HB       ASP  10   1.147  -0.127  -8.568
  203   2HB   ASP  10          2HB       ASP  10   2.103  -0.708  -7.203
  204    H    LEU  11           H        LEU  11  -0.840  -1.801  -6.506
  205    HA   LEU  11           HA       LEU  11   0.520  -2.686  -4.136
  206   1HB   LEU  11          1HB       LEU  11  -1.993  -1.490  -4.779
  207   2HB   LEU  11          2HB       LEU  11  -2.302  -2.911  -3.781
  208    HG   LEU  11           HG       LEU  11  -0.391  -0.650  -3.116
  209   1HD1  LEU  11          1HD1      LEU  11  -2.157  -0.722  -1.089
  210   2HD1  LEU  11          2HD1      LEU  11  -3.199  -1.325  -2.377
  211   3HD1  LEU  11          3HD1      LEU  11  -2.426   0.253  -2.535
  212   1HD2  LEU  11          1HD2      LEU  11  -1.051  -2.458  -0.952
  213   2HD2  LEU  11          2HD2      LEU  11   0.537  -2.011  -1.575
  214   3HD2  LEU  11          3HD2      LEU  11  -0.348  -3.353  -2.301
  215    H    VAL  12           H        VAL  12  -2.192  -4.156  -5.890
  216    HA   VAL  12           HA       VAL  12  -2.138  -6.633  -4.508
  217    HB   VAL  12           HB       VAL  12  -3.557  -7.470  -6.224
  218   1HG1  VAL  12          1HG1      VAL  12  -4.172  -5.188  -5.009
  219   2HG1  VAL  12          2HG1      VAL  12  -5.205  -5.838  -6.282
  220   3HG1  VAL  12          3HG1      VAL  12  -4.061  -4.547  -6.648
  221   1HG2  VAL  12          1HG2      VAL  12  -3.612  -6.016  -8.443
  222   2HG2  VAL  12          2HG2      VAL  12  -2.399  -7.280  -8.237
  223   3HG2  VAL  12          3HG2      VAL  12  -1.973  -5.593  -7.951
  224    H    GLU  13           H        GLU  13  -0.225  -5.422  -7.170
  225    HA   GLU  13           HA       GLU  13   0.946  -7.896  -7.995
  226   1HB   GLU  13          1HB       GLU  13   1.180  -5.437  -8.969
  227   2HB   GLU  13          2HB       GLU  13   2.583  -5.379  -7.902
  228   1HG   GLU  13          1HG       GLU  13   3.156  -7.703  -8.980
  229   2HG   GLU  13          2HG       GLU  13   2.085  -7.157 -10.271
  230    H    ALA  14           H        ALA  14   1.427  -5.803  -5.253
  231    HA   ALA  14           HA       ALA  14   3.885  -7.186  -4.408
  232   1HB   ALA  14          1HB       ALA  14   2.993  -5.658  -2.264
  233   2HB   ALA  14          2HB       ALA  14   2.443  -4.747  -3.671
  234   3HB   ALA  14          3HB       ALA  14   4.154  -5.135  -3.486
  235    H    LEU  15           H        LEU  15   0.479  -7.529  -4.047
  236    HA   LEU  15           HA       LEU  15   0.702  -9.052  -1.524
  237   1HB   LEU  15          1HB       LEU  15  -1.508  -8.053  -3.254
  238   2HB   LEU  15          2HB       LEU  15  -1.818  -9.543  -2.363
  239    HG   LEU  15           HG       LEU  15  -0.584  -7.236  -0.903
  240   1HD1  LEU  15          1HD1      LEU  15  -2.424  -5.919  -0.966
  241   2HD1  LEU  15          2HD1      LEU  15  -3.508  -7.295  -0.763
  242   3HD1  LEU  15          3HD1      LEU  15  -2.918  -6.869  -2.369
  243   1HD2  LEU  15          1HD2      LEU  15  -1.027  -8.602   0.837
  244   2HD2  LEU  15          2HD2      LEU  15  -1.641  -9.806  -0.295
  245   3HD2  LEU  15          3HD2      LEU  15  -2.738  -8.622   0.414
  246    H    TYR  16           H        TYR  16   0.290  -9.510  -4.948
  247    HA   TYR  16           HA       TYR  16  -0.122 -12.382  -4.824
  248   1HB   TYR  16          1HB       TYR  16  -0.961 -11.604  -6.817
  249   2HB   TYR  16          2HB       TYR  16   0.190 -10.275  -6.897
  250    HD1  TYR  16           HD1      TYR  16  -0.344 -13.863  -7.628
  251    HD2  TYR  16           HD2      TYR  16   2.357 -10.537  -7.953
  252    HE1  TYR  16           HE1      TYR  16   1.043 -15.146  -9.238
  253    HE2  TYR  16           HE2      TYR  16   3.743 -11.819  -9.561
  254    HH   TYR  16           HH       TYR  16   4.133 -14.376 -10.016
  255    H    LEU  17           H        LEU  17   2.596 -10.248  -4.721
  256    HA   LEU  17           HA       LEU  17   4.463 -12.495  -5.314
  257   1HB   LEU  17          1HB       LEU  17   5.041 -10.609  -6.633
  258   2HB   LEU  17          2HB       LEU  17   4.775  -9.490  -5.297
  259    HG   LEU  17           HG       LEU  17   6.705 -10.581  -4.097
  260   1HD1  LEU  17          1HD1      LEU  17   6.425 -12.652  -5.724
  261   2HD1  LEU  17          2HD1      LEU  17   8.016 -12.212  -5.104
  262   3HD1  LEU  17          3HD1      LEU  17   7.542 -11.735  -6.735
  263   1HD2  LEU  17          1HD2      LEU  17   8.410  -9.697  -5.956
  264   2HD2  LEU  17          2HD2      LEU  17   7.387  -8.586  -5.044
  265   3HD2  LEU  17          3HD2      LEU  17   6.922  -9.077  -6.672
  266    H    VAL  18           H        VAL  18   3.175 -10.595  -2.764
  267    HA   VAL  18           HA       VAL  18   5.427 -10.952  -0.948
  268    HB   VAL  18           HB       VAL  18   2.673  -9.810  -0.762
  269   1HG1  VAL  18          1HG1      VAL  18   4.132 -11.127   1.478
  270   2HG1  VAL  18          2HG1      VAL  18   2.403 -10.843   1.277
  271   3HG1  VAL  18          3HG1      VAL  18   3.455  -9.532   1.811
  272   1HG2  VAL  18          1HG2      VAL  18   3.817  -7.877  -0.230
  273   2HG2  VAL  18          2HG2      VAL  18   5.023  -8.697  -1.224
  274   3HG2  VAL  18          3HG2      VAL  18   5.144  -8.751   0.534
  275    H    CYS  19           H        CYS  19   2.103 -12.190  -0.899
  276    HA   CYS  19           HA       CYS  19   3.009 -14.331   0.881
  277   1HB   CYS  19          1HB       CYS  19   0.247 -13.730  -0.213
  278   2HB   CYS  19          2HB       CYS  19   0.612 -14.940   1.017
  279    H    GLY  20           H        GLY  20   1.081 -14.303  -2.151
  280   1HA   GLY  20          1HA       GLY  20   1.367 -15.706  -4.049
  281   2HA   GLY  20          2HA       GLY  20   2.717 -16.491  -3.227
  282    H    GLU  21           H        GLU  21   2.128 -17.979  -1.412
  283    HA   GLU  21           HA       GLU  21  -0.563 -19.216  -1.855
  284   1HB   GLU  21          1HB       GLU  21   1.773 -20.409  -2.544
  285   2HB   GLU  21          2HB       GLU  21   1.646 -20.937  -0.865
  286   1HG   GLU  21          1HG       GLU  21  -0.495 -21.939  -1.246
  287   2HG   GLU  21          2HG       GLU  21  -0.641 -21.179  -2.831
  288    H    ARG  22           H        ARG  22  -1.751 -18.855  -0.045
  289    HA   ARG  22           HA       ARG  22  -1.108 -19.849   2.514
  290   1HB   ARG  22          1HB       ARG  22   0.501 -17.693   2.068
  291   2HB   ARG  22          2HB       ARG  22  -0.899 -16.904   2.792
  292   1HG   ARG  22          1HG       ARG  22  -0.054 -17.516   4.794
  293   2HG   ARG  22          2HG       ARG  22  -0.521 -19.165   4.375
  294   1HD   ARG  22          1HD       ARG  22   1.625 -19.764   3.753
  295   2HD   ARG  22          2HD       ARG  22   2.067 -18.118   3.303
  296    HE   ARG  22           HE       ARG  22   2.743 -19.221   5.754
  297   1HH1  ARG  22          1HH1      ARG  22   3.436 -16.414   5.164
  298   2HH1  ARG  22          2HH1      ARG  22   2.525 -15.532   6.344
  299   1HH2  ARG  22          1HH2      ARG  22   0.411 -18.183   7.076
  300   2HH2  ARG  22          2HH2      ARG  22   0.810 -16.535   7.426
  301    H    GLY  23           H        GLY  23  -2.744 -17.382   0.625
  302   1HA   GLY  23          1HA       GLY  23  -5.299 -17.726   0.792
  303   2HA   GLY  23          2HA       GLY  23  -5.048 -17.493   2.523
  304    H    PHE  24           H        PHE  24  -3.355 -15.768  -0.054
  305    HA   PHE  24           HA       PHE  24  -3.782 -13.208   1.148
  306   1HB   PHE  24          1HB       PHE  24  -1.956 -13.151  -0.261
  307   2HB   PHE  24          2HB       PHE  24  -2.693 -14.235  -1.435
  308    HD1  PHE  24           HD1      PHE  24  -3.775 -10.947   0.034
  309    HD2  PHE  24           HD2      PHE  24  -2.813 -13.185  -3.506
  310    HE1  PHE  24           HE1      PHE  24  -4.404  -8.999  -1.370
  311    HE2  PHE  24           HE2      PHE  24  -3.440 -11.240  -4.908
  312    HZ   PHE  24           HZ       PHE  24  -4.239  -9.146  -3.842
  313    H    PHE  25           H        PHE  25  -5.572 -11.949   1.103
  314    HA   PHE  25           HA       PHE  25  -7.550 -12.394  -1.095
  315   1HB   PHE  25          1HB       PHE  25  -8.083 -13.257   1.355
  316   2HB   PHE  25          2HB       PHE  25  -8.461 -11.557   1.633
  317    HD1  PHE  25           HD1      PHE  25  -8.974 -13.981  -1.200
  318    HD2  PHE  25           HD2      PHE  25 -10.728 -11.087   1.449
  319    HE1  PHE  25           HE1      PHE  25 -11.166 -14.278  -2.325
  320    HE2  PHE  25           HE2      PHE  25 -12.919 -11.383   0.324
  321    HZ   PHE  25           HZ       PHE  25 -13.138 -12.980  -1.562
  322    H    TYR  26           H        TYR  26  -8.298 -10.520  -2.043
  323    HA   TYR  26           HA       TYR  26  -7.477  -7.946  -0.755
  324   1HB   TYR  26          1HB       TYR  26  -6.144  -8.355  -2.770
  325   2HB   TYR  26          2HB       TYR  26  -7.613  -8.632  -3.709
  326    HD1  TYR  26           HD1      TYR  26  -6.922  -6.060  -1.084
  327    HD2  TYR  26           HD2      TYR  26  -7.709  -6.835  -5.238
  328    HE1  TYR  26           HE1      TYR  26  -7.118  -3.622  -1.502
  329    HE2  TYR  26           HE2      TYR  26  -7.905  -4.397  -5.655
  330    HH   TYR  26           HH       TYR  26  -8.198  -2.123  -3.159
  331    H    THR  27           H        THR  27  -9.163  -6.599  -0.324
  332    HA   THR  27           HA       THR  27 -11.769  -7.189  -1.670
  333    HB   THR  27           HB       THR  27 -11.880  -5.519   0.739
  334    HG1  THR  27           HG1      THR  27 -10.728  -8.094   0.786
  335   1HG2  THR  27          1HG2      THR  27 -13.516  -7.447   1.313
  336   2HG2  THR  27          2HG2      THR  27 -13.217  -7.995  -0.338
  337   3HG2  THR  27          3HG2      THR  27 -13.915  -6.400  -0.049
  338    H    LYS  28           H        LYS  28 -13.191  -4.986  -1.379
  339    HA   LYS  28           HA       LYS  28 -11.759  -2.513  -1.689
  340   1HB   LYS  28          1HB       LYS  28 -11.079  -2.941  -3.834
  341   2HB   LYS  28          2HB       LYS  28 -12.371  -4.095  -4.137
  342   1HG   LYS  28          1HG       LYS  28 -13.957  -2.346  -4.548
  343   2HG   LYS  28          2HG       LYS  28 -12.877  -1.120  -3.886
  344   1HD   LYS  28          1HD       LYS  28 -11.248  -1.762  -5.759
  345   2HD   LYS  28          2HD       LYS  28 -12.597  -2.636  -6.486
  346   1HE   LYS  28          1HE       LYS  28 -12.544   0.317  -5.800
  347   2HE   LYS  28          2HE       LYS  28 -12.477  -0.375  -7.422
  348   1HZ   LYS  28          1HZ       LYS  28 -14.732  -0.237  -5.548
  349   2HZ   LYS  28          2HZ       LYS  28 -14.660  -1.532  -6.645
  350   3HZ   LYS  28          3HZ       LYS  28 -14.697   0.068  -7.216
  351    HA   PRO  29           HA       PRO  29 -16.388  -1.728  -2.444
  352   1HB   PRO  29          1HB       PRO  29 -18.012  -3.860  -3.046
  353   2HB   PRO  29          2HB       PRO  29 -17.181  -2.891  -4.275
  354   1HG   PRO  29          1HG       PRO  29 -16.525  -5.631  -3.283
  355   2HG   PRO  29          2HG       PRO  29 -16.213  -4.906  -4.868
  356   1HD   PRO  29          1HD       PRO  29 -14.304  -5.231  -2.824
  357   2HD   PRO  29          2HD       PRO  29 -14.144  -4.167  -4.235
  358    H    THR  30           H        THR  30 -15.291  -4.503  -0.725
  359    HA   THR  30           HA       THR  30 -17.458  -4.137   1.305
  360    HB   THR  30           HB       THR  30 -15.696  -6.575   0.945
  361    HG1  THR  30           HG1      THR  30 -18.382  -6.577   0.241
  362   1HG2  THR  30          1HG2      THR  30 -18.036  -7.362   2.121
  363   2HG2  THR  30          2HG2      THR  30 -17.839  -5.743   2.793
  364   3HG2  THR  30          3HG2      THR  30 -16.570  -6.948   3.009
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1 -10.562  11.685   6.099
    2   2H    GLY   1          2H        GLY   1  -9.884  11.206   7.582
    3   3H    GLY   1          3H        GLY   1 -11.526  11.638   7.495
    4   1HA   GLY   1          1HA       GLY   1 -10.420   9.114   7.014
    5   2HA   GLY   1          2HA       GLY   1 -12.153   9.531   7.168
    6    H    GLY   2           H        GLY   2  -8.909   9.845   5.443
    7   1HA   GLY   2          1HA       GLY   2 -10.024   8.375   3.089
    8   2HA   GLY   2          2HA       GLY   2  -8.719   9.556   2.983
    9    H    GLY   3           H        GLY   3  -7.201   8.093   2.095
   10   1HA   GLY   3          1HA       GLY   3  -5.278   6.870   3.443
   11   2HA   GLY   3          2HA       GLY   3  -6.550   5.674   3.695
   12    H    GLU   4           H        GLU   4  -3.926   5.824   2.015
   13    HA   GLU   4           HA       GLU   4  -5.168   4.744  -0.483
   14   1HB   GLU   4          1HB       GLU   4  -2.820   5.485  -1.455
   15   2HB   GLU   4          2HB       GLU   4  -4.129   6.657  -1.305
   16   1HG   GLU   4          1HG       GLU   4  -2.274   6.249   1.015
   17   2HG   GLU   4          2HG       GLU   4  -1.733   7.223  -0.352
   18    H    GLN   5           H        GLN   5  -3.400   4.017   2.247
   19    HA   GLN   5           HA       GLN   5  -2.395   1.968   2.836
   20   1HB   GLN   5          1HB       GLN   5  -3.860   1.131   0.815
   21   2HB   GLN   5          2HB       GLN   5  -2.312   1.100  -0.031
   22   1HG   GLN   5          1HG       GLN   5  -2.501  -1.068   0.899
   23   2HG   GLN   5          2HG       GLN   5  -1.434  -0.213   2.013
   24   1HE2  GLN   5          1HE2      GLN   5  -2.024  -0.420   4.172
   25   2HE2  GLN   5          2HE2      GLN   5  -3.597  -0.726   4.730
   26    H    CYS   6           H        CYS   6  -1.172   2.513  -0.448
   27    HA   CYS   6           HA       CYS   6   1.401   3.455   0.652
   28   1HB   CYS   6          1HB       CYS   6   1.308   1.047  -1.180
   29   2HB   CYS   6          2HB       CYS   6   2.725   1.734  -0.388
   30    H    CYS   7           H        CYS   7  -0.729   4.593  -1.040
   31    HA   CYS   7           HA       CYS   7   0.574   4.759  -3.701
   32   1HB   CYS   7          1HB       CYS   7  -2.003   4.546  -3.232
   33   2HB   CYS   7          2HB       CYS   7  -1.902   6.282  -2.933
   34    H    THR   8           H        THR   8   0.304   6.513  -0.737
   35    HA   THR   8           HA       THR   8   1.855   8.733  -1.978
   36    HB   THR   8           HB       THR   8   0.553  10.401  -0.772
   37    HG1  THR   8           HG1      THR   8   0.045   8.975   0.993
   38   1HG2  THR   8          1HG2      THR   8  -0.280   9.735  -2.982
   39   2HG2  THR   8          2HG2      THR   8  -1.627  10.122  -1.910
   40   3HG2  THR   8          3HG2      THR   8  -1.223   8.438  -2.247
   41    H    SER   9           H        SER   9   2.295   6.327  -0.105
   42    HA   SER   9           HA       SER   9   3.961   7.829   1.824
   43   1HB   SER   9          1HB       SER   9   1.540   7.052   2.708
   44   2HB   SER   9          2HB       SER   9   2.423   5.551   2.973
   45    HG   SER   9           HG       SER   9   3.087   6.530   4.714
   46    H    ILE  10           H        ILE  10   4.612   5.459   3.358
   47    HA   ILE  10           HA       ILE  10   5.751   3.669   1.261
   48    HB   ILE  10           HB       ILE  10   7.490   4.207   3.603
   49   1HG1  ILE  10          1HG1      ILE  10   7.212   6.244   1.366
   50   2HG1  ILE  10          2HG1      ILE  10   6.605   6.484   3.005
   51   1HG2  ILE  10          1HG2      ILE  10   8.278   2.730   1.888
   52   2HG2  ILE  10          2HG2      ILE  10   9.178   4.236   1.696
   53   3HG2  ILE  10          3HG2      ILE  10   7.834   3.867   0.615
   54   1HD1  ILE  10          1HD1      ILE  10   9.274   6.873   2.015
   55   2HD1  ILE  10          2HD1      ILE  10   9.295   5.605   3.243
   56   3HD1  ILE  10          3HD1      ILE  10   8.643   7.197   3.630
   57    H    CYS  11           H        CYS  11   5.447   1.553   1.756
   58    HA   CYS  11           HA       CYS  11   4.879   0.849   4.610
   59   1HB   CYS  11          1HB       CYS  11   3.714  -0.721   2.330
   60   2HB   CYS  11          2HB       CYS  11   3.114  -0.544   3.979
   61    H    SER  12           H        SER  12   4.915  -1.891   4.431
   62    HA   SER  12           HA       SER  12   7.504  -2.523   3.087
   63   1HB   SER  12          1HB       SER  12   7.324  -2.246   5.805
   64   2HB   SER  12          2HB       SER  12   7.038  -3.955   5.608
   65    HG   SER  12           HG       SER  12   9.098  -2.785   4.137
   66    H    LEU  13           H        LEU  13   7.829  -5.010   3.456
   67    HA   LEU  13           HA       LEU  13   5.677  -6.302   2.033
   68   1HB   LEU  13          1HB       LEU  13   7.968  -7.668   3.463
   69   2HB   LEU  13          2HB       LEU  13   7.042  -8.284   2.093
   70    HG   LEU  13           HG       LEU  13   8.679  -5.740   1.962
   71   1HD1  LEU  13          1HD1      LEU  13   9.663  -8.365   2.188
   72   2HD1  LEU  13          2HD1      LEU  13  10.556  -6.942   1.655
   73   3HD1  LEU  13          3HD1      LEU  13   9.756  -7.976   0.471
   74   1HD2  LEU  13          1HD2      LEU  13   6.733  -6.307   0.328
   75   2HD2  LEU  13          2HD2      LEU  13   7.828  -7.533  -0.308
   76   3HD2  LEU  13          3HD2      LEU  13   8.286  -5.831  -0.361
   77    H    TYR  14           H        TYR  14   6.050  -5.493   5.244
   78    HA   TYR  14           HA       TYR  14   4.766  -7.844   6.399
   79   1HB   TYR  14          1HB       TYR  14   5.829  -5.261   7.299
   80   2HB   TYR  14          2HB       TYR  14   4.436  -5.833   8.210
   81    HD1  TYR  14           HD1      TYR  14   7.930  -6.494   7.275
   82    HD2  TYR  14           HD2      TYR  14   4.524  -7.945   9.453
   83    HE1  TYR  14           HE1      TYR  14   9.384  -8.118   8.469
   84    HE2  TYR  14           HE2      TYR  14   5.975  -9.570  10.647
   85    HH   TYR  14           HH       TYR  14   8.554 -10.681   9.815
   86    H    GLN  15           H        GLN  15   3.829  -4.492   5.779
   87    HA   GLN  15           HA       GLN  15   1.087  -4.803   6.513
   88   1HB   GLN  15          1HB       GLN  15   2.415  -2.906   4.564
   89   2HB   GLN  15          2HB       GLN  15   0.714  -2.795   5.024
   90   1HG   GLN  15          1HG       GLN  15   3.126  -2.547   6.832
   91   2HG   GLN  15          2HG       GLN  15   1.926  -1.306   6.468
   92   1HE2  GLN  15          1HE2      GLN  15  -0.484  -2.661   6.792
   93   2HE2  GLN  15          2HE2      GLN  15  -0.628  -3.230   8.385
   94    H    LEU  16           H        LEU  16   2.806  -5.236   3.478
   95    HA   LEU  16           HA       LEU  16   0.492  -5.893   1.901
   96   1HB   LEU  16          1HB       LEU  16   3.312  -6.959   1.528
   97   2HB   LEU  16          2HB       LEU  16   2.062  -6.801   0.295
   98    HG   LEU  16           HG       LEU  16   3.252  -4.460   1.812
   99   1HD1  LEU  16          1HD1      LEU  16   4.180  -4.068  -0.633
  100   2HD1  LEU  16          2HD1      LEU  16   4.009  -5.818  -0.754
  101   3HD1  LEU  16          3HD1      LEU  16   5.049  -5.118   0.486
  102   1HD2  LEU  16          1HD2      LEU  16   1.332  -3.531   1.001
  103   2HD2  LEU  16          2HD2      LEU  16   1.081  -4.833  -0.163
  104   3HD2  LEU  16          3HD2      LEU  16   2.200  -3.522  -0.535
  105    H    GLU  17           H        GLU  17   2.555  -7.623   4.150
  106    HA   GLU  17           HA       GLU  17   1.460 -10.248   3.487
  107   1HB   GLU  17          1HB       GLU  17   3.300  -9.157   5.591
  108   2HB   GLU  17          2HB       GLU  17   2.554 -10.735   5.845
  109   1HG   GLU  17          1HG       GLU  17   3.417 -11.480   3.641
  110   2HG   GLU  17          2HG       GLU  17   4.207  -9.917   3.439
  111    H    ASN  18           H        ASN  18   0.498  -7.550   5.375
  112    HA   ASN  18           HA       ASN  18  -1.088  -8.970   7.332
  113   1HB   ASN  18          1HB       ASN  18  -0.284  -6.464   7.267
  114   2HB   ASN  18          2HB       ASN  18  -1.782  -6.210   6.370
  115   1HD2  ASN  18          1HD2      ASN  18  -1.102  -5.309   9.164
  116   2HD2  ASN  18          2HD2      ASN  18  -2.305  -5.980  10.156
  117    H    TYR  19           H        TYR  19  -1.428  -8.746   4.012
  118    HA   TYR  19           HA       TYR  19  -4.407  -8.810   4.145
  119   1HB   TYR  19          1HB       TYR  19  -2.452  -8.295   1.907
  120   2HB   TYR  19          2HB       TYR  19  -4.149  -8.656   1.587
  121    HD1  TYR  19           HD1      TYR  19  -1.774  -6.190   2.867
  122    HD2  TYR  19           HD2      TYR  19  -5.939  -7.156   2.437
  123    HE1  TYR  19           HE1      TYR  19  -2.373  -3.838   3.383
  124    HE2  TYR  19           HE2      TYR  19  -6.538  -4.805   2.951
  125    HH   TYR  19           HH       TYR  19  -5.562  -2.612   2.914
  126    H    CYS  20           H        CYS  20  -1.831 -10.949   4.111
  127    HA   CYS  20           HA       CYS  20  -2.796 -12.910   2.229
  128   1HB   CYS  20          1HB       CYS  20  -1.244 -13.637   4.704
  129   2HB   CYS  20          2HB       CYS  20  -1.156 -14.351   3.096
  130    H    ASN  21           H        ASN  21  -3.100 -15.265   3.503
  131    HA   ASN  21           HA       ASN  21  -5.435 -14.817   5.324
  132   1HB   ASN  21          1HB       ASN  21  -5.496 -15.957   2.794
  133   2HB   ASN  21          2HB       ASN  21  -5.435 -17.357   3.866
  134   1HD2  ASN  21          1HD2      ASN  21  -7.800 -17.314   2.703
  135   2HD2  ASN  21          2HD2      ASN  21  -9.016 -16.610   3.656
  136   1H    PHE   1          1H        PHE   1  15.999  -4.033  -3.576
  137   2H    PHE   1          2H        PHE   1  16.899  -2.981  -2.593
  138   3H    PHE   1          3H        PHE   1  16.296  -2.443  -4.086
  139    HA   PHE   1           HA       PHE   1  14.008  -2.825  -3.231
  140   1HB   PHE   1          1HB       PHE   1  15.598  -3.888  -1.049
  141   2HB   PHE   1          2HB       PHE   1  14.521  -2.616  -0.474
  142    HD1  PHE   1           HD1      PHE   1  14.348  -5.397  -3.000
  143    HD2  PHE   1           HD2      PHE   1  12.454  -3.370   0.282
  144    HE1  PHE   1           HE1      PHE   1  12.421  -6.954  -3.149
  145    HE2  PHE   1           HE2      PHE   1  10.529  -4.926   0.133
  146    HZ   PHE   1           HZ       PHE   1  10.511  -6.718  -1.582
  147    H    VAL   2           H        VAL   2  13.635  -0.724  -3.822
  148    HA   VAL   2           HA       VAL   2  15.013   1.421  -2.266
  149    HB   VAL   2           HB       VAL   2  15.065   1.194  -4.904
  150   1HG1  VAL   2          1HG1      VAL   2  12.442   1.248  -4.811
  151   2HG1  VAL   2          2HG1      VAL   2  13.290   2.121  -6.086
  152   3HG1  VAL   2          3HG1      VAL   2  12.677   2.991  -4.681
  153   1HG2  VAL   2          1HG2      VAL   2  15.221   3.385  -3.035
  154   2HG2  VAL   2          2HG2      VAL   2  14.602   3.954  -4.585
  155   3HG2  VAL   2          3HG2      VAL   2  16.153   3.118  -4.508
  156    H    ASN   3           H        ASN   3  13.199   3.458  -2.934
  157    HA   ASN   3           HA       ASN   3  11.387   3.460  -0.829
  158   1HB   ASN   3          1HB       ASN   3  10.224   5.241  -1.940
  159   2HB   ASN   3          2HB       ASN   3  11.917   5.381  -2.416
  160   1HD2  ASN   3          1HD2      ASN   3   8.699   4.405  -3.561
  161   2HD2  ASN   3          2HD2      ASN   3   9.109   4.365  -5.208
  162    H    GLN   4           H        GLN   4   8.984   3.177  -0.854
  163    HA   GLN   4           HA       GLN   4   8.201   0.949  -2.694
  164   1HB   GLN   4          1HB       GLN   4   8.285   1.003   0.135
  165   2HB   GLN   4          2HB       GLN   4   6.578   1.049  -0.313
  166   1HG   GLN   4          1HG       GLN   4   6.830  -1.216  -0.471
  167   2HG   GLN   4          2HG       GLN   4   7.484  -0.822  -2.061
  168   1HE2  GLN   4          1HE2      GLN   4   8.242  -2.263   0.970
  169   2HE2  GLN   4          2HE2      GLN   4   9.914  -2.427   0.728
  170    H    HIS   5           H        HIS   5   7.034   2.072  -4.238
  171    HA   HIS   5           HA       HIS   5   4.723   3.680  -3.221
  172   1HB   HIS   5          1HB       HIS   5   6.368   4.137  -5.730
  173   2HB   HIS   5          2HB       HIS   5   4.919   5.042  -5.291
  174    HD2  HIS   5           HD2      HIS   5   5.995   5.065  -1.977
  175    HE1  HIS   5           HE1      HIS   5   8.869   7.663  -3.667
  176    HE2  HIS   5           HE2      HIS   5   7.797   6.875  -1.489
  177    H    LEU   6           H        LEU   6   2.955   2.406  -3.550
  178    HA   LEU   6           HA       LEU   6   2.569   1.258  -6.266
  179   1HB   LEU   6          1HB       LEU   6   2.099  -0.289  -3.699
  180   2HB   LEU   6          2HB       LEU   6   1.832  -0.879  -5.340
  181    HG   LEU   6           HG       LEU   6   4.519   0.070  -4.311
  182   1HD1  LEU   6          1HD1      LEU   6   4.408  -2.743  -4.868
  183   2HD1  LEU   6          2HD1      LEU   6   3.130  -2.343  -3.721
  184   3HD1  LEU   6          3HD1      LEU   6   4.806  -1.942  -3.348
  185   1HD2  LEU   6          1HD2      LEU   6   3.887  -1.658  -6.710
  186   2HD2  LEU   6          2HD2      LEU   6   5.385  -0.797  -6.353
  187   3HD2  LEU   6          3HD2      LEU   6   3.940   0.101  -6.817
  188    H    CYS   7           H        CYS   7   0.226   0.661  -6.610
  189    HA   CYS   7           HA       CYS   7  -1.676   1.867  -4.704
  190   1HB   CYS   7          1HB       CYS   7  -1.557   2.839  -7.572
  191   2HB   CYS   7          2HB       CYS   7  -2.627   3.420  -6.296
  192    H    GLY   8           H        GLY   8  -3.189   0.307  -4.532
  193   1HA   GLY   8          1HA       GLY   8  -4.493  -1.573  -5.113
  194   2HA   GLY   8          2HA       GLY   8  -4.995  -0.517  -6.432
  195    H    SER   9           H        SER   9  -4.213  -0.913  -8.501
  196    HA   SER   9           HA       SER   9  -3.592  -3.430  -9.389
  197   1HB   SER   9          1HB       SER   9  -2.610  -0.772 -10.437
  198   2HB   SER   9          2HB       SER   9  -2.306  -2.288 -11.281
  199    HG   SER   9           HG       SER   9  -4.336  -0.938 -11.703
  200    H    ASP  10           H        ASP  10  -0.997  -0.996  -8.902
  201    HA   ASP  10           HA       ASP  10   1.081  -2.974  -8.990
  202   1HB   ASP  10          1HB       ASP  10   0.891  -0.116  -8.671
  203   2HB   ASP  10          2HB       ASP  10   2.005  -0.772  -7.470
  204    H    LEU  11           H        LEU  11  -1.029  -1.888  -6.471
  205    HA   LEU  11           HA       LEU  11   0.631  -2.755  -4.265
  206   1HB   LEU  11          1HB       LEU  11  -2.088  -1.706  -4.627
  207   2HB   LEU  11          2HB       LEU  11  -1.950  -2.878  -3.315
  208    HG   LEU  11           HG       LEU  11  -0.099  -0.503  -3.657
  209   1HD1  LEU  11          1HD1      LEU  11  -2.723  -0.827  -2.264
  210   2HD1  LEU  11          2HD1      LEU  11  -2.045   0.591  -3.062
  211   3HD1  LEU  11          3HD1      LEU  11  -1.474   0.122  -1.460
  212   1HD2  LEU  11          1HD2      LEU  11   0.981  -1.249  -1.788
  213   2HD2  LEU  11          2HD2      LEU  11   0.310  -2.810  -2.259
  214   3HD2  LEU  11          3HD2      LEU  11  -0.507  -1.830  -1.041
  215    H    VAL  12           H        VAL  12  -1.895  -4.250  -6.215
  216    HA   VAL  12           HA       VAL  12  -2.084  -6.666  -4.665
  217    HB   VAL  12           HB       VAL  12  -2.627  -6.214  -7.613
  218   1HG1  VAL  12          1HG1      VAL  12  -4.183  -8.288  -6.337
  219   2HG1  VAL  12          2HG1      VAL  12  -2.463  -8.618  -6.128
  220   3HG1  VAL  12          3HG1      VAL  12  -3.131  -8.408  -7.747
  221   1HG2  VAL  12          1HG2      VAL  12  -4.090  -4.809  -6.410
  222   2HG2  VAL  12          2HG2      VAL  12  -4.267  -5.973  -5.097
  223   3HG2  VAL  12          3HG2      VAL  12  -5.033  -6.279  -6.656
  224    H    GLU  13           H        GLU  13  -0.249  -5.802  -7.556
  225    HA   GLU  13           HA       GLU  13   1.096  -8.232  -8.000
  226   1HB   GLU  13          1HB       GLU  13   1.296  -5.759  -9.097
  227   2HB   GLU  13          2HB       GLU  13   2.757  -5.759  -8.109
  228   1HG   GLU  13          1HG       GLU  13   3.536  -7.802  -9.170
  229   2HG   GLU  13          2HG       GLU  13   2.025  -7.954 -10.068
  230    H    ALA  14           H        ALA  14   1.514  -5.774  -5.558
  231    HA   ALA  14           HA       ALA  14   3.938  -6.954  -4.452
  232   1HB   ALA  14          1HB       ALA  14   3.492  -4.526  -4.285
  233   2HB   ALA  14          2HB       ALA  14   3.651  -5.260  -2.688
  234   3HB   ALA  14          3HB       ALA  14   2.053  -4.868  -3.324
  235    H    LEU  15           H        LEU  15   0.490  -7.169  -3.965
  236    HA   LEU  15           HA       LEU  15   0.727  -8.603  -1.408
  237   1HB   LEU  15          1HB       LEU  15  -1.623  -8.114  -3.265
  238   2HB   LEU  15          2HB       LEU  15  -1.741  -8.938  -1.709
  239    HG   LEU  15           HG       LEU  15  -0.402  -6.266  -1.767
  240   1HD1  LEU  15          1HD1      LEU  15  -2.330  -5.726  -3.072
  241   2HD1  LEU  15          2HD1      LEU  15  -2.720  -5.248  -1.420
  242   3HD1  LEU  15          3HD1      LEU  15  -3.372  -6.747  -2.082
  243   1HD2  LEU  15          1HD2      LEU  15  -1.996  -6.263   0.380
  244   2HD2  LEU  15          2HD2      LEU  15  -0.442  -7.096   0.394
  245   3HD2  LEU  15          3HD2      LEU  15  -1.928  -8.007   0.127
  246    H    TYR  16           H        TYR  16   0.337  -9.220  -4.790
  247    HA   TYR  16           HA       TYR  16  -0.305 -12.008  -4.683
  248   1HB   TYR  16          1HB       TYR  16  -0.550 -11.511  -6.875
  249   2HB   TYR  16          2HB       TYR  16   0.292  -9.984  -6.646
  250    HD1  TYR  16           HD1      TYR  16   1.033 -13.663  -6.971
  251    HD2  TYR  16           HD2      TYR  16   2.310  -9.636  -7.757
  252    HE1  TYR  16           HE1      TYR  16   3.001 -14.526  -8.215
  253    HE2  TYR  16           HE2      TYR  16   4.275 -10.499  -8.999
  254    HH   TYR  16           HH       TYR  16   4.966 -12.504 -10.169
  255    H    LEU  17           H        LEU  17   2.685 -10.229  -4.331
  256    HA   LEU  17           HA       LEU  17   4.281 -12.694  -4.604
  257   1HB   LEU  17          1HB       LEU  17   5.708 -11.196  -5.501
  258   2HB   LEU  17          2HB       LEU  17   4.744  -9.848  -4.914
  259    HG   LEU  17           HG       LEU  17   5.845 -10.242  -2.634
  260   1HD1  LEU  17          1HD1      LEU  17   8.236 -11.332  -3.219
  261   2HD1  LEU  17          2HD1      LEU  17   7.235 -12.226  -4.365
  262   3HD1  LEU  17          3HD1      LEU  17   6.877 -12.297  -2.640
  263   1HD2  LEU  17          1HD2      LEU  17   7.842  -8.983  -3.273
  264   2HD2  LEU  17          2HD2      LEU  17   6.464  -8.408  -4.211
  265   3HD2  LEU  17          3HD2      LEU  17   7.650  -9.482  -4.953
  266    H    VAL  18           H        VAL  18   3.508 -10.279  -2.157
  267    HA   VAL  18           HA       VAL  18   5.061 -11.216  -0.015
  268    HB   VAL  18           HB       VAL  18   2.748 -10.622   1.285
  269   1HG1  VAL  18          1HG1      VAL  18   3.903  -8.832   1.917
  270   2HG1  VAL  18          2HG1      VAL  18   4.040  -8.238   0.261
  271   3HG1  VAL  18          3HG1      VAL  18   5.168  -9.457   0.860
  272   1HG2  VAL  18          1HG2      VAL  18   2.063 -10.084  -1.357
  273   2HG2  VAL  18          2HG2      VAL  18   2.391  -8.527  -0.599
  274   3HG2  VAL  18          3HG2      VAL  18   1.209  -9.617   0.103
  275    H    CYS  19           H        CYS  19   1.697 -11.802  -0.386
  276    HA   CYS  19           HA       CYS  19   1.741 -14.215   1.250
  277   1HB   CYS  19          1HB       CYS  19  -0.548 -13.406  -0.541
  278   2HB   CYS  19          2HB       CYS  19  -0.607 -14.224   1.019
  279    H    GLY  20           H        GLY  20   0.464 -13.821  -2.031
  280   1HA   GLY  20          1HA       GLY  20   0.154 -15.602  -3.624
  281   2HA   GLY  20          2HA       GLY  20   1.889 -15.323  -3.704
  282    H    GLU  21           H        GLU  21  -0.018 -16.891  -1.098
  283    HA   GLU  21           HA       GLU  21   0.795 -19.559  -1.834
  284   1HB   GLU  21          1HB       GLU  21   3.012 -18.914  -1.204
  285   2HB   GLU  21          2HB       GLU  21   2.434 -18.112   0.256
  286   1HG   GLU  21          1HG       GLU  21   2.002 -20.134   1.354
  287   2HG   GLU  21          2HG       GLU  21   1.900 -21.043  -0.155
  288    H    ARG  22           H        ARG  22   0.984 -18.510   1.514
  289    HA   ARG  22           HA       ARG  22  -0.854 -20.342   2.527
  290   1HB   ARG  22          1HB       ARG  22  -1.296 -18.353   4.273
  291   2HB   ARG  22          2HB       ARG  22   0.211 -19.267   4.264
  292   1HG   ARG  22          1HG       ARG  22   1.366 -17.564   3.083
  293   2HG   ARG  22          2HG       ARG  22  -0.135 -16.758   2.621
  294   1HD   ARG  22          1HD       ARG  22   0.280 -15.419   4.412
  295   2HD   ARG  22          2HD       ARG  22  -0.341 -16.773   5.355
  296    HE   ARG  22           HE       ARG  22   2.573 -16.320   4.848
  297   1HH1  ARG  22          1HH1      ARG  22   0.162 -16.353   7.175
  298   2HH1  ARG  22          2HH1      ARG  22   1.011 -17.363   8.297
  299   1HH2  ARG  22          1HH2      ARG  22   3.574 -18.117   6.086
  300   2HH2  ARG  22          2HH2      ARG  22   2.942 -18.362   7.680
  301    H    GLY  23           H        GLY  23  -1.465 -17.256   0.990
  302   1HA   GLY  23          1HA       GLY  23  -3.841 -17.550  -0.155
  303   2HA   GLY  23          2HA       GLY  23  -4.373 -17.532   1.527
  304    H    PHE  24           H        PHE  24  -5.096 -15.564  -0.431
  305    HA   PHE  24           HA       PHE  24  -4.466 -13.187   1.071
  306   1HB   PHE  24          1HB       PHE  24  -2.448 -12.818   0.055
  307   2HB   PHE  24          2HB       PHE  24  -2.825 -13.873  -1.301
  308    HD1  PHE  24           HD1      PHE  24  -3.721 -10.526   0.140
  309    HD2  PHE  24           HD2      PHE  24  -3.332 -12.950  -3.387
  310    HE1  PHE  24           HE1      PHE  24  -4.203  -8.544  -1.274
  311    HE2  PHE  24           HE2      PHE  24  -3.813 -10.970  -4.802
  312    HZ   PHE  24           HZ       PHE  24  -4.250  -8.767  -3.747
  313    H    PHE  25           H        PHE  25  -5.687 -11.318   0.192
  314    HA   PHE  25           HA       PHE  25  -7.409 -11.745  -2.136
  315   1HB   PHE  25          1HB       PHE  25  -9.528 -11.595  -0.898
  316   2HB   PHE  25          2HB       PHE  25  -8.614 -13.012  -0.378
  317    HD1  PHE  25           HD1      PHE  25  -9.321  -9.446   0.486
  318    HD2  PHE  25           HD2      PHE  25  -7.977 -13.283   1.881
  319    HE1  PHE  25           HE1      PHE  25  -9.331  -8.602   2.819
  320    HE2  PHE  25           HE2      PHE  25  -7.988 -12.439   4.213
  321    HZ   PHE  25           HZ       PHE  25  -8.666 -10.098   4.683
  322    H    TYR  26           H        TYR  26  -8.252  -9.774  -2.884
  323    HA   TYR  26           HA       TYR  26  -8.132  -7.384  -1.178
  324   1HB   TYR  26          1HB       TYR  26  -5.864  -7.301  -1.852
  325   2HB   TYR  26          2HB       TYR  26  -6.238  -7.860  -3.481
  326    HD1  TYR  26           HD1      TYR  26  -6.093  -4.976  -1.233
  327    HD2  TYR  26           HD2      TYR  26  -7.344  -6.348  -5.110
  328    HE1  TYR  26           HE1      TYR  26  -6.299  -2.625  -2.000
  329    HE2  TYR  26           HE2      TYR  26  -7.549  -3.998  -5.876
  330    HH   TYR  26           HH       TYR  26  -7.979  -1.615  -4.413
  331    H    THR  27           H        THR  27  -9.881  -6.157  -1.732
  332    HA   THR  27           HA       THR  27 -10.657  -5.830  -4.536
  333    HB   THR  27           HB       THR  27 -12.815  -6.940  -2.781
  334    HG1  THR  27           HG1      THR  27 -12.068  -8.980  -4.009
  335   1HG2  THR  27          1HG2      THR  27 -13.715  -6.271  -4.804
  336   2HG2  THR  27          2HG2      THR  27 -13.281  -7.933  -5.200
  337   3HG2  THR  27          3HG2      THR  27 -12.230  -6.605  -5.694
  338    H    LYS  28           H        LYS  28 -10.469  -3.594  -4.144
  339    HA   LYS  28           HA       LYS  28 -11.274  -1.478  -3.536
  340   1HB   LYS  28          1HB       LYS  28 -13.491  -2.859  -4.039
  341   2HB   LYS  28          2HB       LYS  28 -13.718  -2.671  -2.299
  342   1HG   LYS  28          1HG       LYS  28 -13.353  -0.208  -2.568
  343   2HG   LYS  28          2HG       LYS  28 -13.293  -0.447  -4.315
  344   1HD   LYS  28          1HD       LYS  28 -15.627  -1.711  -3.071
  345   2HD   LYS  28          2HD       LYS  28 -15.588   0.038  -2.843
  346   1HE   LYS  28          1HE       LYS  28 -16.332   0.276  -4.954
  347   2HE   LYS  28          2HE       LYS  28 -14.810  -0.410  -5.519
  348   1HZ   LYS  28          1HZ       LYS  28 -17.399  -1.565  -5.519
  349   2HZ   LYS  28          2HZ       LYS  28 -16.318  -2.544  -4.649
  350   3HZ   LYS  28          3HZ       LYS  28 -15.979  -2.122  -6.260
  351    HA   PRO  29           HA       PRO  29  -9.936  -1.827   0.753
  352   1HB   PRO  29          1HB       PRO  29  -8.773   0.662   0.804
  353   2HB   PRO  29          2HB       PRO  29  -7.972  -0.777   0.149
  354   1HG   PRO  29          1HG       PRO  29  -9.186   1.525  -1.310
  355   2HG   PRO  29          2HG       PRO  29  -7.877   0.443  -1.812
  356   1HD   PRO  29          1HD       PRO  29 -10.569   0.300  -2.676
  357   2HD   PRO  29          2HD       PRO  29  -9.333  -0.956  -2.901
  358    H    THR  30           H        THR  30  -9.958   0.386   2.407
  359    HA   THR  30           HA       THR  30 -12.581   1.732   2.079
  360    HB   THR  30           HB       THR  30 -12.775   1.100   4.703
  361    HG1  THR  30           HG1      THR  30 -11.757  -1.244   3.500
  362   1HG2  THR  30          1HG2      THR  30 -13.798  -0.141   2.196
  363   2HG2  THR  30          2HG2      THR  30 -14.681   0.644   3.505
  364   3HG2  THR  30          3HG2      THR  30 -14.095  -1.008   3.703
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1  -9.688   8.456   7.786
    2   2H    GLY   1          2H        GLY   1  -8.673   9.636   7.109
    3   3H    GLY   1          3H        GLY   1  -8.002   8.290   7.899
    4   1HA   GLY   1          1HA       GLY   1  -7.898   7.455   5.805
    5   2HA   GLY   1          2HA       GLY   1  -9.628   7.060   6.034
    6    H    GLY   2           H        GLY   2  -8.275   6.902   3.685
    7   1HA   GLY   2          1HA       GLY   2  -8.924   8.972   1.948
    8   2HA   GLY   2          2HA       GLY   2  -7.292   9.362   2.492
    9    H    GLY   3           H        GLY   3  -8.701   8.112  -0.074
   10   1HA   GLY   3          1HA       GLY   3  -7.666   5.542  -0.547
   11   2HA   GLY   3          2HA       GLY   3  -7.919   6.744  -1.813
   12    H    GLU   4           H        GLU   4  -5.585   4.958  -0.162
   13    HA   GLU   4           HA       GLU   4  -3.423   6.000  -1.722
   14   1HB   GLU   4          1HB       GLU   4  -3.978   7.707   0.333
   15   2HB   GLU   4          2HB       GLU   4  -2.816   6.629   1.107
   16   1HG   GLU   4          1HG       GLU   4  -1.479   6.972  -1.149
   17   2HG   GLU   4          2HG       GLU   4  -2.437   8.450  -1.243
   18    H    GLN   5           H        GLN   5  -3.649   4.863   1.671
   19    HA   GLN   5           HA       GLN   5  -2.920   2.848   2.625
   20   1HB   GLN   5          1HB       GLN   5  -4.146   1.992   0.468
   21   2HB   GLN   5          2HB       GLN   5  -2.508   1.676  -0.103
   22   1HG   GLN   5          1HG       GLN   5  -3.516  -0.294   1.046
   23   2HG   GLN   5          2HG       GLN   5  -2.053   0.283   1.847
   24   1HE2  GLN   5          1HE2      GLN   5  -2.839  -0.641   3.910
   25   2HE2  GLN   5          2HE2      GLN   5  -4.063   0.140   4.789
   26    H    CYS   6           H        CYS   6  -1.099   2.821  -0.419
   27    HA   CYS   6           HA       CYS   6   1.371   3.506   1.056
   28   1HB   CYS   6          1HB       CYS   6   0.823   0.862  -0.279
   29   2HB   CYS   6          2HB       CYS   6   2.471   1.485  -0.173
   30    H    CYS   7           H        CYS   7  -0.305   4.732  -1.070
   31    HA   CYS   7           HA       CYS   7   1.190   4.470  -3.562
   32   1HB   CYS   7          1HB       CYS   7  -1.271   5.153  -3.316
   33   2HB   CYS   7          2HB       CYS   7  -0.671   6.731  -2.805
   34    H    THR   8           H        THR   8   1.348   6.466  -0.704
   35    HA   THR   8           HA       THR   8   3.477   8.113  -2.006
   36    HB   THR   8           HB       THR   8   3.020   9.796  -0.268
   37    HG1  THR   8           HG1      THR   8   2.324   8.653   1.440
   38   1HG2  THR   8          1HG2      THR   8   0.413   8.880  -1.503
   39   2HG2  THR   8          2HG2      THR   8   1.680   9.704  -2.413
   40   3HG2  THR   8          3HG2      THR   8   0.876  10.527  -1.076
   41    H    SER   9           H        SER   9   2.711   5.888   0.547
   42    HA   SER   9           HA       SER   9   5.303   6.369   1.900
   43   1HB   SER   9          1HB       SER   9   3.135   5.942   3.174
   44   2HB   SER   9          2HB       SER   9   3.216   4.284   2.584
   45    HG   SER   9           HG       SER   9   4.213   4.636   4.667
   46    H    ILE  10           H        ILE  10   6.601   4.315   2.418
   47    HA   ILE  10           HA       ILE  10   6.903   2.787  -0.101
   48    HB   ILE  10           HB       ILE  10   8.660   2.653   2.359
   49   1HG1  ILE  10          1HG1      ILE  10   9.886   4.255   0.399
   50   2HG1  ILE  10          2HG1      ILE  10   8.229   4.850   0.508
   51   1HG2  ILE  10          1HG2      ILE  10  10.191   2.367   0.076
   52   2HG2  ILE  10          2HG2      ILE  10   8.691   1.550  -0.364
   53   3HG2  ILE  10          3HG2      ILE  10   9.587   1.038   1.066
   54   1HD1  ILE  10          1HD1      ILE  10   8.694   5.861   2.460
   55   2HD1  ILE  10          2HD1      ILE  10  10.369   5.328   2.318
   56   3HD1  ILE  10          3HD1      ILE  10   9.191   4.319   3.158
   57    H    CYS  11           H        CYS  11   6.423   2.189   3.384
   58    HA   CYS  11           HA       CYS  11   5.707   0.248   4.501
   59   1HB   CYS  11          1HB       CYS  11   4.279  -0.685   2.048
   60   2HB   CYS  11          2HB       CYS  11   3.713  -0.605   3.714
   61    H    SER  12           H        SER  12   5.421  -2.337   3.940
   62    HA   SER  12           HA       SER  12   7.445  -3.238   2.015
   63   1HB   SER  12          1HB       SER  12   8.947  -2.847   3.813
   64   2HB   SER  12          2HB       SER  12   7.810  -3.469   5.002
   65    HG   SER  12           HG       SER  12   9.376  -4.839   3.108
   66    H    LEU  13           H        LEU  13   7.699  -5.766   2.444
   67    HA   LEU  13           HA       LEU  13   5.234  -6.971   1.858
   68   1HB   LEU  13          1HB       LEU  13   6.464  -9.111   2.788
   69   2HB   LEU  13          2HB       LEU  13   7.057  -8.318   1.328
   70    HG   LEU  13           HG       LEU  13   8.155  -7.106   3.742
   71   1HD1  LEU  13          1HD1      LEU  13   9.700  -9.107   4.148
   72   2HD1  LEU  13          2HD1      LEU  13   8.522 -10.070   3.257
   73   3HD1  LEU  13          3HD1      LEU  13   8.053  -9.267   4.756
   74   1HD2  LEU  13          1HD2      LEU  13   8.973  -6.831   1.388
   75   2HD2  LEU  13          2HD2      LEU  13   9.465  -8.524   1.398
   76   3HD2  LEU  13          3HD2      LEU  13  10.235  -7.376   2.493
   77    H    TYR  14           H        TYR  14   6.385  -5.885   4.887
   78    HA   TYR  14           HA       TYR  14   5.108  -7.652   6.683
   79   1HB   TYR  14          1HB       TYR  14   5.851  -4.756   6.766
   80   2HB   TYR  14          2HB       TYR  14   4.949  -5.468   8.101
   81    HD1  TYR  14           HD1      TYR  14   8.087  -5.696   6.125
   82    HD2  TYR  14           HD2      TYR  14   5.990  -6.975   9.649
   83    HE1  TYR  14           HE1      TYR  14  10.185  -6.682   7.015
   84    HE2  TYR  14           HE2      TYR  14   8.086  -7.960  10.541
   85    HH   TYR  14           HH       TYR  14  11.025  -7.213   9.569
   86    H    GLN  15           H        GLN  15   3.884  -4.437   5.777
   87    HA   GLN  15           HA       GLN  15   1.243  -4.941   6.698
   88   1HB   GLN  15          1HB       GLN  15   0.631  -2.903   5.743
   89   2HB   GLN  15          2HB       GLN  15   2.366  -2.691   5.932
   90   1HG   GLN  15          1HG       GLN  15   1.305  -3.825   3.353
   91   2HG   GLN  15          2HG       GLN  15   1.215  -2.093   3.646
   92   1HE2  GLN  15          1HE2      GLN  15   2.880  -2.939   1.585
   93   2HE2  GLN  15          2HE2      GLN  15   4.505  -2.763   2.047
   94    H    LEU  16           H        LEU  16   2.824  -5.558   3.653
   95    HA   LEU  16           HA       LEU  16   0.519  -6.352   2.154
   96   1HB   LEU  16          1HB       LEU  16   3.397  -7.304   1.961
   97   2HB   LEU  16          2HB       LEU  16   2.152  -7.614   0.751
   98    HG   LEU  16           HG       LEU  16   3.131  -4.886   1.631
   99   1HD1  LEU  16          1HD1      LEU  16   4.139  -4.732  -0.542
  100   2HD1  LEU  16          2HD1      LEU  16   3.366  -6.225  -1.074
  101   3HD1  LEU  16          3HD1      LEU  16   4.645  -6.278   0.139
  102   1HD2  LEU  16          1HD2      LEU  16   1.037  -5.738  -0.391
  103   2HD2  LEU  16          2HD2      LEU  16   1.671  -4.097  -0.252
  104   3HD2  LEU  16          3HD2      LEU  16   0.761  -4.808   1.082
  105    H    GLU  17           H        GLU  17   2.472  -7.931   4.595
  106    HA   GLU  17           HA       GLU  17   1.380 -10.592   4.087
  107   1HB   GLU  17          1HB       GLU  17   3.227  -9.344   6.046
  108   2HB   GLU  17          2HB       GLU  17   2.308 -10.724   6.644
  109   1HG   GLU  17          1HG       GLU  17   3.506 -11.041   3.947
  110   2HG   GLU  17          2HG       GLU  17   4.643 -10.979   5.295
  111    H    ASN  18           H        ASN  18   0.247  -7.759   5.588
  112    HA   ASN  18           HA       ASN  18  -1.497  -9.139   7.501
  113   1HB   ASN  18          1HB       ASN  18  -0.681  -6.393   6.954
  114   2HB   ASN  18          2HB       ASN  18  -2.423  -6.520   7.209
  115   1HD2  ASN  18          1HD2      ASN  18  -2.442  -5.622   9.355
  116   2HD2  ASN  18          2HD2      ASN  18  -1.709  -6.398  10.675
  117    H    TYR  19           H        TYR  19  -1.538  -8.772   4.208
  118    HA   TYR  19           HA       TYR  19  -4.510  -8.519   4.082
  119   1HB   TYR  19          1HB       TYR  19  -2.304  -8.088   2.075
  120   2HB   TYR  19          2HB       TYR  19  -3.963  -8.366   1.542
  121    HD1  TYR  19           HD1      TYR  19  -1.627  -5.926   2.679
  122    HD2  TYR  19           HD2      TYR  19  -5.810  -6.907   2.679
  123    HE1  TYR  19           HE1      TYR  19  -2.182  -3.558   3.171
  124    HE2  TYR  19           HE2      TYR  19  -6.366  -4.539   3.171
  125    HH   TYR  19           HH       TYR  19  -5.575  -2.503   3.530
  126    H    CYS  20           H        CYS  20  -2.018 -10.823   3.991
  127    HA   CYS  20           HA       CYS  20  -3.348 -12.641   2.122
  128   1HB   CYS  20          1HB       CYS  20  -1.285 -13.625   4.043
  129   2HB   CYS  20          2HB       CYS  20  -1.507 -14.015   2.341
  130    H    ASN  21           H        ASN  21  -3.485 -15.037   3.128
  131    HA   ASN  21           HA       ASN  21  -5.541 -14.808   5.244
  132   1HB   ASN  21          1HB       ASN  21  -5.817 -16.228   3.128
  133   2HB   ASN  21          2HB       ASN  21  -4.652 -17.340   3.847
  134   1HD2  ASN  21          1HD2      ASN  21  -6.155 -19.064   4.288
  135   2HD2  ASN  21          2HD2      ASN  21  -7.424 -18.903   5.404
  136   1H    PHE   1          1H        PHE   1  11.382  -2.514   1.417
  137   2H    PHE   1          2H        PHE   1  11.710  -4.174   1.275
  138   3H    PHE   1          3H        PHE   1  12.173  -3.105   0.037
  139    HA   PHE   1           HA       PHE   1  13.221  -2.827   2.780
  140   1HB   PHE   1          1HB       PHE   1  14.326  -4.503   0.511
  141   2HB   PHE   1          2HB       PHE   1  15.211  -4.105   1.985
  142    HD1  PHE   1           HD1      PHE   1  13.675  -6.745   0.571
  143    HD2  PHE   1           HD2      PHE   1  13.323  -4.356   4.125
  144    HE1  PHE   1           HE1      PHE   1  12.582  -8.642   1.736
  145    HE2  PHE   1           HE2      PHE   1  12.228  -6.255   5.292
  146    HZ   PHE   1           HZ       PHE   1  11.859  -8.398   4.096
  147    H    VAL   2           H        VAL   2  12.431  -1.206   0.226
  148    HA   VAL   2           HA       VAL   2  14.697   0.630   0.411
  149    HB   VAL   2           HB       VAL   2  15.292  -1.227  -1.274
  150   1HG1  VAL   2          1HG1      VAL   2  14.344  -0.967  -3.510
  151   2HG1  VAL   2          2HG1      VAL   2  13.303   0.333  -2.923
  152   3HG1  VAL   2          3HG1      VAL   2  13.076  -1.314  -2.335
  153   1HG2  VAL   2          1HG2      VAL   2  15.932   1.467  -1.164
  154   2HG2  VAL   2          2HG2      VAL   2  15.479   1.218  -2.851
  155   3HG2  VAL   2          3HG2      VAL   2  16.765   0.248  -2.130
  156    H    ASN   3           H        ASN   3  14.161   2.179  -1.802
  157    HA   ASN   3           HA       ASN   3  11.674   3.456  -1.036
  158   1HB   ASN   3          1HB       ASN   3  13.261   4.042  -3.542
  159   2HB   ASN   3          2HB       ASN   3  12.250   5.147  -2.608
  160   1HD2  ASN   3          1HD2      ASN   3  14.868   5.959  -3.066
  161   2HD2  ASN   3          2HD2      ASN   3  15.782   5.832  -1.642
  162    H    GLN   4           H        GLN   4   9.713   2.739  -1.697
  163    HA   GLN   4           HA       GLN   4   9.342   1.967  -4.525
  164   1HB   GLN   4          1HB       GLN   4   9.841  -0.050  -2.795
  165   2HB   GLN   4          2HB       GLN   4   8.099   0.102  -2.576
  166   1HG   GLN   4          1HG       GLN   4   7.902   0.051  -5.120
  167   2HG   GLN   4          2HG       GLN   4   9.598  -0.437  -5.147
  168   1HE2  GLN   4          1HE2      GLN   4   9.794  -2.218  -3.036
  169   2HE2  GLN   4          2HE2      GLN   4   8.747  -3.533  -3.266
  170    H    HIS   5           H        HIS   5   7.056   1.986  -5.132
  171    HA   HIS   5           HA       HIS   5   5.151   2.987  -3.101
  172   1HB   HIS   5          1HB       HIS   5   5.810   4.528  -5.631
  173   2HB   HIS   5          2HB       HIS   5   4.517   4.927  -4.499
  174    HD2  HIS   5           HD2      HIS   5   5.878   5.003  -1.668
  175    HE1  HIS   5           HE1      HIS   5   9.075   7.140  -3.427
  176    HE2  HIS   5           HE2      HIS   5   7.945   6.520  -1.225
  177    H    LEU   6           H        LEU   6   3.134   2.174  -3.505
  178    HA   LEU   6           HA       LEU   6   2.544   1.221  -6.271
  179   1HB   LEU   6          1HB       LEU   6   1.736  -0.310  -3.790
  180   2HB   LEU   6          2HB       LEU   6   1.676  -0.851  -5.468
  181    HG   LEU   6           HG       LEU   6   4.215  -0.175  -3.965
  182   1HD1  LEU   6          1HD1      LEU   6   3.181  -2.893  -4.815
  183   2HD1  LEU   6          2HD1      LEU   6   2.994  -2.250  -3.183
  184   3HD1  LEU   6          3HD1      LEU   6   4.606  -2.553  -3.832
  185   1HD2  LEU   6          1HD2      LEU   6   3.772  -0.149  -6.669
  186   2HD2  LEU   6          2HD2      LEU   6   4.273  -1.820  -6.415
  187   3HD2  LEU   6          3HD2      LEU   6   5.331  -0.498  -5.924
  188    H    CYS   7           H        CYS   7   0.295   1.285  -6.810
  189    HA   CYS   7           HA       CYS   7  -1.538   2.458  -4.797
  190   1HB   CYS   7          1HB       CYS   7  -1.340   3.744  -7.513
  191   2HB   CYS   7          2HB       CYS   7  -2.054   4.389  -6.035
  192    H    GLY   8           H        GLY   8  -2.456   0.259  -5.088
  193   1HA   GLY   8          1HA       GLY   8  -4.488  -0.749  -5.890
  194   2HA   GLY   8          2HA       GLY   8  -4.392   0.266  -7.328
  195    H    SER   9           H        SER   9  -3.811  -0.780  -9.147
  196    HA   SER   9           HA       SER   9  -3.302  -3.465  -9.455
  197   1HB   SER   9          1HB       SER   9  -1.641  -2.389 -11.387
  198   2HB   SER   9          2HB       SER   9  -3.376  -2.639 -11.557
  199    HG   SER   9           HG       SER   9  -3.693  -0.559 -11.334
  200    H    ASP  10           H        ASP  10  -0.802  -0.974  -8.884
  201    HA   ASP  10           HA       ASP  10   1.370  -2.871  -8.887
  202   1HB   ASP  10          1HB       ASP  10   1.046  -0.029  -8.571
  203   2HB   ASP  10          2HB       ASP  10   2.074  -0.642  -7.277
  204    H    LEU  11           H        LEU  11  -0.900  -1.793  -6.480
  205    HA   LEU  11           HA       LEU  11   0.613  -2.735  -4.197
  206   1HB   LEU  11          1HB       LEU  11  -2.129  -1.710  -4.692
  207   2HB   LEU  11          2HB       LEU  11  -1.936  -2.765  -3.292
  208    HG   LEU  11           HG       LEU  11  -0.211  -0.334  -3.852
  209   1HD1  LEU  11          1HD1      LEU  11  -1.941  -0.282  -1.494
  210   2HD1  LEU  11          2HD1      LEU  11  -2.856  -0.359  -3.001
  211   3HD1  LEU  11          3HD1      LEU  11  -1.701   0.948  -2.735
  212   1HD2  LEU  11          1HD2      LEU  11  -0.091  -2.567  -1.968
  213   2HD2  LEU  11          2HD2      LEU  11  -0.122  -1.006  -1.150
  214   3HD2  LEU  11          3HD2      LEU  11   1.132  -1.353  -2.341
  215    H    VAL  12           H        VAL  12  -1.698  -4.150  -6.408
  216    HA   VAL  12           HA       VAL  12  -2.095  -6.571  -4.861
  217    HB   VAL  12           HB       VAL  12  -2.455  -6.186  -7.846
  218   1HG1  VAL  12          1HG1      VAL  12  -3.082  -8.303  -5.887
  219   2HG1  VAL  12          2HG1      VAL  12  -2.888  -8.409  -7.637
  220   3HG1  VAL  12          3HG1      VAL  12  -4.420  -7.870  -6.950
  221   1HG2  VAL  12          1HG2      VAL  12  -4.634  -5.894  -5.787
  222   2HG2  VAL  12          2HG2      VAL  12  -4.598  -5.308  -7.451
  223   3HG2  VAL  12          3HG2      VAL  12  -3.621  -4.515  -6.214
  224    H    GLU  13           H        GLU  13   0.022  -5.569  -7.475
  225    HA   GLU  13           HA       GLU  13   1.244  -8.079  -8.012
  226   1HB   GLU  13          1HB       GLU  13   1.575  -5.559  -8.998
  227   2HB   GLU  13          2HB       GLU  13   3.026  -5.706  -8.007
  228   1HG   GLU  13          1HG       GLU  13   3.155  -8.094  -9.179
  229   2HG   GLU  13          2HG       GLU  13   2.216  -7.269 -10.423
  230    H    ALA  14           H        ALA  14   1.552  -5.805  -5.392
  231    HA   ALA  14           HA       ALA  14   3.910  -7.189  -4.274
  232   1HB   ALA  14          1HB       ALA  14   2.923  -4.585  -4.089
  233   2HB   ALA  14          2HB       ALA  14   4.221  -5.272  -3.113
  234   3HB   ALA  14          3HB       ALA  14   2.563  -5.290  -2.515
  235    H    LEU  15           H        LEU  15   0.469  -7.281  -4.105
  236    HA   LEU  15           HA       LEU  15   0.464  -8.669  -1.492
  237   1HB   LEU  15          1HB       LEU  15  -1.728  -7.881  -3.426
  238   2HB   LEU  15          2HB       LEU  15  -2.030  -8.850  -1.983
  239    HG   LEU  15           HG       LEU  15  -0.615  -6.183  -1.858
  240   1HD1  LEU  15          1HD1      LEU  15  -3.307  -6.614  -2.597
  241   2HD1  LEU  15          2HD1      LEU  15  -2.567  -5.090  -2.105
  242   3HD1  LEU  15          3HD1      LEU  15  -3.342  -6.123  -0.904
  243   1HD2  LEU  15          1HD2      LEU  15  -2.229  -6.957   0.412
  244   2HD2  LEU  15          2HD2      LEU  15  -0.494  -6.647   0.346
  245   3HD2  LEU  15          3HD2      LEU  15  -1.115  -8.259  -0.005
  246    H    TYR  16           H        TYR  16  -0.116  -9.260  -4.900
  247    HA   TYR  16           HA       TYR  16  -0.758 -12.060  -4.621
  248   1HB   TYR  16          1HB       TYR  16  -1.434 -11.008  -6.653
  249   2HB   TYR  16          2HB       TYR  16   0.171 -10.332  -6.926
  250    HD1  TYR  16           HD1      TYR  16  -1.827 -13.462  -6.933
  251    HD2  TYR  16           HD2      TYR  16   1.925 -11.625  -7.940
  252    HE1  TYR  16           HE1      TYR  16  -1.196 -15.471  -8.248
  253    HE2  TYR  16           HE2      TYR  16   2.556 -13.633  -9.254
  254    HH   TYR  16           HH       TYR  16   1.808 -15.563 -10.138
  255    H    LEU  17           H        LEU  17   2.156 -10.188  -4.658
  256    HA   LEU  17           HA       LEU  17   3.870 -12.544  -5.149
  257   1HB   LEU  17          1HB       LEU  17   4.342 -10.217  -6.090
  258   2HB   LEU  17          2HB       LEU  17   4.743  -9.737  -4.442
  259    HG   LEU  17           HG       LEU  17   6.314 -11.806  -4.459
  260   1HD1  LEU  17          1HD1      LEU  17   5.727 -11.386  -7.397
  261   2HD1  LEU  17          2HD1      LEU  17   5.604 -12.884  -6.475
  262   3HD1  LEU  17          3HD1      LEU  17   7.187 -12.192  -6.829
  263   1HD2  LEU  17          1HD2      LEU  17   6.781  -9.205  -4.732
  264   2HD2  LEU  17          2HD2      LEU  17   7.230  -9.686  -6.369
  265   3HD2  LEU  17          3HD2      LEU  17   8.072 -10.380  -4.984
  266    H    VAL  18           H        VAL  18   2.736 -10.521  -2.553
  267    HA   VAL  18           HA       VAL  18   4.662 -11.604  -0.617
  268    HB   VAL  18           HB       VAL  18   2.370  -9.652  -0.487
  269   1HG1  VAL  18          1HG1      VAL  18   3.496  -9.634   2.043
  270   2HG1  VAL  18          2HG1      VAL  18   3.369 -11.355   1.678
  271   3HG1  VAL  18          3HG1      VAL  18   1.933 -10.334   1.625
  272   1HG2  VAL  18          1HG2      VAL  18   4.098  -8.125   0.245
  273   2HG2  VAL  18          2HG2      VAL  18   4.686  -8.961  -1.193
  274   3HG2  VAL  18          3HG2      VAL  18   5.259  -9.443   0.403
  275    H    CYS  19           H        CYS  19   1.204 -11.803  -1.252
  276    HA   CYS  19           HA       CYS  19   0.878 -13.935   0.754
  277   1HB   CYS  19          1HB       CYS  19  -1.200 -12.842  -1.157
  278   2HB   CYS  19          2HB       CYS  19  -1.475 -13.701   0.358
  279    H    GLY  20           H        GLY  20   2.374 -14.191  -1.943
  280   1HA   GLY  20          1HA       GLY  20   0.793 -16.066  -3.496
  281   2HA   GLY  20          2HA       GLY  20   2.523 -15.777  -3.683
  282    H    GLU  21           H        GLU  21   0.526 -17.045  -0.966
  283    HA   GLU  21           HA       GLU  21   1.366 -19.734  -1.156
  284   1HB   GLU  21          1HB       GLU  21   3.603 -18.390  -0.656
  285   2HB   GLU  21          2HB       GLU  21   2.997 -18.439   0.999
  286   1HG   GLU  21          1HG       GLU  21   3.896 -20.506   1.131
  287   2HG   GLU  21          2HG       GLU  21   2.585 -21.031   0.076
  288    H    ARG  22           H        ARG  22   1.347 -17.421   1.586
  289    HA   ARG  22           HA       ARG  22  -0.150 -19.163   3.297
  290   1HB   ARG  22          1HB       ARG  22   0.591 -16.262   3.330
  291   2HB   ARG  22          2HB       ARG  22  -0.644 -16.828   4.454
  292   1HG   ARG  22          1HG       ARG  22   1.130 -17.355   5.780
  293   2HG   ARG  22          2HG       ARG  22   1.256 -18.774   4.739
  294   1HD   ARG  22          1HD       ARG  22   3.292 -18.080   4.087
  295   2HD   ARG  22          2HD       ARG  22   2.548 -16.648   3.376
  296    HE   ARG  22           HE       ARG  22   3.595 -15.466   5.114
  297   1HH1  ARG  22          1HH1      ARG  22   4.224 -18.584   5.933
  298   2HH1  ARG  22          2HH1      ARG  22   4.078 -18.387   7.649
  299   1HH2  ARG  22          1HH2      ARG  22   2.726 -15.198   7.429
  300   2HH2  ARG  22          2HH2      ARG  22   3.232 -16.465   8.497
  301    H    GLY  23           H        GLY  23  -1.148 -17.140   0.695
  302   1HA   GLY  23          1HA       GLY  23  -3.601 -17.848   0.107
  303   2HA   GLY  23          2HA       GLY  23  -3.963 -17.133   1.681
  304    H    PHE  24           H        PHE  24  -5.114 -15.306   1.015
  305    HA   PHE  24           HA       PHE  24  -3.836 -12.934   0.374
  306   1HB   PHE  24          1HB       PHE  24  -3.058 -13.848  -1.730
  307   2HB   PHE  24          2HB       PHE  24  -4.674 -14.426  -2.129
  308    HD1  PHE  24           HD1      PHE  24  -3.472 -11.150  -0.757
  309    HD2  PHE  24           HD2      PHE  24  -5.417 -13.215  -3.984
  310    HE1  PHE  24           HE1      PHE  24  -3.939  -8.981  -1.864
  311    HE2  PHE  24           HE2      PHE  24  -5.888 -11.047  -5.090
  312    HZ   PHE  24           HZ       PHE  24  -5.152  -8.927  -4.029
  313    H    PHE  25           H        PHE  25  -5.364 -11.220   0.303
  314    HA   PHE  25           HA       PHE  25  -8.203 -11.991  -0.111
  315   1HB   PHE  25          1HB       PHE  25  -6.971 -11.106   2.427
  316   2HB   PHE  25          2HB       PHE  25  -8.486 -10.308   2.000
  317    HD1  PHE  25           HD1      PHE  25  -7.006 -13.267   3.363
  318    HD2  PHE  25           HD2      PHE  25 -10.454 -11.817   1.249
  319    HE1  PHE  25           HE1      PHE  25  -8.273 -15.286   4.047
  320    HE2  PHE  25           HE2      PHE  25 -11.723 -13.837   1.934
  321    HZ   PHE  25           HZ       PHE  25 -10.632 -15.572   3.333
  322    H    TYR  26           H        TYR  26  -7.406  -8.954   1.387
  323    HA   TYR  26           HA       TYR  26  -7.676  -6.763   0.576
  324   1HB   TYR  26          1HB       TYR  26  -5.627  -7.394  -0.698
  325   2HB   TYR  26          2HB       TYR  26  -6.650  -8.019  -1.991
  326    HD1  TYR  26           HD1      TYR  26  -6.139  -4.920   0.057
  327    HD2  TYR  26           HD2      TYR  26  -7.283  -6.596  -3.729
  328    HE1  TYR  26           HE1      TYR  26  -6.332  -2.637  -0.892
  329    HE2  TYR  26           HE2      TYR  26  -7.478  -4.312  -4.682
  330    HH   TYR  26           HH       TYR  26  -7.874  -1.992  -3.829
  331    H    THR  27           H        THR  27  -9.962  -6.658   0.659
  332    HA   THR  27           HA       THR  27 -11.449  -7.662  -1.698
  333    HB   THR  27           HB       THR  27 -12.574  -8.363   0.221
  334    HG1  THR  27           HG1      THR  27 -14.375  -6.851   0.416
  335   1HG2  THR  27          1HG2      THR  27 -13.042  -6.362   1.985
  336   2HG2  THR  27          2HG2      THR  27 -11.484  -5.841   1.344
  337   3HG2  THR  27          3HG2      THR  27 -11.643  -7.431   2.089
  338    H    LYS  28           H        LYS  28 -10.923  -4.634   0.066
  339    HA   LYS  28           HA       LYS  28 -11.004  -2.971  -2.183
  340   1HB   LYS  28          1HB       LYS  28 -13.191  -3.440  -2.797
  341   2HB   LYS  28          2HB       LYS  28 -13.704  -3.736  -1.139
  342   1HG   LYS  28          1HG       LYS  28 -12.824  -0.965  -1.724
  343   2HG   LYS  28          2HG       LYS  28 -14.318  -1.472  -2.512
  344   1HD   LYS  28          1HD       LYS  28 -14.787  -2.444  -0.041
  345   2HD   LYS  28          2HD       LYS  28 -13.741  -1.088   0.381
  346   1HE   LYS  28          1HE       LYS  28 -15.535   0.257   0.179
  347   2HE   LYS  28          2HE       LYS  28 -15.507  -0.073  -1.553
  348   1HZ   LYS  28          1HZ       LYS  28 -17.138  -1.632  -1.381
  349   2HZ   LYS  28          2HZ       LYS  28 -17.601  -0.617  -0.100
  350   3HZ   LYS  28          3HZ       LYS  28 -16.745  -2.050   0.216
  351    HA   PRO  29           HA       PRO  29 -10.017  -0.350   1.273
  352   1HB   PRO  29          1HB       PRO  29  -9.238   1.808  -0.240
  353   2HB   PRO  29          2HB       PRO  29  -8.223   0.379   0.018
  354   1HG   PRO  29          1HG       PRO  29  -9.723   1.196  -2.423
  355   2HG   PRO  29          2HG       PRO  29  -8.282   0.174  -2.281
  356   1HD   PRO  29          1HD       PRO  29 -10.945  -0.727  -2.680
  357   2HD   PRO  29          2HD       PRO  29  -9.543  -1.734  -2.261
  358    H    THR  30           H        THR  30 -10.404   2.382   1.328
  359    HA   THR  30           HA       THR  30 -12.039   4.058   1.533
  360    HB   THR  30           HB       THR  30 -14.034   2.713  -0.180
  361    HG1  THR  30           HG1      THR  30 -12.581   3.287  -2.022
  362   1HG2  THR  30          1HG2      THR  30 -13.491   5.022  -1.393
  363   2HG2  THR  30          2HG2      THR  30 -12.767   5.394   0.171
  364   3HG2  THR  30          3HG2      THR  30 -14.474   4.966   0.070
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1 -12.595   8.162   1.216
    2   2H    GLY   1          2H        GLY   1 -12.444   6.544   0.723
    3   3H    GLY   1          3H        GLY   1 -13.917   7.363   0.509
    4   1HA   GLY   1          1HA       GLY   1 -13.140   8.379  -1.358
    5   2HA   GLY   1          2HA       GLY   1 -11.483   8.601  -0.716
    6    H    GLY   2           H        GLY   2 -12.824   5.428  -0.834
    7   1HA   GLY   2          1HA       GLY   2 -13.610   4.067  -2.714
    8   2HA   GLY   2          2HA       GLY   2 -12.881   5.239  -3.811
    9    H    GLY   3           H        GLY   3 -12.349   2.358  -2.006
   10   1HA   GLY   3          1HA       GLY   3 -10.544   0.855  -2.056
   11   2HA   GLY   3          2HA       GLY   3  -9.887   1.805  -3.390
   12    H    GLU   4           H        GLU   4  -8.052   2.928  -2.963
   13    HA   GLU   4           HA       GLU   4  -6.300   3.908  -1.753
   14   1HB   GLU   4          1HB       GLU   4  -7.849   5.571  -1.021
   15   2HB   GLU   4          2HB       GLU   4  -8.645   4.448   0.080
   16   1HG   GLU   4          1HG       GLU   4  -6.684   4.361   1.503
   17   2HG   GLU   4          2HG       GLU   4  -5.754   5.320   0.351
   18    H    GLN   5           H        GLN   5  -4.739   2.661  -0.869
   19    HA   GLN   5           HA       GLN   5  -5.269   1.215   1.642
   20   1HB   GLN   5          1HB       GLN   5  -5.852  -0.385  -0.202
   21   2HB   GLN   5          2HB       GLN   5  -4.196  -0.236  -0.789
   22   1HG   GLN   5          1HG       GLN   5  -3.359  -1.028   1.409
   23   2HG   GLN   5          2HG       GLN   5  -5.024  -1.225   1.957
   24   1HE2  GLN   5          1HE2      GLN   5  -6.380  -2.839   0.720
   25   2HE2  GLN   5          2HE2      GLN   5  -5.609  -4.147  -0.039
   26    H    CYS   6           H        CYS   6  -2.956   1.884  -0.944
   27    HA   CYS   6           HA       CYS   6  -0.971   2.780   1.014
   28   1HB   CYS   6          1HB       CYS   6  -0.683   0.192  -0.500
   29   2HB   CYS   6          2HB       CYS   6   0.745   1.130  -0.061
   30    H    CYS   7           H        CYS   7  -2.352   4.033  -1.165
   31    HA   CYS   7           HA       CYS   7  -0.327   4.223  -3.323
   32   1HB   CYS   7          1HB       CYS   7  -2.789   4.071  -3.845
   33   2HB   CYS   7          2HB       CYS   7  -2.990   5.651  -3.086
   34    H    THR   8           H        THR   8  -1.669   6.090  -0.651
   35    HA   THR   8           HA       THR   8   0.137   8.351  -1.388
   36    HB   THR   8           HB       THR   8  -2.191   9.019  -1.092
   37    HG1  THR   8           HG1      THR   8  -1.831  10.395   0.822
   38   1HG2  THR   8          1HG2      THR   8  -3.275   7.493   0.252
   39   2HG2  THR   8          2HG2      THR   8  -2.962   8.748   1.452
   40   3HG2  THR   8          3HG2      THR   8  -1.909   7.336   1.357
   41    H    SER   9           H        SER   9   0.330   5.634   0.363
   42    HA   SER   9           HA       SER   9   1.897   6.968   2.537
   43   1HB   SER   9          1HB       SER   9  -0.260   5.638   3.156
   44   2HB   SER   9          2HB       SER   9   0.714   4.212   2.814
   45    HG   SER   9           HG       SER   9   0.796   5.943   4.928
   46    H    ILE  10           H        ILE  10   2.833   4.232   3.358
   47    HA   ILE  10           HA       ILE  10   4.645   3.670   1.045
   48    HB   ILE  10           HB       ILE  10   5.611   3.397   3.876
   49   1HG1  ILE  10          1HG1      ILE  10   4.660   5.689   3.674
   50   2HG1  ILE  10          2HG1      ILE  10   6.419   5.716   3.816
   51   1HG2  ILE  10          1HG2      ILE  10   7.000   4.191   1.300
   52   2HG2  ILE  10          2HG2      ILE  10   6.893   2.533   1.891
   53   3HG2  ILE  10          3HG2      ILE  10   7.769   3.746   2.824
   54   1HD1  ILE  10          1HD1      ILE  10   5.460   5.499   1.044
   55   2HD1  ILE  10          2HD1      ILE  10   6.689   6.562   1.729
   56   3HD1  ILE  10          3HD1      ILE  10   4.984   6.995   1.845
   57    H    CYS  11           H        CYS  11   3.916   2.310   4.290
   58    HA   CYS  11           HA       CYS  11   3.303   0.120   4.889
   59   1HB   CYS  11          1HB       CYS  11   2.785  -0.490   1.984
   60   2HB   CYS  11          2HB       CYS  11   1.941  -1.095   3.409
   61    H    SER  12           H        SER  12   3.903  -2.302   4.106
   62    HA   SER  12           HA       SER  12   6.394  -2.455   2.585
   63   1HB   SER  12          1HB       SER  12   7.458  -1.768   4.582
   64   2HB   SER  12          2HB       SER  12   6.362  -2.709   5.589
   65    HG   SER  12           HG       SER  12   8.118  -3.965   5.476
   66    H    LEU  13           H        LEU  13   7.315  -4.850   3.073
   67    HA   LEU  13           HA       LEU  13   5.416  -6.662   2.065
   68   1HB   LEU  13          1HB       LEU  13   7.642  -7.607   3.852
   69   2HB   LEU  13          2HB       LEU  13   7.016  -8.354   2.383
   70    HG   LEU  13           HG       LEU  13   8.776  -5.911   2.632
   71   1HD1  LEU  13          1HD1      LEU  13   9.610  -7.568   0.555
   72   2HD1  LEU  13          2HD1      LEU  13   9.060  -8.694   1.796
   73   3HD1  LEU  13          3HD1      LEU  13  10.307  -7.505   2.173
   74   1HD2  LEU  13          1HD2      LEU  13   8.389  -6.105  -0.032
   75   2HD2  LEU  13          2HD2      LEU  13   7.413  -5.051   0.990
   76   3HD2  LEU  13          3HD2      LEU  13   6.801  -6.638   0.522
   77    H    TYR  14           H        TYR  14   5.917  -5.579   5.291
   78    HA   TYR  14           HA       TYR  14   4.574  -7.772   6.607
   79   1HB   TYR  14          1HB       TYR  14   5.502  -5.047   7.330
   80   2HB   TYR  14          2HB       TYR  14   4.227  -5.743   8.330
   81    HD1  TYR  14           HD1      TYR  14   7.468  -6.751   6.720
   82    HD2  TYR  14           HD2      TYR  14   4.863  -7.094  10.119
   83    HE1  TYR  14           HE1      TYR  14   9.146  -8.183   7.864
   84    HE2  TYR  14           HE2      TYR  14   6.540  -8.522  11.264
   85    HH   TYR  14           HH       TYR  14   9.758  -8.924  10.033
   86    H    GLN  15           H        GLN  15   3.548  -4.439   5.973
   87    HA   GLN  15           HA       GLN  15   0.831  -4.736   6.617
   88   1HB   GLN  15          1HB       GLN  15   1.943  -3.079   4.333
   89   2HB   GLN  15          2HB       GLN  15   0.405  -2.822   5.163
   90   1HG   GLN  15          1HG       GLN  15   2.850  -2.942   6.858
   91   2HG   GLN  15          2HG       GLN  15   2.636  -1.502   5.861
   92   1HE2  GLN  15          1HE2      GLN  15   1.520   0.114   6.957
   93   2HE2  GLN  15          2HE2      GLN  15   0.308  -0.147   8.116
   94    H    LEU  16           H        LEU  16   2.598  -5.661   3.743
   95    HA   LEU  16           HA       LEU  16   0.235  -6.428   2.224
   96   1HB   LEU  16          1HB       LEU  16   3.123  -7.310   1.883
   97   2HB   LEU  16          2HB       LEU  16   1.835  -7.490   0.692
   98    HG   LEU  16           HG       LEU  16   2.686  -4.805   1.799
   99   1HD1  LEU  16          1HD1      LEU  16   4.199  -4.540   0.046
  100   2HD1  LEU  16          2HD1      LEU  16   3.425  -5.778  -0.943
  101   3HD1  LEU  16          3HD1      LEU  16   4.426  -6.246   0.431
  102   1HD2  LEU  16          1HD2      LEU  16   1.532  -4.030  -0.296
  103   2HD2  LEU  16          2HD2      LEU  16   0.450  -4.839   0.839
  104   3HD2  LEU  16          3HD2      LEU  16   1.037  -5.698  -0.586
  105    H    GLU  17           H        GLU  17   2.403  -7.902   4.541
  106    HA   GLU  17           HA       GLU  17   1.415 -10.614   4.093
  107   1HB   GLU  17          1HB       GLU  17   3.470  -9.325   5.700
  108   2HB   GLU  17          2HB       GLU  17   2.545 -10.478   6.661
  109   1HG   GLU  17          1HG       GLU  17   3.327 -11.383   3.944
  110   2HG   GLU  17          2HG       GLU  17   4.639 -11.206   5.109
  111    H    ASN  18           H        ASN  18   0.462  -7.822   5.860
  112    HA   ASN  18           HA       ASN  18  -1.187  -9.253   7.804
  113   1HB   ASN  18          1HB       ASN  18  -0.132  -6.818   7.890
  114   2HB   ASN  18          2HB       ASN  18  -1.650  -6.379   7.104
  115   1HD2  ASN  18          1HD2      ASN  18  -2.221  -5.225   9.167
  116   2HD2  ASN  18          2HD2      ASN  18  -2.805  -6.121  10.484
  117    H    TYR  19           H        TYR  19  -1.463  -8.815   4.535
  118    HA   TYR  19           HA       TYR  19  -4.412  -8.454   4.594
  119   1HB   TYR  19          1HB       TYR  19  -2.307  -8.209   2.468
  120   2HB   TYR  19          2HB       TYR  19  -3.981  -8.509   2.000
  121    HD1  TYR  19           HD1      TYR  19  -1.682  -5.969   2.467
  122    HD2  TYR  19           HD2      TYR  19  -5.710  -7.016   3.539
  123    HE1  TYR  19           HE1      TYR  19  -2.213  -3.570   2.815
  124    HE2  TYR  19           HE2      TYR  19  -6.241  -4.618   3.889
  125    HH   TYR  19           HH       TYR  19  -5.124  -2.535   4.339
  126    H    CYS  20           H        CYS  20  -1.962 -10.856   4.096
  127    HA   CYS  20           HA       CYS  20  -3.970 -12.742   2.970
  128   1HB   CYS  20          1HB       CYS  20  -1.111 -13.500   3.457
  129   2HB   CYS  20          2HB       CYS  20  -2.208 -14.041   2.188
  130    H    ASN  21           H        ASN  21  -3.171 -15.140   3.920
  131    HA   ASN  21           HA       ASN  21  -3.543 -16.540   5.767
  132   1HB   ASN  21          1HB       ASN  21  -1.558 -16.381   6.831
  133   2HB   ASN  21          2HB       ASN  21  -1.393 -14.694   6.363
  134   1HD2  ASN  21          1HD2      ASN  21  -1.342 -16.554   9.062
  135   2HD2  ASN  21          2HD2      ASN  21  -1.992 -15.470  10.194
  136   1H    PHE   1          1H        PHE   1  15.875  -3.294  -3.167
  137   2H    PHE   1          2H        PHE   1  15.000  -3.024  -4.599
  138   3H    PHE   1          3H        PHE   1  14.776  -4.461  -3.723
  139    HA   PHE   1           HA       PHE   1  12.930  -3.245  -3.117
  140   1HB   PHE   1          1HB       PHE   1  15.206  -3.079  -1.199
  141   2HB   PHE   1          2HB       PHE   1  13.769  -2.129  -0.822
  142    HD1  PHE   1           HD1      PHE   1  15.109  -5.528  -1.307
  143    HD2  PHE   1           HD2      PHE   1  11.626  -3.198  -0.353
  144    HE1  PHE   1           HE1      PHE   1  13.956  -7.576  -0.511
  145    HE2  PHE   1           HE2      PHE   1  10.474  -5.246   0.443
  146    HZ   PHE   1           HZ       PHE   1  11.640  -7.436   0.364
  147    H    VAL   2           H        VAL   2  12.287  -1.531  -4.408
  148    HA   VAL   2           HA       VAL   2  13.750   1.048  -4.134
  149    HB   VAL   2           HB       VAL   2  13.001  -0.123  -6.396
  150   1HG1  VAL   2          1HG1      VAL   2  10.853   0.262  -7.134
  151   2HG1  VAL   2          2HG1      VAL   2  10.652   1.694  -6.125
  152   3HG1  VAL   2          3HG1      VAL   2  10.534   0.087  -5.409
  153   1HG2  VAL   2          1HG2      VAL   2  12.420   2.525  -7.001
  154   2HG2  VAL   2          2HG2      VAL   2  14.028   1.800  -6.968
  155   3HG2  VAL   2          3HG2      VAL   2  13.407   2.636  -5.545
  156    H    ASN   3           H        ASN   3  11.570   2.688  -4.844
  157    HA   ASN   3           HA       ASN   3  10.479   3.350  -2.329
  158   1HB   ASN   3          1HB       ASN   3   9.218   3.856  -5.043
  159   2HB   ASN   3          2HB       ASN   3   8.878   4.742  -3.556
  160   1HD2  ASN   3          1HD2      ASN   3  11.215   5.436  -2.467
  161   2HD2  ASN   3          2HD2      ASN   3  12.234   6.246  -3.557
  162    H    GLN   4           H        GLN   4   8.443   2.900  -1.356
  163    HA   GLN   4           HA       GLN   4   7.169   0.398  -2.367
  164   1HB   GLN   4          1HB       GLN   4   7.662   1.548   0.325
  165   2HB   GLN   4          2HB       GLN   4   6.119   0.720   0.111
  166   1HG   GLN   4          1HG       GLN   4   7.493  -1.057   0.722
  167   2HG   GLN   4          2HG       GLN   4   7.614  -1.127  -1.037
  168   1HE2  GLN   4          1HE2      GLN   4   9.207   0.965   1.445
  169   2HE2  GLN   4          2HE2      GLN   4  10.785   0.654   0.902
  170    H    HIS   5           H        HIS   5   6.355   2.512  -3.824
  171    HA   HIS   5           HA       HIS   5   3.788   3.413  -2.594
  172   1HB   HIS   5          1HB       HIS   5   5.558   4.538  -4.753
  173   2HB   HIS   5          2HB       HIS   5   3.851   4.979  -4.691
  174    HD2  HIS   5           HD2      HIS   5   6.360   4.654  -1.620
  175    HE1  HIS   5           HE1      HIS   5   4.616   8.506  -1.631
  176    HE2  HIS   5           HE2      HIS   5   6.176   6.928  -0.370
  177    H    LEU   6           H        LEU   6   2.156   2.042  -3.141
  178    HA   LEU   6           HA       LEU   6   1.982   1.202  -6.002
  179   1HB   LEU   6          1HB       LEU   6   1.227  -0.549  -3.645
  180   2HB   LEU   6          2HB       LEU   6   1.264  -1.010  -5.347
  181    HG   LEU   6           HG       LEU   6   3.761  -0.345  -5.273
  182   1HD1  LEU   6          1HD1      LEU   6   4.103  -1.086  -2.532
  183   2HD1  LEU   6          2HD1      LEU   6   2.963   0.259  -2.595
  184   3HD1  LEU   6          3HD1      LEU   6   4.564   0.424  -3.318
  185   1HD2  LEU   6          1HD2      LEU   6   3.629  -2.612  -5.493
  186   2HD2  LEU   6          2HD2      LEU   6   2.391  -2.757  -4.247
  187   3HD2  LEU   6          3HD2      LEU   6   4.090  -2.620  -3.790
  188    H    CYS   7           H        CYS   7  -0.130   1.168  -6.842
  189    HA   CYS   7           HA       CYS   7  -2.305   2.020  -4.980
  190   1HB   CYS   7          1HB       CYS   7  -2.007   3.090  -7.791
  191   2HB   CYS   7          2HB       CYS   7  -3.068   3.680  -6.512
  192    H    GLY   8           H        GLY   8  -3.122  -0.145  -5.022
  193   1HA   GLY   8          1HA       GLY   8  -4.551  -1.815  -5.847
  194   2HA   GLY   8          2HA       GLY   8  -4.962  -0.706  -7.155
  195    H    SER   9           H        SER   9  -3.445  -0.608  -9.000
  196    HA   SER   9           HA       SER   9  -2.840  -3.061 -10.150
  197   1HB   SER   9          1HB       SER   9  -2.015  -0.281 -10.604
  198   2HB   SER   9          2HB       SER   9  -0.820  -1.456 -11.144
  199    HG   SER   9           HG       SER   9  -2.192  -1.307 -12.820
  200    H    ASP  10           H        ASP  10  -0.148  -0.987  -9.068
  201    HA   ASP  10           HA       ASP  10   1.651  -3.193  -8.769
  202   1HB   ASP  10          1HB       ASP  10   1.849  -0.502  -7.390
  203   2HB   ASP  10          2HB       ASP  10   3.172  -1.600  -7.781
  204    H    LEU  11           H        LEU  11  -0.931  -2.184  -6.808
  205    HA   LEU  11           HA       LEU  11   0.225  -2.977  -4.256
  206   1HB   LEU  11          1HB       LEU  11  -2.326  -1.905  -5.210
  207   2HB   LEU  11          2HB       LEU  11  -2.523  -3.113  -3.941
  208    HG   LEU  11           HG       LEU  11  -0.797  -0.625  -3.809
  209   1HD1  LEU  11          1HD1      LEU  11  -2.550  -0.729  -1.647
  210   2HD1  LEU  11          2HD1      LEU  11  -3.525  -1.289  -3.006
  211   3HD1  LEU  11          3HD1      LEU  11  -2.731   0.285  -3.078
  212   1HD2  LEU  11          1HD2      LEU  11  -0.988  -3.083  -2.097
  213   2HD2  LEU  11          2HD2      LEU  11  -0.681  -1.527  -1.325
  214   3HD2  LEU  11          3HD2      LEU  11   0.436  -2.143  -2.543
  215    H    VAL  12           H        VAL  12  -1.999  -4.457  -6.576
  216    HA   VAL  12           HA       VAL  12  -2.254  -6.904  -5.049
  217    HB   VAL  12           HB       VAL  12  -3.975  -6.271  -6.687
  218   1HG1  VAL  12          1HG1      VAL  12  -1.684  -6.542  -8.650
  219   2HG1  VAL  12          2HG1      VAL  12  -2.658  -5.107  -8.331
  220   3HG1  VAL  12          3HG1      VAL  12  -3.377  -6.499  -9.140
  221   1HG2  VAL  12          1HG2      VAL  12  -4.391  -8.428  -7.362
  222   2HG2  VAL  12          2HG2      VAL  12  -3.051  -8.772  -6.269
  223   3HG2  VAL  12          3HG2      VAL  12  -2.765  -8.651  -8.005
  224    H    GLU  13           H        GLU  13  -0.190  -5.803  -7.667
  225    HA   GLU  13           HA       GLU  13   1.099  -8.318  -8.158
  226   1HB   GLU  13          1HB       GLU  13   1.240  -6.031  -9.467
  227   2HB   GLU  13          2HB       GLU  13   2.579  -5.708  -8.363
  228   1HG   GLU  13          1HG       GLU  13   3.918  -6.983  -9.641
  229   2HG   GLU  13          2HG       GLU  13   2.888  -8.375  -9.304
  230    H    ALA  14           H        ALA  14   1.345  -5.907  -5.671
  231    HA   ALA  14           HA       ALA  14   3.846  -7.061  -4.604
  232   1HB   ALA  14          1HB       ALA  14   2.145  -4.673  -3.935
  233   2HB   ALA  14          2HB       ALA  14   3.865  -4.737  -4.319
  234   3HB   ALA  14          3HB       ALA  14   3.292  -5.291  -2.746
  235    H    LEU  15           H        LEU  15   0.412  -7.312  -4.198
  236    HA   LEU  15           HA       LEU  15   0.670  -8.539  -1.519
  237   1HB   LEU  15          1HB       LEU  15  -1.592  -7.737  -3.308
  238   2HB   LEU  15          2HB       LEU  15  -1.885  -9.010  -2.122
  239    HG   LEU  15           HG       LEU  15  -0.575  -6.409  -1.334
  240   1HD1  LEU  15          1HD1      LEU  15  -3.356  -6.552  -0.582
  241   2HD1  LEU  15          2HD1      LEU  15  -3.208  -6.678  -2.335
  242   3HD1  LEU  15          3HD1      LEU  15  -2.522  -5.291  -1.490
  243   1HD2  LEU  15          1HD2      LEU  15  -2.141  -7.362   0.732
  244   2HD2  LEU  15          2HD2      LEU  15  -0.409  -7.648   0.562
  245   3HD2  LEU  15          3HD2      LEU  15  -1.562  -8.848  -0.022
  246    H    TYR  16           H        TYR  16   0.189  -9.379  -4.859
  247    HA   TYR  16           HA       TYR  16  -0.309 -12.211  -4.366
  248   1HB   TYR  16          1HB       TYR  16  -1.243 -11.401  -6.380
  249   2HB   TYR  16          2HB       TYR  16   0.214 -10.504  -6.796
  250    HD1  TYR  16           HD1      TYR  16  -0.438 -14.073  -5.801
  251    HD2  TYR  16           HD2      TYR  16   1.213 -11.372  -8.707
  252    HE1  TYR  16           HE1      TYR  16   0.382 -16.003  -7.130
  253    HE2  TYR  16           HE2      TYR  16   2.033 -13.300 -10.035
  254    HH   TYR  16           HH       TYR  16   2.678 -15.824  -9.403
  255    H    LEU  17           H        LEU  17   2.442 -10.136  -4.683
  256    HA   LEU  17           HA       LEU  17   4.269 -12.394  -5.225
  257   1HB   LEU  17          1HB       LEU  17   4.622 -10.191  -6.344
  258   2HB   LEU  17          2HB       LEU  17   4.895  -9.465  -4.760
  259    HG   LEU  17           HG       LEU  17   6.693 -11.329  -4.475
  260   1HD1  LEU  17          1HD1      LEU  17   7.669 -12.118  -6.569
  261   2HD1  LEU  17          2HD1      LEU  17   6.482 -11.204  -7.499
  262   3HD1  LEU  17          3HD1      LEU  17   5.966 -12.575  -6.517
  263   1HD2  LEU  17          1HD2      LEU  17   7.003  -8.807  -4.862
  264   2HD2  LEU  17          2HD2      LEU  17   7.270  -9.212  -6.557
  265   3HD2  LEU  17          3HD2      LEU  17   8.356  -9.841  -5.319
  266    H    VAL  18           H        VAL  18   3.245 -10.305  -2.619
  267    HA   VAL  18           HA       VAL  18   5.360 -10.973  -0.783
  268    HB   VAL  18           HB       VAL  18   2.554  -9.921  -0.404
  269   1HG1  VAL  18          1HG1      VAL  18   4.644 -10.616   1.674
  270   2HG1  VAL  18          2HG1      VAL  18   2.978 -11.188   1.591
  271   3HG1  VAL  18          3HG1      VAL  18   3.312  -9.503   1.989
  272   1HG2  VAL  18          1HG2      VAL  18   5.006  -8.488   0.485
  273   2HG2  VAL  18          2HG2      VAL  18   3.547  -7.853  -0.275
  274   3HG2  VAL  18          3HG2      VAL  18   4.778  -8.647  -1.257
  275    H    CYS  19           H        CYS  19   2.021 -12.134  -1.050
  276    HA   CYS  19           HA       CYS  19   2.801 -14.530   0.537
  277   1HB   CYS  19          1HB       CYS  19  -0.022 -13.863  -0.291
  278   2HB   CYS  19          2HB       CYS  19   0.531 -14.786   1.108
  279    H    GLY  20           H        GLY  20   0.582 -13.907  -2.208
  280   1HA   GLY  20          1HA       GLY  20   0.148 -15.208  -4.113
  281   2HA   GLY  20          2HA       GLY  20   1.893 -15.456  -4.144
  282    H    GLU  21           H        GLU  21   0.283 -16.528  -1.304
  283    HA   GLU  21           HA       GLU  21  -0.802 -18.976  -1.726
  284   1HB   GLU  21          1HB       GLU  21   0.989 -19.750  -3.148
  285   2HB   GLU  21          2HB       GLU  21   2.210 -19.241  -1.977
  286   1HG   GLU  21          1HG       GLU  21   1.991 -21.157  -0.810
  287   2HG   GLU  21          2HG       GLU  21   0.235 -20.999  -0.769
  288    H    ARG  22           H        ARG  22  -0.948 -17.244   0.276
  289    HA   ARG  22           HA       ARG  22   0.018 -18.812   2.594
  290   1HB   ARG  22          1HB       ARG  22   1.251 -16.385   1.787
  291   2HB   ARG  22          2HB       ARG  22   0.287 -16.012   3.217
  292   1HG   ARG  22          1HG       ARG  22   1.945 -16.900   4.457
  293   2HG   ARG  22          2HG       ARG  22   1.500 -18.472   3.795
  294   1HD   ARG  22          1HD       ARG  22   2.967 -17.714   1.751
  295   2HD   ARG  22          2HD       ARG  22   3.679 -16.603   2.921
  296    HE   ARG  22           HE       ARG  22   3.873 -18.919   4.289
  297   1HH1  ARG  22          1HH1      ARG  22   5.169 -17.668   1.419
  298   2HH1  ARG  22          2HH1      ARG  22   6.065 -19.094   1.012
  299   1HH2  ARG  22          1HH2      ARG  22   4.725 -20.993   3.589
  300   2HH2  ARG  22          2HH2      ARG  22   5.814 -20.978   2.241
  301    H    GLY  23           H        GLY  23  -2.523 -17.751   1.060
  302   1HA   GLY  23          1HA       GLY  23  -4.733 -17.847   2.119
  303   2HA   GLY  23          2HA       GLY  23  -4.024 -17.105   3.558
  304    H    PHE  24           H        PHE  24  -2.973 -15.871   0.534
  305    HA   PHE  24           HA       PHE  24  -3.934 -13.227   1.129
  306   1HB   PHE  24          1HB       PHE  24  -1.928 -13.467  -0.184
  307   2HB   PHE  24          2HB       PHE  24  -2.757 -14.471  -1.370
  308    HD1  PHE  24           HD1      PHE  24  -3.477 -11.171   0.284
  309    HD2  PHE  24           HD2      PHE  24  -3.106 -13.376  -3.386
  310    HE1  PHE  24           HE1      PHE  24  -4.099  -9.140  -1.000
  311    HE2  PHE  24           HE2      PHE  24  -3.729 -11.345  -4.670
  312    HZ   PHE  24           HZ       PHE  24  -4.224  -9.228  -3.477
  313    H    PHE  25           H        PHE  25  -5.677 -12.090   0.198
  314    HA   PHE  25           HA       PHE  25  -7.370 -13.465  -1.789
  315   1HB   PHE  25          1HB       PHE  25  -9.298 -13.647  -0.489
  316   2HB   PHE  25          2HB       PHE  25  -8.051 -14.043   0.690
  317    HD1  PHE  25           HD1      PHE  25 -10.442 -11.475  -0.445
  318    HD2  PHE  25           HD2      PHE  25  -7.469 -12.495   2.487
  319    HE1  PHE  25           HE1      PHE  25 -11.198  -9.586   0.978
  320    HE2  PHE  25           HE2      PHE  25  -8.225 -10.606   3.909
  321    HZ   PHE  25           HZ       PHE  25 -10.090  -9.154   3.155
  322    H    TYR  26           H        TYR  26  -7.644 -11.926  -3.310
  323    HA   TYR  26           HA       TYR  26  -8.570  -9.243  -2.503
  324   1HB   TYR  26          1HB       TYR  26  -6.048  -9.172  -2.500
  325   2HB   TYR  26          2HB       TYR  26  -6.090  -9.566  -4.219
  326    HD1  TYR  26           HD1      TYR  26  -8.394  -7.383  -2.248
  327    HD2  TYR  26           HD2      TYR  26  -5.363  -7.587  -5.289
  328    HE1  TYR  26           HE1      TYR  26  -8.765  -4.989  -2.779
  329    HE2  TYR  26           HE2      TYR  26  -5.734  -5.192  -5.820
  330    HH   TYR  26           HH       TYR  26  -7.781  -3.165  -3.829
  331    H    THR  27           H        THR  27 -10.044  -8.522  -3.981
  332    HA   THR  27           HA       THR  27 -10.599 -10.179  -6.329
  333    HB   THR  27           HB       THR  27 -11.871  -7.581  -5.411
  334    HG1  THR  27           HG1      THR  27 -13.527  -9.415  -4.966
  335   1HG2  THR  27          1HG2      THR  27 -12.373  -9.472  -7.658
  336   2HG2  THR  27          2HG2      THR  27 -12.622  -7.727  -7.579
  337   3HG2  THR  27          3HG2      THR  27 -13.782  -8.820  -6.822
  338    H    LYS  28           H        LYS  28 -10.472  -9.459  -8.514
  339    HA   LYS  28           HA       LYS  28  -8.664  -7.112  -8.906
  340   1HB   LYS  28          1HB       LYS  28  -7.721  -9.354  -9.535
  341   2HB   LYS  28          2HB       LYS  28  -9.009  -9.508 -10.731
  342   1HG   LYS  28          1HG       LYS  28  -7.862  -8.239 -12.192
  343   2HG   LYS  28          2HG       LYS  28  -7.741  -6.936 -11.012
  344   1HD   LYS  28          1HD       LYS  28  -5.612  -7.482 -10.454
  345   2HD   LYS  28          2HD       LYS  28  -5.967  -9.210 -10.438
  346   1HE   LYS  28          1HE       LYS  28  -5.732  -9.368 -12.820
  347   2HE   LYS  28          2HE       LYS  28  -5.694  -7.615 -12.996
  348   1HZ   LYS  28          1HZ       LYS  28  -3.627  -9.399 -11.872
  349   2HZ   LYS  28          2HZ       LYS  28  -3.653  -7.742 -11.496
  350   3HZ   LYS  28          3HZ       LYS  28  -3.477  -8.248 -13.108
  351    HA   PRO  29           HA       PRO  29 -12.230  -5.495 -11.042
  352   1HB   PRO  29          1HB       PRO  29 -11.070  -3.096 -11.709
  353   2HB   PRO  29          2HB       PRO  29 -11.739  -3.451 -10.106
  354   1HG   PRO  29          1HG       PRO  29  -8.884  -3.306 -10.961
  355   2HG   PRO  29          2HG       PRO  29  -9.593  -3.020  -9.364
  356   1HD   PRO  29          1HD       PRO  29  -8.244  -5.365 -10.167
  357   2HD   PRO  29          2HD       PRO  29  -9.263  -5.196  -8.722
  358    H    THR  30           H        THR  30  -9.516  -4.000 -12.694
  359    HA   THR  30           HA       THR  30 -10.274  -5.510 -15.163
  360    HB   THR  30           HB       THR  30  -9.072  -2.731 -14.951
  361    HG1  THR  30           HG1      THR  30 -11.680  -3.721 -15.209
  362   1HG2  THR  30          1HG2      THR  30  -8.429  -3.887 -17.007
  363   2HG2  THR  30          2HG2      THR  30  -9.619  -2.638 -17.376
  364   3HG2  THR  30          3HG2      THR  30 -10.109  -4.331 -17.307
  Start of MODEL   11
    1   1H    GLY   1          1H        GLY   1 -16.513   9.298  -2.679
    2   2H    GLY   1          2H        GLY   1 -16.300   7.952  -3.693
    3   3H    GLY   1          3H        GLY   1 -16.249   9.521  -4.342
    4   1HA   GLY   1          1HA       GLY   1 -14.020   9.221  -4.083
    5   2HA   GLY   1          2HA       GLY   1 -14.330   9.750  -2.401
    6    H    GLY   2           H        GLY   2 -13.266   7.804  -1.409
    7   1HA   GLY   2          1HA       GLY   2 -13.004   5.197  -2.262
    8   2HA   GLY   2          2HA       GLY   2 -11.721   6.034  -3.140
    9    H    GLY   3           H        GLY   3  -9.807   5.811  -2.106
   10   1HA   GLY   3          1HA       GLY   3  -9.038   6.825   0.314
   11   2HA   GLY   3          2HA       GLY   3  -9.703   5.255   0.768
   12    H    GLU   4           H        GLU   4  -7.223   5.203   1.409
   13    HA   GLU   4           HA       GLU   4  -5.937   3.278  -0.231
   14   1HB   GLU   4          1HB       GLU   4  -4.072   4.669  -1.143
   15   2HB   GLU   4          2HB       GLU   4  -5.636   5.086  -1.848
   16   1HG   GLU   4          1HG       GLU   4  -5.191   6.610   0.572
   17   2HG   GLU   4          2HG       GLU   4  -3.846   6.833  -0.548
   18    H    GLN   5           H        GLN   5  -4.084   2.468   0.818
   19    HA   GLN   5           HA       GLN   5  -3.280   3.932   3.302
   20   1HB   GLN   5          1HB       GLN   5  -4.675   1.759   3.558
   21   2HB   GLN   5          2HB       GLN   5  -3.205   0.928   3.046
   22   1HG   GLN   5          1HG       GLN   5  -2.713   0.970   5.275
   23   2HG   GLN   5          2HG       GLN   5  -2.185   2.615   4.920
   24   1HE2  GLN   5          1HE2      GLN   5  -4.220   0.832   6.945
   25   2HE2  GLN   5          2HE2      GLN   5  -5.255   2.086   7.432
   26    H    CYS   6           H        CYS   6  -2.287   2.580   0.345
   27    HA   CYS   6           HA       CYS   6   0.561   2.790   1.221
   28   1HB   CYS   6          1HB       CYS   6  -0.728   0.656  -0.489
   29   2HB   CYS   6          2HB       CYS   6   1.012   0.945  -0.492
   30    H    CYS   7           H        CYS   7  -1.737   4.187  -0.595
   31    HA   CYS   7           HA       CYS   7  -0.296   4.491  -3.119
   32   1HB   CYS   7          1HB       CYS   7  -2.877   4.726  -2.617
   33   2HB   CYS   7          2HB       CYS   7  -2.444   6.389  -2.218
   34    H    THR   8           H        THR   8  -1.003   6.631  -0.340
   35    HA   THR   8           HA       THR   8   0.929   8.617  -1.344
   36    HB   THR   8           HB       THR   8  -1.154   9.375  -0.249
   37    HG1  THR   8           HG1      THR   8  -0.050  10.970   0.521
   38   1HG2  THR   8          1HG2      THR   8  -0.569   7.279   1.537
   39   2HG2  THR   8          2HG2      THR   8  -1.915   8.414   1.634
   40   3HG2  THR   8          3HG2      THR   8  -0.406   8.763   2.477
   41    H    SER   9           H        SER   9   0.749   6.032   0.999
   42    HA   SER   9           HA       SER   9   3.366   6.828   2.163
   43   1HB   SER   9          1HB       SER   9   1.592   6.153   3.736
   44   2HB   SER   9          2HB       SER   9   1.444   4.601   2.917
   45    HG   SER   9           HG       SER   9   2.905   4.050   4.342
   46    H    ILE  10           H        ILE  10   4.399   4.312   2.766
   47    HA   ILE  10           HA       ILE  10   4.765   3.090   0.058
   48    HB   ILE  10           HB       ILE  10   6.869   3.550   2.195
   49   1HG1  ILE  10          1HG1      ILE  10   6.559   4.702  -0.597
   50   2HG1  ILE  10          2HG1      ILE  10   6.212   5.571   0.898
   51   1HG2  ILE  10          1HG2      ILE  10   6.718   1.785  -0.160
   52   2HG2  ILE  10          2HG2      ILE  10   7.806   1.719   1.228
   53   3HG2  ILE  10          3HG2      ILE  10   8.157   2.805  -0.117
   54   1HD1  ILE  10          1HD1      ILE  10   8.434   6.203   0.261
   55   2HD1  ILE  10          2HD1      ILE  10   8.890   4.529  -0.055
   56   3HD1  ILE  10          3HD1      ILE  10   8.610   5.070   1.601
   57    H    CYS  11           H        CYS  11   4.247   2.608   3.460
   58    HA   CYS  11           HA       CYS  11   3.959   0.645   4.725
   59   1HB   CYS  11          1HB       CYS  11   3.205  -0.702   2.136
   60   2HB   CYS  11          2HB       CYS  11   2.515  -0.934   3.742
   61    H    SER  12           H        SER  12   4.399  -2.008   4.265
   62    HA   SER  12           HA       SER  12   6.989  -2.322   2.896
   63   1HB   SER  12          1HB       SER  12   7.843  -1.663   5.015
   64   2HB   SER  12          2HB       SER  12   6.637  -2.609   5.880
   65    HG   SER  12           HG       SER  12   8.699  -3.633   5.786
   66    H    LEU  13           H        LEU  13   7.733  -4.706   3.340
   67    HA   LEU  13           HA       LEU  13   5.801  -6.437   2.233
   68   1HB   LEU  13          1HB       LEU  13   8.087  -7.090   2.062
   69   2HB   LEU  13          2HB       LEU  13   8.323  -6.980   3.806
   70    HG   LEU  13           HG       LEU  13   6.660  -8.855   4.072
   71   1HD1  LEU  13          1HD1      LEU  13   6.585 -10.202   1.765
   72   2HD1  LEU  13          2HD1      LEU  13   6.709  -8.574   1.099
   73   3HD1  LEU  13          3HD1      LEU  13   5.367  -8.989   2.164
   74   1HD2  LEU  13          1HD2      LEU  13   9.244  -9.190   2.555
   75   2HD2  LEU  13          2HD2      LEU  13   8.274 -10.596   2.995
   76   3HD2  LEU  13          3HD2      LEU  13   8.911  -9.535   4.252
   77    H    TYR  14           H        TYR  14   6.179  -5.368   5.455
   78    HA   TYR  14           HA       TYR  14   4.845  -7.590   6.752
   79   1HB   TYR  14          1HB       TYR  14   5.663  -4.837   7.461
   80   2HB   TYR  14          2HB       TYR  14   4.449  -5.608   8.472
   81    HD1  TYR  14           HD1      TYR  14   7.871  -6.063   7.042
   82    HD2  TYR  14           HD2      TYR  14   5.052  -7.265  10.052
   83    HE1  TYR  14           HE1      TYR  14   9.644  -7.382   8.175
   84    HE2  TYR  14           HE2      TYR  14   6.823  -8.582  11.188
   85    HH   TYR  14           HH       TYR  14  10.166  -8.617   9.948
   86    H    GLN  15           H        GLN  15   3.844  -4.255   6.136
   87    HA   GLN  15           HA       GLN  15   1.102  -4.583   6.729
   88   1HB   GLN  15          1HB       GLN  15   2.116  -2.755   4.548
   89   2HB   GLN  15          2HB       GLN  15   0.739  -2.506   5.623
   90   1HG   GLN  15          1HG       GLN  15   2.758  -2.799   7.436
   91   2HG   GLN  15          2HG       GLN  15   3.616  -2.023   6.104
   92   1HE2  GLN  15          1HE2      GLN  15   0.842  -1.623   8.321
   93   2HE2  GLN  15          2HE2      GLN  15   0.711   0.057   8.115
   94    H    LEU  16           H        LEU  16   2.961  -5.423   3.911
   95    HA   LEU  16           HA       LEU  16   0.662  -5.862   2.191
   96   1HB   LEU  16          1HB       LEU  16   3.476  -6.978   1.966
   97   2HB   LEU  16          2HB       LEU  16   2.263  -6.946   0.684
   98    HG   LEU  16           HG       LEU  16   3.234  -4.438   2.070
   99   1HD1  LEU  16          1HD1      LEU  16   4.198  -4.765  -0.637
  100   2HD1  LEU  16          2HD1      LEU  16   4.738  -6.110   0.366
  101   3HD1  LEU  16          3HD1      LEU  16   5.117  -4.454   0.835
  102   1HD2  LEU  16          1HD2      LEU  16   1.382  -5.129  -0.143
  103   2HD2  LEU  16          2HD2      LEU  16   2.447  -3.756  -0.444
  104   3HD2  LEU  16          3HD2      LEU  16   1.364  -3.743   0.947
  105    H    GLU  17           H        GLU  17   2.619  -7.848   4.405
  106    HA   GLU  17           HA       GLU  17   1.180 -10.294   3.614
  107   1HB   GLU  17          1HB       GLU  17   2.407 -11.344   5.492
  108   2HB   GLU  17          2HB       GLU  17   3.499 -10.452   4.431
  109   1HG   GLU  17          1HG       GLU  17   3.638  -8.627   5.945
  110   2HG   GLU  17          2HG       GLU  17   2.282  -9.217   6.904
  111    H    ASN  18           H        ASN  18   0.497  -7.628   5.570
  112    HA   ASN  18           HA       ASN  18  -1.116  -9.085   7.533
  113   1HB   ASN  18          1HB       ASN  18  -0.341  -6.270   7.034
  114   2HB   ASN  18          2HB       ASN  18  -1.937  -6.498   7.753
  115   1HD2  ASN  18          1HD2      ASN  18  -1.801  -6.404   9.997
  116   2HD2  ASN  18          2HD2      ASN  18  -0.524  -7.024  10.926
  117    H    TYR  19           H        TYR  19  -1.511  -8.392   4.310
  118    HA   TYR  19           HA       TYR  19  -4.403  -7.788   4.470
  119   1HB   TYR  19          1HB       TYR  19  -2.352  -7.870   2.296
  120   2HB   TYR  19          2HB       TYR  19  -4.041  -8.120   1.856
  121    HD1  TYR  19           HD1      TYR  19  -1.530  -5.704   2.561
  122    HD2  TYR  19           HD2      TYR  19  -5.758  -6.410   2.804
  123    HE1  TYR  19           HE1      TYR  19  -1.926  -3.255   2.699
  124    HE2  TYR  19           HE2      TYR  19  -6.161  -3.962   2.941
  125    HH   TYR  19           HH       TYR  19  -3.469  -1.668   3.163
  126    H    CYS  20           H        CYS  20  -2.251 -10.453   3.952
  127    HA   CYS  20           HA       CYS  20  -4.523 -12.149   3.036
  128   1HB   CYS  20          1HB       CYS  20  -1.674 -13.084   3.181
  129   2HB   CYS  20          2HB       CYS  20  -2.949 -13.581   2.072
  130    H    ASN  21           H        ASN  21  -3.679 -14.617   3.856
  131    HA   ASN  21           HA       ASN  21  -2.819 -14.856   6.556
  132   1HB   ASN  21          1HB       ASN  21  -5.001 -13.544   6.863
  133   2HB   ASN  21          2HB       ASN  21  -5.831 -15.010   6.341
  134   1HD2  ASN  21          1HD2      ASN  21  -3.137 -14.208   8.629
  135   2HD2  ASN  21          2HD2      ASN  21  -3.711 -15.210   9.872
  136   1H    PHE   1          1H        PHE   1  12.595  -7.030  -3.299
  137   2H    PHE   1          2H        PHE   1  13.038  -7.740  -1.819
  138   3H    PHE   1          3H        PHE   1  13.954  -6.459  -2.457
  139    HA   PHE   1           HA       PHE   1  11.151  -5.856  -2.076
  140   1HB   PHE   1          1HB       PHE   1  13.011  -6.455   0.244
  141   2HB   PHE   1          2HB       PHE   1  11.528  -5.513   0.398
  142    HD1  PHE   1           HD1      PHE   1  12.850  -8.714   0.768
  143    HD2  PHE   1           HD2      PHE   1   9.422  -6.697  -0.858
  144    HE1  PHE   1           HE1      PHE   1  11.533 -10.810   0.945
  145    HE2  PHE   1           HE2      PHE   1   8.105  -8.793  -0.683
  146    HZ   PHE   1           HZ       PHE   1   9.160 -10.849   0.219
  147    H    VAL   2           H        VAL   2  10.988  -3.613  -1.940
  148    HA   VAL   2           HA       VAL   2  13.360  -1.990  -1.322
  149    HB   VAL   2           HB       VAL   2  13.263  -2.714  -3.871
  150   1HG1  VAL   2          1HG1      VAL   2  10.845  -1.712  -3.925
  151   2HG1  VAL   2          2HG1      VAL   2  11.931  -1.424  -5.285
  152   3HG1  VAL   2          3HG1      VAL   2  11.687  -0.169  -4.072
  153   1HG2  VAL   2          1HG2      VAL   2  14.489  -0.696  -2.429
  154   2HG2  VAL   2          2HG2      VAL   2  13.724   0.170  -3.762
  155   3HG2  VAL   2          3HG2      VAL   2  14.861  -1.137  -4.095
  156    H    ASN   3           H        ASN   3  12.375   0.389  -2.437
  157    HA   ASN   3           HA       ASN   3   9.874   0.756  -0.838
  158   1HB   ASN   3          1HB       ASN   3  12.280   2.508  -1.270
  159   2HB   ASN   3          2HB       ASN   3  10.723   3.237  -0.876
  160   1HD2  ASN   3          1HD2      ASN   3  12.610   0.374   0.282
  161   2HD2  ASN   3          2HD2      ASN   3  12.361   0.698   1.929
  162    H    GLN   4           H        GLN   4   8.100   1.393  -1.982
  163    HA   GLN   4           HA       GLN   4   8.375   3.088  -4.350
  164   1HB   GLN   4          1HB       GLN   4   7.720   1.595  -6.004
  165   2HB   GLN   4          2HB       GLN   4   8.696   0.540  -4.986
  166   1HG   GLN   4          1HG       GLN   4   6.699  -0.325  -3.885
  167   2HG   GLN   4          2HG       GLN   4   5.681   0.817  -4.763
  168   1HE2  GLN   4          1HE2      GLN   4   6.220   0.648  -7.342
  169   2HE2  GLN   4          2HE2      GLN   4   6.213  -0.943  -7.935
  170    H    HIS   5           H        HIS   5   6.019   3.302  -5.363
  171    HA   HIS   5           HA       HIS   5   4.122   3.482  -3.055
  172   1HB   HIS   5          1HB       HIS   5   3.689   5.148  -5.489
  173   2HB   HIS   5          2HB       HIS   5   3.407   5.543  -3.795
  174    HD2  HIS   5           HD2      HIS   5   6.381   5.265  -2.561
  175    HE1  HIS   5           HE1      HIS   5   7.609   7.792  -5.720
  176    HE2  HIS   5           HE2      HIS   5   8.257   6.835  -3.445
  177    H    LEU   6           H        LEU   6   2.282   2.278  -3.259
  178    HA   LEU   6           HA       LEU   6   1.414   1.506  -6.010
  179   1HB   LEU   6          1HB       LEU   6   0.856  -0.543  -3.991
  180   2HB   LEU   6          2HB       LEU   6   1.547  -0.720  -5.602
  181    HG   LEU   6           HG       LEU   6   3.677   0.355  -4.480
  182   1HD1  LEU   6          1HD1      LEU   6   3.176  -1.081  -2.042
  183   2HD1  LEU   6          2HD1      LEU   6   1.901   0.115  -2.273
  184   3HD1  LEU   6          3HD1      LEU   6   3.591   0.621  -2.247
  185   1HD2  LEU   6          1HD2      LEU   6   2.812  -2.501  -3.920
  186   2HD2  LEU   6          2HD2      LEU   6   4.475  -1.915  -3.939
  187   3HD2  LEU   6          3HD2      LEU   6   3.530  -1.931  -5.427
  188    H    CYS   7           H        CYS   7  -0.898   1.019  -6.132
  189    HA   CYS   7           HA       CYS   7  -2.484   1.797  -3.748
  190   1HB   CYS   7          1HB       CYS   7  -3.216   2.992  -6.406
  191   2HB   CYS   7          2HB       CYS   7  -3.629   3.549  -4.785
  192    H    GLY   8           H        GLY   8  -2.462   0.528  -7.071
  193   1HA   GLY   8          1HA       GLY   8  -4.695  -1.273  -6.256
  194   2HA   GLY   8          2HA       GLY   8  -4.818  -0.376  -7.770
  195    H    SER   9           H        SER   9  -3.878  -1.249  -9.572
  196    HA   SER   9           HA       SER   9  -3.155  -3.906  -9.803
  197   1HB   SER   9          1HB       SER   9  -1.671  -3.063 -11.778
  198   2HB   SER   9          2HB       SER   9  -3.408  -2.771 -11.838
  199    HG   SER   9           HG       SER   9  -1.657  -0.972 -12.112
  200    H    ASP  10           H        ASP  10  -0.927  -1.201  -9.096
  201    HA   ASP  10           HA       ASP  10   1.382  -2.943  -8.926
  202   1HB   ASP  10          1HB       ASP  10   0.827  -0.089  -8.641
  203   2HB   ASP  10          2HB       ASP  10   2.013  -0.669  -7.471
  204    H    LEU  11           H        LEU  11  -0.844  -1.542  -6.571
  205    HA   LEU  11           HA       LEU  11   0.583  -2.441  -4.252
  206   1HB   LEU  11          1HB       LEU  11  -1.237  -0.707  -4.227
  207   2HB   LEU  11          2HB       LEU  11  -2.404  -2.001  -4.500
  208    HG   LEU  11           HG       LEU  11  -1.840  -3.054  -2.406
  209   1HD1  LEU  11          1HD1      LEU  11   0.574  -2.709  -2.418
  210   2HD1  LEU  11          2HD1      LEU  11  -0.090  -2.051  -0.924
  211   3HD1  LEU  11          3HD1      LEU  11   0.356  -0.968  -2.241
  212   1HD2  LEU  11          1HD2      LEU  11  -3.364  -1.472  -1.750
  213   2HD2  LEU  11          2HD2      LEU  11  -2.446  -0.146  -2.463
  214   3HD2  LEU  11          3HD2      LEU  11  -1.973  -0.806  -0.898
  215    H    VAL  12           H        VAL  12  -1.997  -3.896  -6.172
  216    HA   VAL  12           HA       VAL  12  -2.188  -6.255  -4.507
  217    HB   VAL  12           HB       VAL  12  -3.665  -7.109  -6.155
  218   1HG1  VAL  12          1HG1      VAL  12  -3.798  -4.347  -5.425
  219   2HG1  VAL  12          2HG1      VAL  12  -5.130  -5.444  -5.783
  220   3HG1  VAL  12          3HG1      VAL  12  -4.388  -4.506  -7.078
  221   1HG2  VAL  12          1HG2      VAL  12  -2.014  -6.884  -8.036
  222   2HG2  VAL  12          2HG2      VAL  12  -2.436  -5.177  -8.148
  223   3HG2  VAL  12          3HG2      VAL  12  -3.650  -6.408  -8.488
  224    H    GLU  13           H        GLU  13  -0.154  -5.225  -7.117
  225    HA   GLU  13           HA       GLU  13   0.884  -7.769  -7.912
  226   1HB   GLU  13          1HB       GLU  13   1.302  -5.571  -9.094
  227   2HB   GLU  13          2HB       GLU  13   2.411  -5.149  -7.789
  228   1HG   GLU  13          1HG       GLU  13   3.717  -6.098  -9.592
  229   2HG   GLU  13          2HG       GLU  13   3.676  -7.271  -8.276
  230    H    ALA  14           H        ALA  14   1.440  -5.689  -5.157
  231    HA   ALA  14           HA       ALA  14   3.771  -7.271  -4.265
  232   1HB   ALA  14          1HB       ALA  14   4.249  -5.440  -3.031
  233   2HB   ALA  14          2HB       ALA  14   2.649  -5.454  -2.289
  234   3HB   ALA  14          3HB       ALA  14   2.896  -4.642  -3.835
  235    H    LEU  15           H        LEU  15   0.342  -7.303  -3.928
  236    HA   LEU  15           HA       LEU  15   0.420  -8.740  -1.347
  237   1HB   LEU  15          1HB       LEU  15  -1.803  -7.906  -3.222
  238   2HB   LEU  15          2HB       LEU  15  -2.098  -8.971  -1.847
  239    HG   LEU  15           HG       LEU  15  -0.693  -6.314  -1.536
  240   1HD1  LEU  15          1HD1      LEU  15  -3.360  -6.660  -2.355
  241   2HD1  LEU  15          2HD1      LEU  15  -2.646  -5.195  -1.684
  242   3HD1  LEU  15          3HD1      LEU  15  -3.447  -6.352  -0.621
  243   1HD2  LEU  15          1HD2      LEU  15  -2.320  -7.947   0.430
  244   2HD2  LEU  15          2HD2      LEU  15  -1.244  -6.597   0.788
  245   3HD2  LEU  15          3HD2      LEU  15  -0.577  -8.135   0.242
  246    H    TYR  16           H        TYR  16   0.284  -9.349  -4.740
  247    HA   TYR  16           HA       TYR  16  -0.500 -12.165  -4.431
  248   1HB   TYR  16          1HB       TYR  16  -1.322 -11.355  -6.444
  249   2HB   TYR  16          2HB       TYR  16   0.049 -10.279  -6.691
  250    HD1  TYR  16           HD1      TYR  16  -1.215 -13.720  -7.113
  251    HD2  TYR  16           HD2      TYR  16   2.139 -11.091  -7.664
  252    HE1  TYR  16           HE1      TYR  16  -0.151 -15.390  -8.611
  253    HE2  TYR  16           HE2      TYR  16   3.202 -12.757  -9.161
  254    HH   TYR  16           HH       TYR  16   3.029 -15.360  -9.423
  255    H    LEU  17           H        LEU  17   2.392 -10.233  -4.733
  256    HA   LEU  17           HA       LEU  17   4.090 -12.586  -5.258
  257   1HB   LEU  17          1HB       LEU  17   4.758 -10.578  -6.384
  258   2HB   LEU  17          2HB       LEU  17   4.651  -9.633  -4.899
  259    HG   LEU  17           HG       LEU  17   6.483 -11.070  -3.943
  260   1HD1  LEU  17          1HD1      LEU  17   6.261 -13.033  -5.346
  261   2HD1  LEU  17          2HD1      LEU  17   7.849 -12.327  -5.649
  262   3HD1  LEU  17          3HD1      LEU  17   6.537 -12.078  -6.802
  263   1HD2  LEU  17          1HD2      LEU  17   8.143 -10.118  -5.900
  264   2HD2  LEU  17          2HD2      LEU  17   7.485  -9.133  -4.594
  265   3HD2  LEU  17          3HD2      LEU  17   6.697  -9.146  -6.172
  266    H    VAL  18           H        VAL  18   2.814 -10.915  -2.566
  267    HA   VAL  18           HA       VAL  18   5.018 -11.733  -0.775
  268    HB   VAL  18           HB       VAL  18   2.566 -10.020  -0.468
  269   1HG1  VAL  18          1HG1      VAL  18   3.709  -9.868   1.993
  270   2HG1  VAL  18          2HG1      VAL  18   3.980 -11.570   1.626
  271   3HG1  VAL  18          3HG1      VAL  18   2.342 -10.918   1.621
  272   1HG2  VAL  18          1HG2      VAL  18   5.551  -9.683  -0.145
  273   2HG2  VAL  18          2HG2      VAL  18   4.409  -8.503   0.498
  274   3HG2  VAL  18          3HG2      VAL  18   4.469  -8.819  -1.237
  275    H    CYS  19           H        CYS  19   1.546 -12.338  -1.151
  276    HA   CYS  19           HA       CYS  19   1.811 -14.616   0.751
  277   1HB   CYS  19          1HB       CYS  19  -0.848 -13.770  -0.294
  278   2HB   CYS  19          2HB       CYS  19  -0.408 -14.355   1.308
  279    H    GLY  20           H        GLY  20   2.670 -14.714  -2.090
  280   1HA   GLY  20          1HA       GLY  20   0.704 -16.175  -3.609
  281   2HA   GLY  20          2HA       GLY  20   2.438 -16.156  -3.939
  282    H    GLU  21           H        GLU  21   0.312 -17.433  -1.327
  283    HA   GLU  21           HA       GLU  21   0.833 -20.163  -1.820
  284   1HB   GLU  21          1HB       GLU  21   3.176 -19.006  -1.052
  285   2HB   GLU  21          2HB       GLU  21   2.533 -19.505   0.512
  286   1HG   GLU  21          1HG       GLU  21   3.058 -21.649   0.089
  287   2HG   GLU  21          2HG       GLU  21   2.116 -21.615  -1.401
  288    H    ARG  22           H        ARG  22   1.109 -18.321   1.243
  289    HA   ARG  22           HA       ARG  22  -0.595 -20.023   2.731
  290   1HB   ARG  22          1HB       ARG  22  -0.497 -17.057   3.250
  291   2HB   ARG  22          2HB       ARG  22  -0.561 -18.380   4.413
  292   1HG   ARG  22          1HG       ARG  22   1.792 -17.500   2.730
  293   2HG   ARG  22          2HG       ARG  22   1.683 -17.582   4.487
  294   1HD   ARG  22          1HD       ARG  22   1.259 -20.115   4.136
  295   2HD   ARG  22          2HD       ARG  22   1.905 -19.851   2.516
  296    HE   ARG  22           HE       ARG  22   3.530 -20.200   4.749
  297   1HH1  ARG  22          1HH1      ARG  22   3.357 -18.459   1.853
  298   2HH1  ARG  22          2HH1      ARG  22   4.777 -17.510   2.147
  299   1HH2  ARG  22          1HH2      ARG  22   5.195 -18.664   5.391
  300   2HH2  ARG  22          2HH2      ARG  22   5.817 -17.626   4.152
  301    H    GLY  23           H        GLY  23  -1.335 -17.062   0.927
  302   1HA   GLY  23          1HA       GLY  23  -3.778 -17.732  -0.133
  303   2HA   GLY  23          2HA       GLY  23  -4.191 -17.249   1.516
  304    H    PHE  24           H        PHE  24  -5.330 -15.368   0.712
  305    HA   PHE  24           HA       PHE  24  -4.135 -12.907   0.841
  306   1HB   PHE  24          1HB       PHE  24  -2.552 -13.242  -0.866
  307   2HB   PHE  24          2HB       PHE  24  -3.674 -14.159  -1.863
  308    HD1  PHE  24           HD1      PHE  24  -4.256 -10.860  -0.197
  309    HD2  PHE  24           HD2      PHE  24  -3.665 -12.971  -3.894
  310    HE1  PHE  24           HE1      PHE  24  -4.802  -8.798  -1.466
  311    HE2  PHE  24           HE2      PHE  24  -4.214 -10.913  -5.161
  312    HZ   PHE  24           HZ       PHE  24  -4.784  -8.823  -3.948
  313    H    PHE  25           H        PHE  25  -5.794 -11.461   0.812
  314    HA   PHE  25           HA       PHE  25  -8.031 -11.811  -1.087
  315   1HB   PHE  25          1HB       PHE  25  -8.445 -11.734   1.918
  316   2HB   PHE  25          2HB       PHE  25  -9.724 -11.711   0.702
  317    HD1  PHE  25           HD1      PHE  25  -7.787 -13.793   2.807
  318    HD2  PHE  25           HD2      PHE  25  -9.601 -13.663  -1.087
  319    HE1  PHE  25           HE1      PHE  25  -7.745 -16.273   2.703
  320    HE2  PHE  25           HE2      PHE  25  -9.559 -16.143  -1.191
  321    HZ   PHE  25           HZ       PHE  25  -8.630 -17.449   0.704
  322    H    TYR  26           H        TYR  26  -8.202  -9.811  -1.958
  323    HA   TYR  26           HA       TYR  26  -7.410  -7.452  -0.361
  324   1HB   TYR  26          1HB       TYR  26  -6.664  -7.736  -2.744
  325   2HB   TYR  26          2HB       TYR  26  -8.351  -7.580  -3.239
  326    HD1  TYR  26           HD1      TYR  26  -6.013  -5.824  -0.877
  327    HD2  TYR  26           HD2      TYR  26  -8.971  -5.466  -3.975
  328    HE1  TYR  26           HE1      TYR  26  -5.819  -3.355  -0.777
  329    HE2  TYR  26           HE2      TYR  26  -8.776  -2.994  -3.874
  330    HH   TYR  26           HH       TYR  26  -6.242  -1.423  -2.193
  331    H    THR  27           H        THR  27  -8.943  -6.410   0.810
  332    HA   THR  27           HA       THR  27 -11.796  -6.815   0.124
  333    HB   THR  27           HB       THR  27 -10.727  -5.225   2.459
  334    HG1  THR  27           HG1      THR  27 -10.718  -7.962   1.984
  335   1HG2  THR  27          1HG2      THR  27 -13.233  -6.882   2.078
  336   2HG2  THR  27          2HG2      THR  27 -13.152  -5.131   1.895
  337   3HG2  THR  27          3HG2      THR  27 -12.848  -5.866   3.469
  338    H    LYS  28           H        LYS  28 -12.480  -5.418  -1.453
  339    HA   LYS  28           HA       LYS  28 -11.335  -2.889  -2.041
  340   1HB   LYS  28          1HB       LYS  28 -13.357  -2.465  -3.352
  341   2HB   LYS  28          2HB       LYS  28 -12.859  -4.142  -3.569
  342   1HG   LYS  28          1HG       LYS  28 -14.511  -4.890  -1.941
  343   2HG   LYS  28          2HG       LYS  28 -14.963  -3.221  -1.590
  344   1HD   LYS  28          1HD       LYS  28 -15.571  -2.974  -4.037
  345   2HD   LYS  28          2HD       LYS  28 -15.349  -4.718  -4.193
  346   1HE   LYS  28          1HE       LYS  28 -17.272  -3.359  -2.283
  347   2HE   LYS  28          2HE       LYS  28 -17.720  -4.160  -3.789
  348   1HZ   LYS  28          1HZ       LYS  28 -17.800  -6.059  -2.687
  349   2HZ   LYS  28          2HZ       LYS  28 -17.285  -5.300  -1.256
  350   3HZ   LYS  28          3HZ       LYS  28 -16.143  -5.933  -2.343
  351    HA   PRO  29           HA       PRO  29 -12.939  -0.533   1.350
  352   1HB   PRO  29          1HB       PRO  29 -12.130   1.924   0.417
  353   2HB   PRO  29          2HB       PRO  29 -11.033   0.753   1.169
  354   1HG   PRO  29          1HG       PRO  29 -11.302   1.492  -1.706
  355   2HG   PRO  29          2HG       PRO  29  -9.901   0.836  -0.842
  356   1HD   PRO  29          1HD       PRO  29 -11.661  -0.625  -2.521
  357   2HD   PRO  29          2HD       PRO  29 -10.443  -1.312  -1.426
  358    H    THR  30           H        THR  30 -14.136  -0.539  -1.796
  359    HA   THR  30           HA       THR  30 -16.151   0.233  -2.720
  360    HB   THR  30           HB       THR  30 -17.304   1.312  -0.268
  361    HG1  THR  30           HG1      THR  30 -17.289  -0.773   0.763
  362   1HG2  THR  30          1HG2      THR  30 -18.287   0.249  -2.491
  363   2HG2  THR  30          2HG2      THR  30 -19.134   0.070  -0.954
  364   3HG2  THR  30          3HG2      THR  30 -18.138  -1.247  -1.571
  Start of MODEL   12
    1   1H    GLY   1          1H        GLY   1  -8.887   3.015   7.783
    2   2H    GLY   1          2H        GLY   1  -8.834   3.379   6.125
    3   3H    GLY   1          3H        GLY   1 -10.252   3.669   7.014
    4   1HA   GLY   1          1HA       GLY   1  -9.464   5.707   7.473
    5   2HA   GLY   1          2HA       GLY   1  -8.061   5.002   8.333
    6    H    GLY   2           H        GLY   2  -7.612   4.483   5.184
    7   1HA   GLY   2          1HA       GLY   2  -7.907   7.223   4.076
    8   2HA   GLY   2          2HA       GLY   2  -6.285   6.533   4.157
    9    H    GLY   3           H        GLY   3  -7.148   7.160   1.670
   10   1HA   GLY   3          1HA       GLY   3  -8.421   4.799   0.445
   11   2HA   GLY   3          2HA       GLY   3  -7.943   6.273  -0.400
   12    H    GLU   4           H        GLU   4  -5.241   6.362   0.573
   13    HA   GLU   4           HA       GLU   4  -4.114   3.945  -0.790
   14   1HB   GLU   4          1HB       GLU   4  -3.189   6.831  -0.837
   15   2HB   GLU   4          2HB       GLU   4  -2.204   5.490  -1.423
   16   1HG   GLU   4          1HG       GLU   4  -3.974   4.882  -3.027
   17   2HG   GLU   4          2HG       GLU   4  -4.970   6.214  -2.437
   18    H    GLN   5           H        GLN   5  -2.497   2.860   0.317
   19    HA   GLN   5           HA       GLN   5  -1.569   4.108   2.873
   20   1HB   GLN   5          1HB       GLN   5  -3.127   2.070   3.042
   21   2HB   GLN   5          2HB       GLN   5  -1.780   1.132   2.393
   22   1HG   GLN   5          1HG       GLN   5  -1.795   1.089   4.868
   23   2HG   GLN   5          2HG       GLN   5  -0.348   1.885   4.249
   24   1HE2  GLN   5          1HE2      GLN   5  -0.315   2.989   6.447
   25   2HE2  GLN   5          2HE2      GLN   5  -1.290   4.359   6.677
   26    H    CYS   6           H        CYS   6  -0.711   2.462  -0.053
   27    HA   CYS   6           HA       CYS   6   2.168   2.635   0.751
   28   1HB   CYS   6          1HB       CYS   6   0.980   0.651  -1.209
   29   2HB   CYS   6          2HB       CYS   6   2.631   0.678  -0.591
   30    H    CYS   7           H        CYS   7   0.108   4.371  -0.822
   31    HA   CYS   7           HA       CYS   7   1.540   4.541  -3.420
   32   1HB   CYS   7          1HB       CYS   7  -1.040   4.567  -3.160
   33   2HB   CYS   7          2HB       CYS   7  -0.826   6.220  -2.588
   34    H    THR   8           H        THR   8   0.980   6.319  -0.436
   35    HA   THR   8           HA       THR   8   2.676   8.541  -1.483
   36    HB   THR   8           HB       THR   8   0.407   9.104  -0.541
   37    HG1  THR   8           HG1      THR   8   1.339  10.898  -0.048
   38   1HG2  THR   8          1HG2      THR   8  -0.150   8.683   1.670
   39   2HG2  THR   8          2HG2      THR   8   1.534   8.596   2.185
   40   3HG2  THR   8          3HG2      THR   8   0.813   7.251   1.302
   41    H    SER   9           H        SER   9   2.350   6.191   1.146
   42    HA   SER   9           HA       SER   9   5.005   7.064   2.189
   43   1HB   SER   9          1HB       SER   9   2.756   6.602   3.601
   44   2HB   SER   9          2HB       SER   9   3.426   4.972   3.598
   45    HG   SER   9           HG       SER   9   4.449   5.859   5.266
   46    H    ILE  10           H        ILE  10   5.409   4.422   3.464
   47    HA   ILE  10           HA       ILE  10   5.818   2.695   1.072
   48    HB   ILE  10           HB       ILE  10   8.001   3.044   3.124
   49   1HG1  ILE  10          1HG1      ILE  10   7.803   4.526   0.487
   50   2HG1  ILE  10          2HG1      ILE  10   7.402   5.256   2.043
   51   1HG2  ILE  10          1HG2      ILE  10   7.613   1.705   0.498
   52   2HG2  ILE  10          2HG2      ILE  10   8.601   1.217   1.874
   53   3HG2  ILE  10          3HG2      ILE  10   9.184   2.459   0.766
   54   1HD1  ILE  10          1HD1      ILE  10   9.754   4.444   2.786
   55   2HD1  ILE  10          2HD1      ILE  10   9.660   5.854   1.731
   56   3HD1  ILE  10          3HD1      ILE  10  10.078   4.277   1.060
   57    H    CYS  11           H        CYS  11   4.923   0.763   1.534
   58    HA   CYS  11           HA       CYS  11   4.678  -0.075   4.379
   59   1HB   CYS  11          1HB       CYS  11   3.473  -1.486   1.995
   60   2HB   CYS  11          2HB       CYS  11   2.934  -1.519   3.675
   61    H    SER  12           H        SER  12   4.695  -2.791   4.246
   62    HA   SER  12           HA       SER  12   7.148  -3.556   2.755
   63   1HB   SER  12          1HB       SER  12   8.040  -3.022   4.913
   64   2HB   SER  12          2HB       SER  12   6.746  -3.887   5.730
   65    HG   SER  12           HG       SER  12   8.334  -5.344   5.680
   66    H    LEU  13           H        LEU  13   7.502  -5.973   3.014
   67    HA   LEU  13           HA       LEU  13   5.108  -7.314   2.152
   68   1HB   LEU  13          1HB       LEU  13   6.445  -9.259   1.872
   69   2HB   LEU  13          2HB       LEU  13   7.522  -7.910   1.523
   70    HG   LEU  13           HG       LEU  13   7.336  -9.066   4.306
   71   1HD1  LEU  13          1HD1      LEU  13   9.580 -10.204   3.421
   72   2HD1  LEU  13          2HD1      LEU  13   8.709 -10.155   1.889
   73   3HD1  LEU  13          3HD1      LEU  13   8.019 -11.010   3.268
   74   1HD2  LEU  13          1HD2      LEU  13   9.195  -7.292   2.748
   75   2HD2  LEU  13          2HD2      LEU  13   9.829  -8.239   4.095
   76   3HD2  LEU  13          3HD2      LEU  13   8.541  -7.067   4.370
   77    H    TYR  14           H        TYR  14   6.068  -6.466   5.204
   78    HA   TYR  14           HA       TYR  14   4.846  -8.827   6.492
   79   1HB   TYR  14          1HB       TYR  14   6.661  -6.688   7.246
   80   2HB   TYR  14          2HB       TYR  14   5.384  -6.927   8.435
   81    HD1  TYR  14           HD1      TYR  14   7.572  -9.051   6.232
   82    HD2  TYR  14           HD2      TYR  14   5.846  -8.461  10.123
   83    HE1  TYR  14           HE1      TYR  14   8.727 -11.090   7.056
   84    HE2  TYR  14           HE2      TYR  14   7.002 -10.499  10.947
   85    HH   TYR  14           HH       TYR  14   8.004 -12.492  10.146
   86    H    GLN  15           H        GLN  15   4.457  -5.331   6.292
   87    HA   GLN  15           HA       GLN  15   1.887  -5.363   7.652
   88   1HB   GLN  15          1HB       GLN  15   3.554  -3.309   6.257
   89   2HB   GLN  15          2HB       GLN  15   1.834  -2.975   6.456
   90   1HG   GLN  15          1HG       GLN  15   1.982  -2.839   8.751
   91   2HG   GLN  15          2HG       GLN  15   3.310  -3.997   8.837
   92   1HE2  GLN  15          1HE2      GLN  15   2.563  -0.604   7.949
   93   2HE2  GLN  15          2HE2      GLN  15   4.144  -0.030   8.183
   94    H    LEU  16           H        LEU  16   3.020  -5.513   4.346
   95    HA   LEU  16           HA       LEU  16   0.293  -5.264   3.291
   96   1HB   LEU  16          1HB       LEU  16   1.269  -5.129   1.222
   97   2HB   LEU  16          2HB       LEU  16   2.668  -4.683   2.187
   98    HG   LEU  16           HG       LEU  16   3.263  -7.174   2.190
   99   1HD1  LEU  16          1HD1      LEU  16   1.665  -8.523   1.305
  100   2HD1  LEU  16          2HD1      LEU  16   2.162  -7.900  -0.268
  101   3HD1  LEU  16          3HD1      LEU  16   0.812  -7.157   0.589
  102   1HD2  LEU  16          1HD2      LEU  16   3.899  -5.095   0.504
  103   2HD2  LEU  16          2HD2      LEU  16   3.365  -6.333  -0.633
  104   3HD2  LEU  16          3HD2      LEU  16   4.688  -6.671   0.482
  105    H    GLU  17           H        GLU  17   2.454  -7.678   4.445
  106    HA   GLU  17           HA       GLU  17   1.229  -9.958   3.152
  107   1HB   GLU  17          1HB       GLU  17   3.297 -10.505   4.104
  108   2HB   GLU  17          2HB       GLU  17   2.982  -9.577   5.570
  109   1HG   GLU  17          1HG       GLU  17   1.231 -11.931   4.970
  110   2HG   GLU  17          2HG       GLU  17   2.860 -12.233   5.577
  111    H    ASN  18           H        ASN  18   0.386  -7.864   5.760
  112    HA   ASN  18           HA       ASN  18  -1.413  -9.575   7.172
  113   1HB   ASN  18          1HB       ASN  18  -0.535  -7.154   7.725
  114   2HB   ASN  18          2HB       ASN  18  -1.968  -6.643   6.832
  115   1HD2  ASN  18          1HD2      ASN  18  -2.805  -5.811   8.959
  116   2HD2  ASN  18          2HD2      ASN  18  -3.506  -6.900  10.055
  117    H    TYR  19           H        TYR  19  -1.522  -8.278   4.036
  118    HA   TYR  19           HA       TYR  19  -4.404  -8.047   3.769
  119   1HB   TYR  19          1HB       TYR  19  -2.132  -8.204   1.779
  120   2HB   TYR  19          2HB       TYR  19  -3.818  -8.080   1.282
  121    HD1  TYR  19           HD1      TYR  19  -1.794  -6.445   4.010
  122    HD2  TYR  19           HD2      TYR  19  -4.312  -5.927   0.566
  123    HE1  TYR  19           HE1      TYR  19  -1.722  -3.989   4.329
  124    HE2  TYR  19           HE2      TYR  19  -4.239  -3.469   0.886
  125    HH   TYR  19           HH       TYR  19  -3.388  -1.792   2.062
  126    H    CYS  20           H        CYS  20  -2.022 -10.572   3.338
  127    HA   CYS  20           HA       CYS  20  -3.892 -12.346   1.964
  128   1HB   CYS  20          1HB       CYS  20  -1.399 -13.362   3.270
  129   2HB   CYS  20          2HB       CYS  20  -2.125 -13.831   1.736
  130    H    ASN  21           H        ASN  21  -3.761 -14.743   3.067
  131    HA   ASN  21           HA       ASN  21  -4.969 -14.339   5.770
  132   1HB   ASN  21          1HB       ASN  21  -6.076 -15.539   3.572
  133   2HB   ASN  21          2HB       ASN  21  -5.377 -16.928   4.406
  134   1HD2  ASN  21          1HD2      ASN  21  -8.283 -16.135   4.144
  135   2HD2  ASN  21          2HD2      ASN  21  -8.853 -16.011   5.738
  136   1H    PHE   1          1H        PHE   1  15.902  -5.648   0.163
  137   2H    PHE   1          2H        PHE   1  15.566  -7.307   0.015
  138   3H    PHE   1          3H        PHE   1  14.666  -6.349   1.092
  139    HA   PHE   1           HA       PHE   1  14.684  -5.629  -1.751
  140   1HB   PHE   1          1HB       PHE   1  12.583  -7.145  -1.881
  141   2HB   PHE   1          2HB       PHE   1  14.163  -7.921  -2.002
  142    HD1  PHE   1           HD1      PHE   1  11.226  -7.350   0.151
  143    HD2  PHE   1           HD2      PHE   1  15.067  -9.252  -0.164
  144    HE1  PHE   1           HE1      PHE   1  10.707  -8.728   2.148
  145    HE2  PHE   1           HE2      PHE   1  14.549 -10.630   1.833
  146    HZ   PHE   1           HZ       PHE   1  12.369 -10.367   2.989
  147    H    VAL   2           H        VAL   2  14.493  -3.890   0.370
  148    HA   VAL   2           HA       VAL   2  11.644  -3.558   1.055
  149    HB   VAL   2           HB       VAL   2  13.786  -3.065   2.532
  150   1HG1  VAL   2          1HG1      VAL   2  13.308  -0.281   1.529
  151   2HG1  VAL   2          2HG1      VAL   2  14.465  -1.317   0.694
  152   3HG1  VAL   2          3HG1      VAL   2  14.698  -0.930   2.398
  153   1HG2  VAL   2          1HG2      VAL   2  11.069  -2.004   2.444
  154   2HG2  VAL   2          2HG2      VAL   2  12.178  -0.941   3.308
  155   3HG2  VAL   2          3HG2      VAL   2  11.987  -2.617   3.818
  156    H    ASN   3           H        ASN   3  11.569  -0.750   1.064
  157    HA   ASN   3           HA       ASN   3  11.022   1.049  -0.343
  158   1HB   ASN   3          1HB       ASN   3  13.502   0.300  -1.139
  159   2HB   ASN   3          2HB       ASN   3  12.602  -0.012  -2.624
  160   1HD2  ASN   3          1HD2      ASN   3  13.088   2.568  -0.156
  161   2HD2  ASN   3          2HD2      ASN   3  12.859   3.854  -1.240
  162    H    GLN   4           H        GLN   4   8.929   0.897  -1.018
  163    HA   GLN   4           HA       GLN   4   8.374  -0.563  -3.517
  164   1HB   GLN   4          1HB       GLN   4   8.049  -2.143  -1.497
  165   2HB   GLN   4          2HB       GLN   4   6.646  -1.145  -1.113
  166   1HG   GLN   4          1HG       GLN   4   5.642  -2.725  -2.474
  167   2HG   GLN   4          2HG       GLN   4   6.102  -1.529  -3.686
  168   1HE2  GLN   4          1HE2      GLN   4   6.908  -2.632  -5.475
  169   2HE2  GLN   4          2HE2      GLN   4   7.984  -3.943  -5.407
  170    H    HIS   5           H        HIS   5   7.475   1.105  -4.636
  171    HA   HIS   5           HA       HIS   5   5.360   2.715  -3.257
  172   1HB   HIS   5          1HB       HIS   5   7.697   3.599  -4.574
  173   2HB   HIS   5          2HB       HIS   5   6.366   3.953  -5.676
  174    HD2  HIS   5           HD2      HIS   5   5.909   4.174  -1.769
  175    HE1  HIS   5           HE1      HIS   5   5.600   8.062  -3.403
  176    HE2  HIS   5           HE2      HIS   5   5.367   6.672  -1.277
  177    H    LEU   6           H        LEU   6   3.464   1.764  -3.913
  178    HA   LEU   6           HA       LEU   6   2.798   1.812  -6.757
  179   1HB   LEU   6          1HB       LEU   6   2.321  -0.571  -6.971
  180   2HB   LEU   6          2HB       LEU   6   4.010  -0.362  -6.513
  181    HG   LEU   6           HG       LEU   6   1.742  -1.003  -4.612
  182   1HD1  LEU   6          1HD1      LEU   6   3.117  -2.681  -6.374
  183   2HD1  LEU   6          2HD1      LEU   6   2.199  -3.194  -4.960
  184   3HD1  LEU   6          3HD1      LEU   6   3.934  -2.914  -4.828
  185   1HD2  LEU   6          1HD2      LEU   6   4.583  -0.223  -4.250
  186   2HD2  LEU   6          2HD2      LEU   6   4.022  -1.579  -3.272
  187   3HD2  LEU   6          3HD2      LEU   6   3.211  -0.018  -3.160
  188    H    CYS   7           H        CYS   7   0.496   1.640  -7.070
  189    HA   CYS   7           HA       CYS   7  -1.115   1.368  -4.582
  190   1HB   CYS   7          1HB       CYS   7  -2.231   3.469  -6.217
  191   2HB   CYS   7          2HB       CYS   7  -1.747   3.530  -4.527
  192    H    GLY   8           H        GLY   8  -3.441   1.077  -5.057
  193   1HA   GLY   8          1HA       GLY   8  -5.091  -0.185  -6.152
  194   2HA   GLY   8          2HA       GLY   8  -4.632   0.777  -7.557
  195    H    SER   9           H        SER   9  -4.468  -0.661  -9.204
  196    HA   SER   9           HA       SER   9  -4.016  -3.358  -9.238
  197   1HB   SER   9          1HB       SER   9  -4.377  -2.013 -11.277
  198   2HB   SER   9          2HB       SER   9  -2.738  -1.380 -11.149
  199    HG   SER   9           HG       SER   9  -2.130  -3.708 -11.152
  200    H    ASP  10           H        ASP  10  -1.209  -1.292 -10.004
  201    HA   ASP  10           HA       ASP  10   0.810  -3.097  -9.591
  202   1HB   ASP  10          1HB       ASP  10   0.898  -0.250  -8.565
  203   2HB   ASP  10          2HB       ASP  10   2.281  -1.244  -9.025
  204    H    LEU  11           H        LEU  11  -1.076  -1.532  -7.082
  205    HA   LEU  11           HA       LEU  11   0.584  -2.318  -4.891
  206   1HB   LEU  11          1HB       LEU  11  -1.282  -0.590  -4.828
  207   2HB   LEU  11          2HB       LEU  11  -2.412  -1.940  -4.779
  208    HG   LEU  11           HG       LEU  11  -1.686  -2.634  -2.650
  209   1HD1  LEU  11          1HD1      LEU  11   0.399  -1.809  -1.588
  210   2HD1  LEU  11          2HD1      LEU  11   0.770  -0.902  -3.053
  211   3HD1  LEU  11          3HD1      LEU  11   0.727  -2.666  -3.094
  212   1HD2  LEU  11          1HD2      LEU  11  -2.656  -0.835  -1.705
  213   2HD2  LEU  11          2HD2      LEU  11  -2.195   0.169  -3.079
  214   3HD2  LEU  11          3HD2      LEU  11  -1.090  -0.025  -1.719
  215    H    VAL  12           H        VAL  12  -1.950  -3.965  -6.658
  216    HA   VAL  12           HA       VAL  12  -2.048  -6.195  -4.778
  217    HB   VAL  12           HB       VAL  12  -3.651  -7.146  -6.203
  218   1HG1  VAL  12          1HG1      VAL  12  -3.844  -4.280  -7.127
  219   2HG1  VAL  12          2HG1      VAL  12  -4.152  -4.728  -5.449
  220   3HG1  VAL  12          3HG1      VAL  12  -5.151  -5.398  -6.739
  221   1HG2  VAL  12          1HG2      VAL  12  -2.085  -5.793  -8.392
  222   2HG2  VAL  12          2HG2      VAL  12  -3.749  -6.296  -8.682
  223   3HG2  VAL  12          3HG2      VAL  12  -2.530  -7.491  -8.237
  224    H    GLU  13           H        GLU  13  -0.142  -5.244  -7.496
  225    HA   GLU  13           HA       GLU  13   0.899  -7.792  -8.260
  226   1HB   GLU  13          1HB       GLU  13   1.247  -5.378  -9.301
  227   2HB   GLU  13          2HB       GLU  13   2.646  -5.346  -8.227
  228   1HG   GLU  13          1HG       GLU  13   3.794  -6.819  -9.504
  229   2HG   GLU  13          2HG       GLU  13   2.392  -7.873  -9.689
  230    H    ALA  14           H        ALA  14   1.699  -5.494  -5.699
  231    HA   ALA  14           HA       ALA  14   3.969  -7.091  -4.755
  232   1HB   ALA  14          1HB       ALA  14   4.233  -4.821  -4.236
  233   2HB   ALA  14          2HB       ALA  14   3.632  -5.478  -2.714
  234   3HB   ALA  14          3HB       ALA  14   2.536  -4.623  -3.800
  235    H    LEU  15           H        LEU  15   0.555  -7.109  -4.402
  236    HA   LEU  15           HA       LEU  15   0.596  -8.488  -1.801
  237   1HB   LEU  15          1HB       LEU  15  -1.613  -7.821  -3.765
  238   2HB   LEU  15          2HB       LEU  15  -1.890  -8.738  -2.285
  239    HG   LEU  15           HG       LEU  15  -0.451  -6.107  -2.139
  240   1HD1  LEU  15          1HD1      LEU  15  -3.181  -6.511  -3.053
  241   2HD1  LEU  15          2HD1      LEU  15  -2.252  -5.015  -2.944
  242   3HD1  LEU  15          3HD1      LEU  15  -3.144  -5.603  -1.541
  243   1HD2  LEU  15          1HD2      LEU  15  -2.492  -7.213  -0.224
  244   2HD2  LEU  15          2HD2      LEU  15  -1.112  -6.167   0.108
  245   3HD2  LEU  15          3HD2      LEU  15  -0.858  -7.878  -0.238
  246    H    TYR  16           H        TYR  16   0.561  -9.182  -5.178
  247    HA   TYR  16           HA       TYR  16  -0.237 -11.980  -4.880
  248   1HB   TYR  16          1HB       TYR  16  -0.830 -11.119  -6.975
  249   2HB   TYR  16          2HB       TYR  16   0.665 -10.199  -7.130
  250    HD1  TYR  16           HD1      TYR  16  -0.911 -13.505  -7.519
  251    HD2  TYR  16           HD2      TYR  16   2.747 -11.272  -7.845
  252    HE1  TYR  16           HE1      TYR  16   0.103 -15.356  -8.824
  253    HE2  TYR  16           HE2      TYR  16   3.762 -13.122  -9.150
  254    HH   TYR  16           HH       TYR  16   3.511 -15.256  -9.813
  255    H    LEU  17           H        LEU  17   2.645 -10.115  -4.667
  256    HA   LEU  17           HA       LEU  17   4.387 -12.488  -5.054
  257   1HB   LEU  17          1HB       LEU  17   5.043 -10.378  -6.143
  258   2HB   LEU  17          2HB       LEU  17   5.052  -9.567  -4.578
  259    HG   LEU  17           HG       LEU  17   6.698 -11.636  -4.019
  260   1HD1  LEU  17          1HD1      LEU  17   6.562 -12.529  -6.318
  261   2HD1  LEU  17          2HD1      LEU  17   8.197 -11.980  -5.948
  262   3HD1  LEU  17          3HD1      LEU  17   7.140 -10.985  -6.948
  263   1HD2  LEU  17          1HD2      LEU  17   8.548  -9.941  -4.826
  264   2HD2  LEU  17          2HD2      LEU  17   7.461  -9.490  -3.513
  265   3HD2  LEU  17          3HD2      LEU  17   7.166  -8.893  -5.147
  266    H    VAL  18           H        VAL  18   2.942 -10.605  -2.565
  267    HA   VAL  18           HA       VAL  18   4.900 -11.443  -0.528
  268    HB   VAL  18           HB       VAL  18   2.420  -9.732  -0.483
  269   1HG1  VAL  18          1HG1      VAL  18   3.318  -9.396   2.007
  270   2HG1  VAL  18          2HG1      VAL  18   3.860 -11.060   1.777
  271   3HG1  VAL  18          3HG1      VAL  18   2.149 -10.658   1.619
  272   1HG2  VAL  18          1HG2      VAL  18   5.281  -9.324  -0.677
  273   2HG2  VAL  18          2HG2      VAL  18   4.638  -8.506   0.747
  274   3HG2  VAL  18          3HG2      VAL  18   3.980  -8.146  -0.850
  275    H    CYS  19           H        CYS  19   1.446 -11.894  -1.159
  276    HA   CYS  19           HA       CYS  19   0.834 -13.646   0.936
  277   1HB   CYS  19          1HB       CYS  19  -0.197 -13.743  -1.915
  278   2HB   CYS  19          2HB       CYS  19  -0.952 -14.532  -0.534
  279    H    GLY  20           H        GLY  20   2.548 -14.268  -2.062
  280   1HA   GLY  20          1HA       GLY  20   3.497 -16.267  -2.903
  281   2HA   GLY  20          2HA       GLY  20   4.078 -16.406  -1.244
  282    H    GLU  21           H        GLU  21   3.027 -17.842   0.175
  283    HA   GLU  21           HA       GLU  21   0.749 -19.401  -0.964
  284   1HB   GLU  21          1HB       GLU  21   3.156 -20.492  -1.070
  285   2HB   GLU  21          2HB       GLU  21   2.867 -20.797   0.642
  286   1HG   GLU  21          1HG       GLU  21   0.574 -21.741  -0.136
  287   2HG   GLU  21          2HG       GLU  21   1.315 -21.807  -1.736
  288    H    ARG  22           H        ARG  22  -0.720 -18.436   0.419
  289    HA   ARG  22           HA       ARG  22  -0.933 -19.518   3.072
  290   1HB   ARG  22          1HB       ARG  22   0.753 -17.305   2.942
  291   2HB   ARG  22          2HB       ARG  22  -0.793 -16.620   3.444
  292   1HG   ARG  22          1HG       ARG  22  -0.801 -18.724   5.072
  293   2HG   ARG  22          2HG       ARG  22   0.945 -18.612   4.846
  294   1HD   ARG  22          1HD       ARG  22   0.189 -15.974   5.267
  295   2HD   ARG  22          2HD       ARG  22  -0.846 -16.874   6.376
  296    HE   ARG  22           HE       ARG  22   2.120 -17.261   6.362
  297   1HH1  ARG  22          1HH1      ARG  22   0.816 -15.057   8.062
  298   2HH1  ARG  22          2HH1      ARG  22   0.704 -15.858   9.594
  299   1HH2  ARG  22          1HH2      ARG  22   1.232 -19.021   8.276
  300   2HH2  ARG  22          2HH2      ARG  22   0.938 -18.102   9.714
  301    H    GLY  23           H        GLY  23  -1.868 -17.041   0.739
  302   1HA   GLY  23          1HA       GLY  23  -4.464 -17.543   0.338
  303   2HA   GLY  23          2HA       GLY  23  -4.555 -16.822   1.947
  304    H    PHE  24           H        PHE  24  -5.876 -15.161   0.729
  305    HA   PHE  24           HA       PHE  24  -4.370 -12.781   0.306
  306   1HB   PHE  24          1HB       PHE  24  -3.770 -14.051  -1.798
  307   2HB   PHE  24          2HB       PHE  24  -5.469 -13.968  -2.252
  308    HD1  PHE  24           HD1      PHE  24  -4.244 -11.124  -0.350
  309    HD2  PHE  24           HD2      PHE  24  -4.623 -12.754  -4.311
  310    HE1  PHE  24           HE1      PHE  24  -3.866  -8.875  -1.313
  311    HE2  PHE  24           HE2      PHE  24  -4.248 -10.500  -5.271
  312    HZ   PHE  24           HZ       PHE  24  -3.871  -8.560  -3.772
  313    H    PHE  25           H        PHE  25  -5.825 -11.156   0.763
  314    HA   PHE  25           HA       PHE  25  -8.602 -11.389  -0.199
  315   1HB   PHE  25          1HB       PHE  25  -8.262 -12.589   2.110
  316   2HB   PHE  25          2HB       PHE  25  -8.224 -10.946   2.749
  317    HD1  PHE  25           HD1      PHE  25 -10.192 -12.352  -0.110
  318    HD2  PHE  25           HD2      PHE  25 -10.287 -10.655   3.837
  319    HE1  PHE  25           HE1      PHE  25 -12.667 -12.250  -0.214
  320    HE2  PHE  25           HE2      PHE  25 -12.764 -10.555   3.735
  321    HZ   PHE  25           HZ       PHE  25 -13.954 -11.353   1.709
  322    H    TYR  26           H        TYR  26  -8.500  -9.426  -1.249
  323    HA   TYR  26           HA       TYR  26  -9.057  -7.029   0.007
  324   1HB   TYR  26          1HB       TYR  26  -6.969  -7.018   1.202
  325   2HB   TYR  26          2HB       TYR  26  -6.063  -7.422  -0.258
  326    HD1  TYR  26           HD1      TYR  26  -8.008  -4.777   1.463
  327    HD2  TYR  26           HD2      TYR  26  -5.523  -5.745  -1.906
  328    HE1  TYR  26           HE1      TYR  26  -7.799  -2.364   0.925
  329    HE2  TYR  26           HE2      TYR  26  -5.317  -3.331  -2.446
  330    HH   TYR  26           HH       TYR  26  -5.696  -0.995  -0.587
  331    H    THR  27           H        THR  27 -10.081  -6.231  -1.774
  332    HA   THR  27           HA       THR  27  -8.466  -5.953  -4.274
  333    HB   THR  27           HB       THR  27 -10.306  -6.617  -5.636
  334    HG1  THR  27           HG1      THR  27 -11.929  -6.908  -3.353
  335   1HG2  THR  27          1HG2      THR  27 -10.798  -8.883  -4.861
  336   2HG2  THR  27          2HG2      THR  27 -10.305  -8.450  -3.224
  337   3HG2  THR  27          3HG2      THR  27  -9.112  -8.489  -4.523
  338    H    LYS  28           H        LYS  28 -10.891  -4.719  -5.545
  339    HA   LYS  28           HA       LYS  28 -10.815  -2.122  -4.058
  340   1HB   LYS  28          1HB       LYS  28 -11.300  -1.137  -6.385
  341   2HB   LYS  28          2HB       LYS  28  -9.677  -1.774  -6.122
  342   1HG   LYS  28          1HG       LYS  28 -10.091  -3.708  -7.389
  343   2HG   LYS  28          2HG       LYS  28 -11.840  -3.548  -7.233
  344   1HD   LYS  28          1HD       LYS  28 -10.344  -1.350  -8.601
  345   2HD   LYS  28          2HD       LYS  28 -10.600  -2.856  -9.484
  346   1HE   LYS  28          1HE       LYS  28 -13.073  -2.322  -8.296
  347   2HE   LYS  28          2HE       LYS  28 -12.507  -0.748  -8.851
  348   1HZ   LYS  28          1HZ       LYS  28 -11.948  -2.688 -10.810
  349   2HZ   LYS  28          2HZ       LYS  28 -12.954  -1.323 -10.923
  350   3HZ   LYS  28          3HZ       LYS  28 -13.584  -2.804 -10.379
  351    HA   PRO  29           HA       PRO  29 -15.183  -3.525  -4.155
  352   1HB   PRO  29          1HB       PRO  29 -15.674  -2.882  -1.529
  353   2HB   PRO  29          2HB       PRO  29 -15.029  -4.447  -2.052
  354   1HG   PRO  29          1HG       PRO  29 -13.608  -2.182  -0.729
  355   2HG   PRO  29          2HG       PRO  29 -13.236  -3.912  -0.696
  356   1HD   PRO  29          1HD       PRO  29 -11.915  -1.968  -2.270
  357   2HD   PRO  29          2HD       PRO  29 -11.795  -3.729  -2.470
  358    H    THR  30           H        THR  30 -15.176  -1.107  -1.650
  359    HA   THR  30           HA       THR  30 -15.535   1.200  -3.351
  360    HB   THR  30           HB       THR  30 -18.101   0.473  -2.002
  361    HG1  THR  30           HG1      THR  30 -18.558  -1.046  -3.380
  362   1HG2  THR  30          1HG2      THR  30 -17.105   2.419  -3.856
  363   2HG2  THR  30          2HG2      THR  30 -18.709   2.318  -3.131
  364   3HG2  THR  30          3HG2      THR  30 -18.372   1.482  -4.648
  Start of MODEL   13
    1   1H    GLY   1          1H        GLY   1  -2.185   3.871  11.251
    2   2H    GLY   1          2H        GLY   1  -3.823   3.518  11.530
    3   3H    GLY   1          3H        GLY   1  -3.221   5.075  11.851
    4   1HA   GLY   1          1HA       GLY   1  -2.759   4.466   9.178
    5   2HA   GLY   1          2HA       GLY   1  -4.489   4.147   9.504
    6    H    GLY   2           H        GLY   2  -4.414   5.894   7.781
    7   1HA   GLY   2          1HA       GLY   2  -4.063   8.583   8.492
    8   2HA   GLY   2          2HA       GLY   2  -2.547   8.087   7.735
    9    H    GLY   3           H        GLY   3  -3.449   6.354   5.769
   10   1HA   GLY   3          1HA       GLY   3  -5.318   8.032   4.151
   11   2HA   GLY   3          2HA       GLY   3  -3.810   7.435   3.455
   12    H    GLU   4           H        GLU   4  -4.183   5.703   2.160
   13    HA   GLU   4           HA       GLU   4  -6.490   3.939   2.787
   14   1HB   GLU   4          1HB       GLU   4  -6.405   4.750   0.497
   15   2HB   GLU   4          2HB       GLU   4  -4.748   4.174   0.317
   16   1HG   GLU   4          1HG       GLU   4  -5.661   2.263  -0.483
   17   2HG   GLU   4          2HG       GLU   4  -6.105   1.917   1.189
   18    H    GLN   5           H        GLN   5  -3.647   2.848   1.034
   19    HA   GLN   5           HA       GLN   5  -2.960   1.085   3.340
   20   1HB   GLN   5          1HB       GLN   5  -4.212  -0.310   1.831
   21   2HB   GLN   5          2HB       GLN   5  -3.316   0.301   0.440
   22   1HG   GLN   5          1HG       GLN   5  -1.267  -0.729   1.238
   23   2HG   GLN   5          2HG       GLN   5  -2.055  -1.220   2.738
   24   1HE2  GLN   5          1HE2      GLN   5  -1.415  -3.490   2.027
   25   2HE2  GLN   5          2HE2      GLN   5  -2.421  -4.303   0.929
   26    H    CYS   6           H        CYS   6  -1.581   1.018   0.122
   27    HA   CYS   6           HA       CYS   6   0.916   2.228   1.232
   28   1HB   CYS   6          1HB       CYS   6   0.594  -0.158  -0.601
   29   2HB   CYS   6          2HB       CYS   6   2.135   0.660  -0.347
   30    H    CYS   7           H        CYS   7  -0.953   3.819  -0.053
   31    HA   CYS   7           HA       CYS   7   0.273   4.228  -2.751
   32   1HB   CYS   7          1HB       CYS   7  -2.129   3.693  -2.872
   33   2HB   CYS   7          2HB       CYS   7  -2.487   5.020  -1.766
   34    H    THR   8           H        THR   8  -1.622   6.287  -0.517
   35    HA   THR   8           HA       THR   8  -0.051   8.624  -1.136
   36    HB   THR   8           HB       THR   8  -2.396   8.719  -0.288
   37    HG1  THR   8           HG1      THR   8  -0.324   9.986   1.151
   38   1HG2  THR   8          1HG2      THR   8  -1.992   8.548   2.490
   39   2HG2  THR   8          2HG2      THR   8  -1.213   7.118   1.815
   40   3HG2  THR   8          3HG2      THR   8  -2.917   7.434   1.483
   41    H    SER   9           H        SER   9   0.421   5.966   0.997
   42    HA   SER   9           HA       SER   9   2.619   7.472   2.361
   43   1HB   SER   9          1HB       SER   9   0.736   6.677   3.850
   44   2HB   SER   9          2HB       SER   9   1.172   5.027   3.416
   45    HG   SER   9           HG       SER   9   2.205   5.701   5.337
   46    H    ILE  10           H        ILE  10   4.115   5.438   3.360
   47    HA   ILE  10           HA       ILE  10   4.693   3.673   1.020
   48    HB   ILE  10           HB       ILE  10   6.986   4.665   2.649
   49   1HG1  ILE  10          1HG1      ILE  10   5.548   6.331   0.556
   50   2HG1  ILE  10          2HG1      ILE  10   5.757   6.743   2.258
   51   1HG2  ILE  10          1HG2      ILE  10   6.614   3.157   0.332
   52   2HG2  ILE  10          2HG2      ILE  10   8.140   3.841   0.891
   53   3HG2  ILE  10          3HG2      ILE  10   7.146   4.729  -0.264
   54   1HD1  ILE  10          1HD1      ILE  10   8.230   6.710   1.922
   55   2HD1  ILE  10          2HD1      ILE  10   7.429   7.934   0.937
   56   3HD1  ILE  10          3HD1      ILE  10   7.963   6.423   0.203
   57    H    CYS  11           H        CYS  11   4.247   1.665   1.802
   58    HA   CYS  11           HA       CYS  11   5.156   1.014   4.575
   59   1HB   CYS  11          1HB       CYS  11   3.484  -1.045   3.465
   60   2HB   CYS  11          2HB       CYS  11   3.197  -0.046   4.883
   61    H    SER  12           H        SER  12   5.153  -1.756   4.343
   62    HA   SER  12           HA       SER  12   7.120  -2.302   2.171
   63   1HB   SER  12          1HB       SER  12   8.489  -1.920   4.110
   64   2HB   SER  12          2HB       SER  12   7.434  -2.898   5.124
   65    HG   SER  12           HG       SER  12   9.081  -3.740   2.972
   66    H    LEU  13           H        LEU  13   7.644  -4.924   2.692
   67    HA   LEU  13           HA       LEU  13   5.187  -6.186   1.884
   68   1HB   LEU  13          1HB       LEU  13   6.543  -8.345   2.124
   69   2HB   LEU  13          2HB       LEU  13   7.114  -7.171   0.948
   70    HG   LEU  13           HG       LEU  13   8.788  -8.319   2.641
   71   1HD1  LEU  13          1HD1      LEU  13   8.762  -5.924   1.138
   72   2HD1  LEU  13          2HD1      LEU  13  10.168  -6.843   1.677
   73   3HD1  LEU  13          3HD1      LEU  13   9.528  -5.541   2.680
   74   1HD2  LEU  13          1HD2      LEU  13   7.876  -5.919   4.257
   75   2HD2  LEU  13          2HD2      LEU  13   9.147  -7.061   4.677
   76   3HD2  LEU  13          3HD2      LEU  13   7.469  -7.589   4.644
   77    H    TYR  14           H        TYR  14   5.776  -5.093   4.820
   78    HA   TYR  14           HA       TYR  14   4.886  -7.479   6.302
   79   1HB   TYR  14          1HB       TYR  14   6.256  -5.015   6.884
   80   2HB   TYR  14          2HB       TYR  14   4.890  -5.233   7.972
   81    HD1  TYR  14           HD1      TYR  14   6.873  -7.922   6.343
   82    HD2  TYR  14           HD2      TYR  14   6.025  -5.822   9.988
   83    HE1  TYR  14           HE1      TYR  14   8.166  -9.617   7.617
   84    HE2  TYR  14           HE2      TYR  14   7.313  -7.516  11.269
   85    HH   TYR  14           HH       TYR  14   7.928 -10.287  10.547
   86    H    GLN  15           H        GLN  15   3.908  -4.167   5.601
   87    HA   GLN  15           HA       GLN  15   1.283  -4.433   6.775
   88   1HB   GLN  15          1HB       GLN  15   2.651  -2.457   4.996
   89   2HB   GLN  15          2HB       GLN  15   0.886  -2.442   5.034
   90   1HG   GLN  15          1HG       GLN  15   1.706  -0.931   6.746
   91   2HG   GLN  15          2HG       GLN  15   0.993  -2.341   7.528
   92   1HE2  GLN  15          1HE2      GLN  15   4.237  -1.881   6.020
   93   2HE2  GLN  15          2HE2      GLN  15   5.105  -2.332   7.407
   94    H    LEU  16           H        LEU  16   2.765  -5.241   3.771
   95    HA   LEU  16           HA       LEU  16   0.287  -5.652   2.296
   96   1HB   LEU  16          1HB       LEU  16   3.111  -6.665   1.800
   97   2HB   LEU  16          2HB       LEU  16   1.772  -6.805   0.659
   98    HG   LEU  16           HG       LEU  16   2.739  -4.160   1.773
   99   1HD1  LEU  16          1HD1      LEU  16   3.729  -5.843  -0.460
  100   2HD1  LEU  16          2HD1      LEU  16   4.562  -4.590   0.461
  101   3HD1  LEU  16          3HD1      LEU  16   3.467  -4.142  -0.848
  102   1HD2  LEU  16          1HD2      LEU  16   0.800  -3.470   0.841
  103   2HD2  LEU  16          2HD2      LEU  16   0.517  -5.052   0.114
  104   3HD2  LEU  16          3HD2      LEU  16   1.510  -3.860  -0.726
  105    H    GLU  17           H        GLU  17   2.507  -7.586   4.283
  106    HA   GLU  17           HA       GLU  17   1.071 -10.069   3.666
  107   1HB   GLU  17          1HB       GLU  17   2.614 -11.155   5.088
  108   2HB   GLU  17          2HB       GLU  17   3.551  -9.851   4.362
  109   1HG   GLU  17          1HG       GLU  17   4.033  -9.102   6.419
  110   2HG   GLU  17          2HG       GLU  17   2.321  -8.772   6.675
  111    H    ASN  18           H        ASN  18   0.310  -7.399   5.511
  112    HA   ASN  18           HA       ASN  18  -0.922  -8.828   7.753
  113   1HB   ASN  18          1HB       ASN  18  -0.125  -6.209   7.347
  114   2HB   ASN  18          2HB       ASN  18  -1.881  -6.104   7.225
  115   1HD2  ASN  18          1HD2      ASN  18   0.784  -6.656   9.427
  116   2HD2  ASN  18          2HD2      ASN  18  -0.155  -6.825  10.831
  117    H    TYR  19           H        TYR  19  -1.713  -8.452   4.524
  118    HA   TYR  19           HA       TYR  19  -4.647  -8.454   5.074
  119   1HB   TYR  19          1HB       TYR  19  -3.055  -7.961   2.550
  120   2HB   TYR  19          2HB       TYR  19  -4.807  -8.137   2.561
  121    HD1  TYR  19           HD1      TYR  19  -2.127  -6.261   4.408
  122    HD2  TYR  19           HD2      TYR  19  -6.087  -6.202   2.741
  123    HE1  TYR  19           HE1      TYR  19  -2.353  -3.868   5.030
  124    HE2  TYR  19           HE2      TYR  19  -6.312  -3.808   3.361
  125    HH   TYR  19           HH       TYR  19  -4.731  -1.865   3.795
  126    H    CYS  20           H        CYS  20  -2.071 -10.561   4.308
  127    HA   CYS  20           HA       CYS  20  -3.965 -12.537   3.109
  128   1HB   CYS  20          1HB       CYS  20  -0.955 -12.782   3.220
  129   2HB   CYS  20          2HB       CYS  20  -2.077 -13.664   2.186
  130    H    ASN  21           H        ASN  21  -2.619 -14.870   3.706
  131    HA   ASN  21           HA       ASN  21  -2.070 -15.029   6.574
  132   1HB   ASN  21          1HB       ASN  21  -4.736 -15.093   5.890
  133   2HB   ASN  21          2HB       ASN  21  -4.317 -16.807   5.913
  134   1HD2  ASN  21          1HD2      ASN  21  -4.141 -17.793   7.954
  135   2HD2  ASN  21          2HD2      ASN  21  -4.128 -16.948   9.425
  136   1H    PHE   1          1H        PHE   1  15.484  -3.700  -0.032
  137   2H    PHE   1          2H        PHE   1  14.404  -4.988   0.216
  138   3H    PHE   1          3H        PHE   1  15.611  -4.654   1.365
  139    HA   PHE   1           HA       PHE   1  12.997  -3.587   1.159
  140   1HB   PHE   1          1HB       PHE   1  15.284  -3.623   3.100
  141   2HB   PHE   1          2HB       PHE   1  13.944  -2.514   3.385
  142    HD1  PHE   1           HD1      PHE   1  14.813  -6.098   2.858
  143    HD2  PHE   1           HD2      PHE   1  11.828  -3.291   4.160
  144    HE1  PHE   1           HE1      PHE   1  13.448  -7.965   3.758
  145    HE2  PHE   1           HE2      PHE   1  10.464  -5.160   5.059
  146    HZ   PHE   1           HZ       PHE   1  11.274  -7.495   4.859
  147    H    VAL   2           H        VAL   2  12.439  -1.685   0.218
  148    HA   VAL   2           HA       VAL   2  14.147   0.677   0.603
  149    HB   VAL   2           HB       VAL   2  14.763  -0.693  -1.587
  150   1HG1  VAL   2          1HG1      VAL   2  12.247  -0.477  -2.272
  151   2HG1  VAL   2          2HG1      VAL   2  13.497  -0.243  -3.495
  152   3HG1  VAL   2          3HG1      VAL   2  12.710   1.154  -2.760
  153   1HG2  VAL   2          1HG2      VAL   2  15.147   1.890  -0.677
  154   2HG2  VAL   2          2HG2      VAL   2  14.499   2.130  -2.299
  155   3HG2  VAL   2          3HG2      VAL   2  15.956   1.164  -2.065
  156    H    ASN   3           H        ASN   3  12.892   2.295  -1.286
  157    HA   ASN   3           HA       ASN   3  10.247   2.609   0.000
  158   1HB   ASN   3          1HB       ASN   3  11.750   4.395  -1.939
  159   2HB   ASN   3          2HB       ASN   3  10.228   4.809  -1.152
  160   1HD2  ASN   3          1HD2      ASN   3  10.584   4.025   1.464
  161   2HD2  ASN   3          2HD2      ASN   3  11.916   4.817   2.159
  162    H    GLN   4           H        GLN   4   8.341   2.181  -1.038
  163    HA   GLN   4           HA       GLN   4   8.453   1.673  -3.981
  164   1HB   GLN   4          1HB       GLN   4   8.098  -0.299  -2.058
  165   2HB   GLN   4          2HB       GLN   4   6.449   0.077  -2.565
  166   1HG   GLN   4          1HG       GLN   4   7.169  -0.172  -4.944
  167   2HG   GLN   4          2HG       GLN   4   8.760  -0.678  -4.376
  168   1HE2  GLN   4          1HE2      GLN   4   6.872  -2.347  -5.909
  169   2HE2  GLN   4          2HE2      GLN   4   6.491  -3.676  -4.922
  170    H    HIS   5           H        HIS   5   6.191   1.762  -4.956
  171    HA   HIS   5           HA       HIS   5   4.291   3.432  -3.409
  172   1HB   HIS   5          1HB       HIS   5   5.331   4.243  -6.141
  173   2HB   HIS   5          2HB       HIS   5   4.141   5.114  -5.174
  174    HD2  HIS   5           HD2      HIS   5   5.200   6.589  -3.011
  175    HE1  HIS   5           HE1      HIS   5   9.253   5.781  -3.902
  176    HE2  HIS   5           HE2      HIS   5   7.676   7.178  -2.466
  177    H    LEU   6           H        LEU   6   2.598   1.981  -3.535
  178    HA   LEU   6           HA       LEU   6   1.777   1.135  -6.288
  179   1HB   LEU   6          1HB       LEU   6   1.106  -0.469  -3.831
  180   2HB   LEU   6          2HB       LEU   6   1.196  -1.002  -5.510
  181    HG   LEU   6           HG       LEU   6   3.729  -0.295  -5.280
  182   1HD1  LEU   6          1HD1      LEU   6   3.950   0.611  -3.164
  183   2HD1  LEU   6          2HD1      LEU   6   4.306  -1.077  -2.797
  184   3HD1  LEU   6          3HD1      LEU   6   2.701  -0.424  -2.474
  185   1HD2  LEU   6          1HD2      LEU   6   3.266  -2.554  -5.764
  186   2HD2  LEU   6          2HD2      LEU   6   2.369  -2.787  -4.263
  187   3HD2  LEU   6          3HD2      LEU   6   4.126  -2.650  -4.228
  188    H    CYS   7           H        CYS   7  -0.335   1.604  -6.816
  189    HA   CYS   7           HA       CYS   7  -2.138   2.469  -4.594
  190   1HB   CYS   7          1HB       CYS   7  -1.782   3.819  -7.286
  191   2HB   CYS   7          2HB       CYS   7  -2.999   4.257  -6.088
  192    H    GLY   8           H        GLY   8  -1.772   0.051  -6.601
  193   1HA   GLY   8          1HA       GLY   8  -4.460  -0.770  -6.669
  194   2HA   GLY   8          2HA       GLY   8  -4.166   0.047  -8.202
  195    H    SER   9           H        SER   9  -3.572  -1.307  -9.799
  196    HA   SER   9           HA       SER   9  -3.131  -4.023  -9.661
  197   1HB   SER   9          1HB       SER   9  -1.924  -1.974 -11.526
  198   2HB   SER   9          2HB       SER   9  -1.646  -3.701 -11.735
  199    HG   SER   9           HG       SER   9  -4.064  -3.801 -11.564
  200    H    ASP  10           H        ASP  10  -0.766  -1.476  -9.018
  201    HA   ASP  10           HA       ASP  10   1.464  -3.327  -8.777
  202   1HB   ASP  10          1HB       ASP  10   1.015  -0.427  -8.455
  203   2HB   ASP  10          2HB       ASP  10   2.252  -1.103  -7.395
  204    H    LEU  11           H        LEU  11  -0.943  -1.984  -6.634
  205    HA   LEU  11           HA       LEU  11   0.317  -2.659  -4.153
  206   1HB   LEU  11          1HB       LEU  11  -2.391  -1.898  -5.050
  207   2HB   LEU  11          2HB       LEU  11  -2.351  -2.894  -3.596
  208    HG   LEU  11           HG       LEU  11  -0.749  -0.348  -3.995
  209   1HD1  LEU  11          1HD1      LEU  11  -2.469   0.095  -1.911
  210   2HD1  LEU  11          2HD1      LEU  11  -3.469  -0.889  -2.981
  211   3HD1  LEU  11          3HD1      LEU  11  -2.764   0.618  -3.569
  212   1HD2  LEU  11          1HD2      LEU  11  -1.066  -1.116  -1.268
  213   2HD2  LEU  11          2HD2      LEU  11   0.424  -1.058  -2.210
  214   3HD2  LEU  11          3HD2      LEU  11  -0.527  -2.541  -2.156
  215    H    VAL  12           H        VAL  12  -2.375  -4.346  -5.749
  216    HA   VAL  12           HA       VAL  12  -2.193  -6.725  -4.227
  217    HB   VAL  12           HB       VAL  12  -4.108  -6.294  -5.695
  218   1HG1  VAL  12          1HG1      VAL  12  -3.683  -6.695  -8.212
  219   2HG1  VAL  12          2HG1      VAL  12  -1.983  -6.416  -7.837
  220   3HG1  VAL  12          3HG1      VAL  12  -3.169  -5.145  -7.543
  221   1HG2  VAL  12          1HG2      VAL  12  -4.445  -8.501  -6.298
  222   2HG2  VAL  12          2HG2      VAL  12  -3.040  -8.704  -5.252
  223   3HG2  VAL  12          3HG2      VAL  12  -2.836  -8.663  -7.003
  224    H    GLU  13           H        GLU  13  -0.302  -5.576  -6.909
  225    HA   GLU  13           HA       GLU  13   0.937  -8.037  -7.663
  226   1HB   GLU  13          1HB       GLU  13   1.142  -5.427  -8.507
  227   2HB   GLU  13          2HB       GLU  13   2.681  -5.650  -7.677
  228   1HG   GLU  13          1HG       GLU  13   3.164  -6.381  -9.856
  229   2HG   GLU  13          2HG       GLU  13   2.804  -7.888  -9.013
  230    H    ALA  14           H        ALA  14   1.387  -5.826  -4.992
  231    HA   ALA  14           HA       ALA  14   3.840  -7.178  -4.075
  232   1HB   ALA  14          1HB       ALA  14   2.927  -4.629  -3.745
  233   2HB   ALA  14          2HB       ALA  14   4.097  -5.393  -2.667
  234   3HB   ALA  14          3HB       ALA  14   2.387  -5.365  -2.236
  235    H    LEU  15           H        LEU  15   0.438  -7.497  -3.753
  236    HA   LEU  15           HA       LEU  15   0.630  -8.961  -1.186
  237   1HB   LEU  15          1HB       LEU  15  -1.602  -7.995  -2.944
  238   2HB   LEU  15          2HB       LEU  15  -1.915  -9.331  -1.837
  239    HG   LEU  15           HG       LEU  15  -0.519  -6.887  -0.802
  240   1HD1  LEU  15          1HD1      LEU  15  -2.397  -5.885  -1.912
  241   2HD1  LEU  15          2HD1      LEU  15  -2.835  -6.013  -0.209
  242   3HD1  LEU  15          3HD1      LEU  15  -3.479  -7.168  -1.375
  243   1HD2  LEU  15          1HD2      LEU  15  -2.469  -8.913   0.343
  244   2HD2  LEU  15          2HD2      LEU  15  -1.793  -7.556   1.245
  245   3HD2  LEU  15          3HD2      LEU  15  -0.735  -8.837   0.654
  246    H    TYR  16           H        TYR  16   0.653  -9.503  -4.568
  247    HA   TYR  16           HA       TYR  16  -0.091 -12.351  -4.349
  248   1HB   TYR  16          1HB       TYR  16  -0.914 -11.569  -6.361
  249   2HB   TYR  16          2HB       TYR  16   0.368 -10.377  -6.542
  250    HD1  TYR  16           HD1      TYR  16   0.004 -14.122  -6.384
  251    HD2  TYR  16           HD2      TYR  16   1.912 -10.744  -8.234
  252    HE1  TYR  16           HE1      TYR  16   1.205 -15.646  -7.931
  253    HE2  TYR  16           HE2      TYR  16   3.112 -12.268  -9.780
  254    HH   TYR  16           HH       TYR  16   3.835 -14.886  -9.582
  255    H    LEU  17           H        LEU  17   2.723 -10.333  -4.386
  256    HA   LEU  17           HA       LEU  17   4.501 -12.641  -4.946
  257   1HB   LEU  17          1HB       LEU  17   5.070 -10.590  -6.113
  258   2HB   LEU  17          2HB       LEU  17   5.044  -9.681  -4.602
  259    HG   LEU  17           HG       LEU  17   6.813 -11.738  -4.054
  260   1HD1  LEU  17          1HD1      LEU  17   7.384 -12.577  -6.098
  261   2HD1  LEU  17          2HD1      LEU  17   8.350 -11.107  -6.230
  262   3HD1  LEU  17          3HD1      LEU  17   6.745 -11.176  -6.957
  263   1HD2  LEU  17          1HD2      LEU  17   8.531  -9.926  -4.297
  264   2HD2  LEU  17          2HD2      LEU  17   7.100  -9.405  -3.406
  265   3HD2  LEU  17          3HD2      LEU  17   7.312  -8.930  -5.091
  266    H    VAL  18           H        VAL  18   3.547 -10.438  -2.404
  267    HA   VAL  18           HA       VAL  18   5.546 -11.331  -0.499
  268    HB   VAL  18           HB       VAL  18   2.984  -9.749  -0.267
  269   1HG1  VAL  18          1HG1      VAL  18   4.370 -11.231   1.812
  270   2HG1  VAL  18          2HG1      VAL  18   2.864 -10.318   1.910
  271   3HG1  VAL  18          3HG1      VAL  18   4.409  -9.499   2.139
  272   1HG2  VAL  18          1HG2      VAL  18   4.400  -7.898   0.041
  273   2HG2  VAL  18          2HG2      VAL  18   5.259  -8.846  -1.173
  274   3HG2  VAL  18          3HG2      VAL  18   5.768  -8.905   0.515
  275    H    CYS  19           H        CYS  19   2.077 -11.912  -0.896
  276    HA   CYS  19           HA       CYS  19   2.147 -14.080   1.087
  277   1HB   CYS  19          1HB       CYS  19  -0.220 -13.611  -0.695
  278   2HB   CYS  19          2HB       CYS  19  -0.174 -14.012   1.023
  279    H    GLY  20           H        GLY  20   1.488 -13.757  -2.400
  280   1HA   GLY  20          1HA       GLY  20   1.279 -15.485  -4.027
  281   2HA   GLY  20          2HA       GLY  20   2.956 -15.695  -3.535
  282    H    GLU  21           H        GLU  21  -0.224 -17.037  -3.431
  283    HA   GLU  21           HA       GLU  21  -0.993 -19.129  -2.726
  284   1HB   GLU  21          1HB       GLU  21   1.271 -19.615  -4.053
  285   2HB   GLU  21          2HB       GLU  21   1.799 -20.147  -2.456
  286   1HG   GLU  21          1HG       GLU  21  -0.274 -21.567  -2.322
  287   2HG   GLU  21          2HG       GLU  21  -0.613 -21.136  -3.998
  288    H    ARG  22           H        ARG  22  -1.813 -19.054  -0.731
  289    HA   ARG  22           HA       ARG  22  -0.816 -20.187   1.542
  290   1HB   ARG  22          1HB       ARG  22   0.532 -17.631   1.052
  291   2HB   ARG  22          2HB       ARG  22  -0.239 -17.697   2.637
  292   1HG   ARG  22          1HG       ARG  22   0.913 -20.188   2.461
  293   2HG   ARG  22          2HG       ARG  22   2.096 -19.178   1.629
  294   1HD   ARG  22          1HD       ARG  22   0.971 -18.152   4.197
  295   2HD   ARG  22          2HD       ARG  22   2.134 -19.475   4.285
  296    HE   ARG  22           HE       ARG  22   2.750 -16.730   3.605
  297   1HH1  ARG  22          1HH1      ARG  22   4.075 -19.688   4.294
  298   2HH1  ARG  22          2HH1      ARG  22   5.459 -19.529   3.264
  299   1HH2  ARG  22          1HH2      ARG  22   4.311 -16.647   1.719
  300   2HH2  ARG  22          2HH2      ARG  22   5.594 -17.808   1.808
  301    H    GLY  23           H        GLY  23  -2.562 -17.566   0.124
  302   1HA   GLY  23          1HA       GLY  23  -5.060 -18.007   1.100
  303   2HA   GLY  23          2HA       GLY  23  -4.309 -17.136   2.441
  304    H    PHE  24           H        PHE  24  -3.345 -15.013   1.932
  305    HA   PHE  24           HA       PHE  24  -3.774 -12.827   1.161
  306   1HB   PHE  24          1HB       PHE  24  -2.132 -13.337  -0.437
  307   2HB   PHE  24          2HB       PHE  24  -3.139 -14.543  -1.230
  308    HD1  PHE  24           HD1      PHE  24  -3.388 -10.883  -0.381
  309    HD2  PHE  24           HD2      PHE  24  -3.902 -13.960  -3.334
  310    HE1  PHE  24           HE1      PHE  24  -4.119  -9.179  -2.026
  311    HE2  PHE  24           HE2      PHE  24  -4.637 -12.259  -4.980
  312    HZ   PHE  24           HZ       PHE  24  -4.748  -9.868  -4.329
  313    H    PHE  25           H        PHE  25  -5.956 -12.528   1.774
  314    HA   PHE  25           HA       PHE  25  -8.019 -13.218  -0.264
  315   1HB   PHE  25          1HB       PHE  25  -8.586 -14.033   1.929
  316   2HB   PHE  25          2HB       PHE  25  -8.199 -12.480   2.670
  317    HD1  PHE  25           HD1      PHE  25 -10.327 -13.783  -0.139
  318    HD2  PHE  25           HD2      PHE  25 -10.005 -11.123   3.220
  319    HE1  PHE  25           HE1      PHE  25 -12.659 -13.027  -0.516
  320    HE2  PHE  25           HE2      PHE  25 -12.338 -10.366   2.844
  321    HZ   PHE  25           HZ       PHE  25 -13.665 -11.318   0.976
  322    H    TYR  26           H        TYR  26  -7.483 -11.442  -1.689
  323    HA   TYR  26           HA       TYR  26  -8.313  -8.783  -0.596
  324   1HB   TYR  26          1HB       TYR  26  -5.816  -9.118  -1.205
  325   2HB   TYR  26          2HB       TYR  26  -6.369  -9.103  -2.879
  326    HD1  TYR  26           HD1      TYR  26  -6.923  -7.152   0.289
  327    HD2  TYR  26           HD2      TYR  26  -6.369  -7.051  -3.972
  328    HE1  TYR  26           HE1      TYR  26  -6.991  -4.672   0.338
  329    HE2  TYR  26           HE2      TYR  26  -6.440  -4.570  -3.923
  330    HH   TYR  26           HH       TYR  26  -7.212  -2.809  -0.963
  331    H    THR  27           H        THR  27  -9.411  -7.398  -2.128
  332    HA   THR  27           HA       THR  27 -10.789  -8.953  -4.268
  333    HB   THR  27           HB       THR  27 -11.803  -6.287  -3.417
  334    HG1  THR  27           HG1      THR  27 -11.917  -8.623  -1.816
  335   1HG2  THR  27          1HG2      THR  27 -13.558  -8.638  -3.432
  336   2HG2  THR  27          2HG2      THR  27 -12.722  -8.377  -4.962
  337   3HG2  THR  27          3HG2      THR  27 -13.730  -7.101  -4.277
  338    H    LYS  28           H        LYS  28 -11.766  -6.309  -5.348
  339    HA   LYS  28           HA       LYS  28  -9.291  -5.113  -6.435
  340   1HB   LYS  28          1HB       LYS  28 -11.430  -6.321  -8.215
  341   2HB   LYS  28          2HB       LYS  28  -9.997  -5.447  -8.759
  342   1HG   LYS  28          1HG       LYS  28  -8.618  -7.187  -7.504
  343   2HG   LYS  28          2HG       LYS  28 -10.109  -8.118  -7.344
  344   1HD   LYS  28          1HD       LYS  28  -9.964  -7.321 -10.053
  345   2HD   LYS  28          2HD       LYS  28  -8.355  -7.903  -9.622
  346   1HE   LYS  28          1HE       LYS  28 -10.638  -9.531  -8.645
  347   2HE   LYS  28          2HE       LYS  28 -10.350  -9.559 -10.385
  348   1HZ   LYS  28          1HZ       LYS  28  -8.935 -10.893  -8.380
  349   2HZ   LYS  28          2HZ       LYS  28  -7.886  -9.751  -9.072
  350   3HZ   LYS  28          3HZ       LYS  28  -8.649 -10.910 -10.052
  351    HA   PRO  29           HA       PRO  29 -11.860  -1.554  -6.312
  352   1HB   PRO  29          1HB       PRO  29 -10.418   0.051  -8.013
  353   2HB   PRO  29          2HB       PRO  29  -9.911  -0.325  -6.356
  354   1HG   PRO  29          1HG       PRO  29  -8.827  -1.366  -8.931
  355   2HG   PRO  29          2HG       PRO  29  -8.027  -1.205  -7.360
  356   1HD   PRO  29          1HD       PRO  29  -9.064  -3.603  -8.463
  357   2HD   PRO  29          2HD       PRO  29  -8.538  -3.365  -6.783
  358    H    THR  30           H        THR  30 -12.412   0.263  -8.301
  359    HA   THR  30           HA       THR  30 -14.308  -1.160  -9.955
  360    HB   THR  30           HB       THR  30 -14.586   1.210  -9.130
  361    HG1  THR  30           HG1      THR  30 -15.854   1.526 -10.777
  362   1HG2  THR  30          1HG2      THR  30 -12.207   1.852  -9.684
  363   2HG2  THR  30          2HG2      THR  30 -13.424   2.998 -10.245
  364   3HG2  THR  30          3HG2      THR  30 -12.677   1.876 -11.383
  Start of MODEL   14
    1   1H    GLY   1          1H        GLY   1 -13.833   4.913  -1.111
    2   2H    GLY   1          2H        GLY   1 -12.636   5.674  -2.047
    3   3H    GLY   1          3H        GLY   1 -13.044   6.294  -0.519
    4   1HA   GLY   1          1HA       GLY   1 -10.965   4.852  -0.658
    5   2HA   GLY   1          2HA       GLY   1 -12.072   4.536   0.712
    6    H    GLY   2           H        GLY   2 -11.028   4.266  -2.814
    7   1HA   GLY   2          1HA       GLY   2 -10.574   1.330  -2.439
    8   2HA   GLY   2          2HA       GLY   2 -11.248   1.986  -3.932
    9    H    GLY   3           H        GLY   3  -8.335   1.616  -2.030
   10   1HA   GLY   3          1HA       GLY   3  -6.146   1.418  -3.024
   11   2HA   GLY   3          2HA       GLY   3  -6.748   2.268  -4.450
   12    H    GLU   4           H        GLU   4  -6.434   2.940  -0.937
   13    HA   GLU   4           HA       GLU   4  -4.974   5.423  -1.619
   14   1HB   GLU   4          1HB       GLU   4  -7.490   5.893  -1.498
   15   2HB   GLU   4          2HB       GLU   4  -7.368   5.530   0.223
   16   1HG   GLU   4          1HG       GLU   4  -5.341   7.233   0.106
   17   2HG   GLU   4          2HG       GLU   4  -6.205   7.820  -1.315
   18    H    GLN   5           H        GLN   5  -4.638   2.746  -0.088
   19    HA   GLN   5           HA       GLN   5  -4.093   3.767   2.635
   20   1HB   GLN   5          1HB       GLN   5  -3.609   1.457   3.209
   21   2HB   GLN   5          2HB       GLN   5  -5.111   1.499   2.284
   22   1HG   GLN   5          1HG       GLN   5  -4.222   0.249   0.632
   23   2HG   GLN   5          2HG       GLN   5  -2.804   1.293   0.530
   24   1HE2  GLN   5          1HE2      GLN   5  -3.821  -0.500   3.448
   25   2HE2  GLN   5          2HE2      GLN   5  -2.458  -1.510   3.499
   26    H    CYS   6           H        CYS   6  -2.443   3.148  -0.330
   27    HA   CYS   6           HA       CYS   6   0.025   4.241   0.768
   28   1HB   CYS   6          1HB       CYS   6  -0.269   1.307   0.274
   29   2HB   CYS   6          2HB       CYS   6   1.258   2.071  -0.171
   30    H    CYS   7           H        CYS   7  -1.819   4.900  -1.374
   31    HA   CYS   7           HA       CYS   7  -0.300   4.269  -3.844
   32   1HB   CYS   7          1HB       CYS   7  -2.809   4.177  -3.840
   33   2HB   CYS   7          2HB       CYS   7  -2.833   5.910  -3.513
   34    H    THR   8           H        THR   8  -0.887   6.868  -1.580
   35    HA   THR   8           HA       THR   8   0.802   8.669  -3.274
   36    HB   THR   8           HB       THR   8  -0.230  10.540  -2.000
   37    HG1  THR   8           HG1      THR   8  -1.596  10.152  -0.422
   38   1HG2  THR   8          1HG2      THR   8  -2.495  10.342  -2.996
   39   2HG2  THR   8          2HG2      THR   8  -2.188   8.632  -3.305
   40   3HG2  THR   8          3HG2      THR   8  -1.229   9.862  -4.126
   41    H    SER   9           H        SER   9   0.948   6.648  -0.669
   42    HA   SER   9           HA       SER   9   3.070   8.307   0.630
   43   1HB   SER   9          1HB       SER   9   1.122   8.075   2.112
   44   2HB   SER   9          2HB       SER   9   1.162   6.325   1.914
   45    HG   SER   9           HG       SER   9   2.490   7.813   3.652
   46    H    ILE  10           H        ILE  10   3.180   5.476   2.225
   47    HA   ILE  10           HA       ILE  10   4.587   3.936   0.129
   48    HB   ILE  10           HB       ILE  10   6.468   3.635   1.947
   49   1HG1  ILE  10          1HG1      ILE  10   6.439   6.403   2.619
   50   2HG1  ILE  10          2HG1      ILE  10   4.866   5.745   3.067
   51   1HG2  ILE  10          1HG2      ILE  10   6.628   4.585  -0.373
   52   2HG2  ILE  10          2HG2      ILE  10   7.765   5.277   0.786
   53   3HG2  ILE  10          3HG2      ILE  10   6.318   6.174   0.325
   54   1HD1  ILE  10          1HD1      ILE  10   5.864   4.950   4.922
   55   2HD1  ILE  10          2HD1      ILE  10   7.475   5.272   4.281
   56   3HD1  ILE  10          3HD1      ILE  10   6.646   3.770   3.872
   57    H    CYS  11           H        CYS  11   5.106   1.748   0.838
   58    HA   CYS  11           HA       CYS  11   3.804   0.911   3.347
   59   1HB   CYS  11          1HB       CYS  11   2.782   0.375   0.659
   60   2HB   CYS  11          2HB       CYS  11   3.071  -1.109   1.566
   61    H    SER  12           H        SER  12   4.190  -1.741   3.372
   62    HA   SER  12           HA       SER  12   6.892  -2.296   2.279
   63   1HB   SER  12          1HB       SER  12   7.465  -1.547   4.474
   64   2HB   SER  12          2HB       SER  12   6.131  -2.436   5.199
   65    HG   SER  12           HG       SER  12   7.375  -4.116   5.272
   66    H    LEU  13           H        LEU  13   7.448  -4.649   2.827
   67    HA   LEU  13           HA       LEU  13   5.494  -6.342   1.669
   68   1HB   LEU  13          1HB       LEU  13   8.141  -6.645   2.826
   69   2HB   LEU  13          2HB       LEU  13   7.107  -8.020   3.215
   70    HG   LEU  13           HG       LEU  13   6.630  -8.416   0.891
   71   1HD1  LEU  13          1HD1      LEU  13   6.394  -6.361  -0.165
   72   2HD1  LEU  13          2HD1      LEU  13   7.985  -6.840  -0.756
   73   3HD1  LEU  13          3HD1      LEU  13   7.848  -5.695   0.580
   74   1HD2  LEU  13          1HD2      LEU  13   8.895  -8.857   0.013
   75   2HD2  LEU  13          2HD2      LEU  13   8.798  -9.280   1.722
   76   3HD2  LEU  13          3HD2      LEU  13   9.578  -7.778   1.229
   77    H    TYR  14           H        TYR  14   6.129  -5.493   4.963
   78    HA   TYR  14           HA       TYR  14   4.506  -7.515   6.179
   79   1HB   TYR  14          1HB       TYR  14   5.825  -5.017   6.970
   80   2HB   TYR  14          2HB       TYR  14   4.376  -5.402   7.899
   81    HD1  TYR  14           HD1      TYR  14   6.878  -7.657   6.266
   82    HD2  TYR  14           HD2      TYR  14   5.128  -6.283   9.939
   83    HE1  TYR  14           HE1      TYR  14   8.146  -9.389   7.520
   84    HE2  TYR  14           HE2      TYR  14   6.396  -8.011  11.197
   85    HH   TYR  14           HH       TYR  14   8.916  -9.877   9.707
   86    H    GLN  15           H        GLN  15   3.858  -4.106   5.464
   87    HA   GLN  15           HA       GLN  15   1.144  -4.063   6.211
   88   1HB   GLN  15          1HB       GLN  15   2.233  -2.626   3.776
   89   2HB   GLN  15          2HB       GLN  15   0.898  -2.126   4.813
   90   1HG   GLN  15          1HG       GLN  15   2.759  -2.225   6.700
   91   2HG   GLN  15          2HG       GLN  15   3.844  -1.996   5.329
   92   1HE2  GLN  15          1HE2      GLN  15   4.340   0.216   6.111
   93   2HE2  GLN  15          2HE2      GLN  15   3.219   1.470   5.895
   94    H    LEU  16           H        LEU  16   2.695  -5.208   3.287
   95    HA   LEU  16           HA       LEU  16   0.178  -5.826   1.944
   96   1HB   LEU  16          1HB       LEU  16   2.895  -6.989   1.290
   97   2HB   LEU  16          2HB       LEU  16   1.531  -6.735   0.201
   98    HG   LEU  16           HG       LEU  16   2.733  -4.379   1.619
   99   1HD1  LEU  16          1HD1      LEU  16   4.735  -4.774   0.646
  100   2HD1  LEU  16          2HD1      LEU  16   3.935  -4.425  -0.887
  101   3HD1  LEU  16          3HD1      LEU  16   4.084  -6.092  -0.329
  102   1HD2  LEU  16          1HD2      LEU  16   1.293  -4.880  -0.998
  103   2HD2  LEU  16          2HD2      LEU  16   2.046  -3.336  -0.603
  104   3HD2  LEU  16          3HD2      LEU  16   0.719  -3.948   0.386
  105    H    GLU  17           H        GLU  17   2.402  -7.426   4.125
  106    HA   GLU  17           HA       GLU  17   1.279 -10.088   3.650
  107   1HB   GLU  17          1HB       GLU  17   3.630  -9.721   4.463
  108   2HB   GLU  17          2HB       GLU  17   2.963  -9.125   5.984
  109   1HG   GLU  17          1HG       GLU  17   1.816 -11.692   5.152
  110   2HG   GLU  17          2HG       GLU  17   3.556 -11.769   5.430
  111    H    ASN  18           H        ASN  18   0.414  -7.312   5.437
  112    HA   ASN  18           HA       ASN  18  -1.080  -8.743   7.507
  113   1HB   ASN  18          1HB       ASN  18  -0.653  -5.885   6.741
  114   2HB   ASN  18          2HB       ASN  18  -2.085  -6.281   7.692
  115   1HD2  ASN  18          1HD2      ASN  18   0.192  -4.748   8.716
  116   2HD2  ASN  18          2HD2      ASN  18   0.878  -5.657   9.974
  117    H    TYR  19           H        TYR  19  -1.564  -8.330   4.260
  118    HA   TYR  19           HA       TYR  19  -4.500  -7.976   4.483
  119   1HB   TYR  19          1HB       TYR  19  -2.500  -7.774   2.273
  120   2HB   TYR  19          2HB       TYR  19  -4.156  -8.209   1.853
  121    HD1  TYR  19           HD1      TYR  19  -2.160  -5.702   3.778
  122    HD2  TYR  19           HD2      TYR  19  -5.822  -6.557   1.697
  123    HE1  TYR  19           HE1      TYR  19  -2.838  -3.327   3.999
  124    HE2  TYR  19           HE2      TYR  19  -6.501  -4.180   1.919
  125    HH   TYR  19           HH       TYR  19  -5.540  -2.020   2.286
  126    H    CYS  20           H        CYS  20  -2.122 -10.447   4.053
  127    HA   CYS  20           HA       CYS  20  -3.810 -12.314   2.643
  128   1HB   CYS  20          1HB       CYS  20  -1.532 -13.019   4.496
  129   2HB   CYS  20          2HB       CYS  20  -2.172 -13.986   3.172
  130    H    ASN  21           H        ASN  21  -3.757 -14.617   4.074
  131    HA   ASN  21           HA       ASN  21  -6.077 -14.430   5.703
  132   1HB   ASN  21          1HB       ASN  21  -3.919 -16.526   5.450
  133   2HB   ASN  21          2HB       ASN  21  -5.259 -16.722   6.581
  134   1HD2  ASN  21          1HD2      ASN  21  -4.552 -18.076   3.864
  135   2HD2  ASN  21          2HD2      ASN  21  -6.002 -17.974   2.987
  136   1H    PHE   1          1H        PHE   1  13.780  -2.249   4.548
  137   2H    PHE   1          2H        PHE   1  15.044  -2.428   3.426
  138   3H    PHE   1          3H        PHE   1  13.986  -3.722   3.732
  139    HA   PHE   1           HA       PHE   1  13.555  -2.531   1.604
  140   1HB   PHE   1          1HB       PHE   1  11.773  -3.472   3.597
  141   2HB   PHE   1          2HB       PHE   1  11.065  -1.991   2.950
  142    HD1  PHE   1           HD1      PHE   1  12.848  -5.066   1.726
  143    HD2  PHE   1           HD2      PHE   1   9.756  -2.162   1.035
  144    HE1  PHE   1           HE1      PHE   1  12.157  -6.289  -0.319
  145    HE2  PHE   1           HE2      PHE   1   9.066  -3.384  -1.011
  146    HZ   PHE   1           HZ       PHE   1  10.265  -5.448  -1.688
  147    H    VAL   2           H        VAL   2  13.210  -0.560   0.613
  148    HA   VAL   2           HA       VAL   2  13.340   1.827   2.379
  149    HB   VAL   2           HB       VAL   2  14.868   1.297   0.266
  150   1HG1  VAL   2          1HG1      VAL   2  12.576   1.330  -1.093
  151   2HG1  VAL   2          2HG1      VAL   2  14.073   1.940  -1.798
  152   3HG1  VAL   2          3HG1      VAL   2  12.901   3.064  -1.112
  153   1HG2  VAL   2          1HG2      VAL   2  13.899   3.750   1.548
  154   2HG2  VAL   2          2HG2      VAL   2  14.549   4.014  -0.071
  155   3HG2  VAL   2          3HG2      VAL   2  15.549   3.257   1.168
  156    H    ASN   3           H        ASN   3  12.263   3.645   0.536
  157    HA   ASN   3           HA       ASN   3   9.439   3.365   1.124
  158   1HB   ASN   3          1HB       ASN   3  11.004   5.340  -0.559
  159   2HB   ASN   3          2HB       ASN   3   9.259   5.453  -0.319
  160   1HD2  ASN   3          1HD2      ASN   3  12.373   5.999   1.185
  161   2HD2  ASN   3          2HD2      ASN   3  11.776   6.605   2.656
  162    H    GLN   4           H        GLN   4   7.834   2.559  -0.178
  163    HA   GLN   4           HA       GLN   4   8.494   2.002  -3.037
  164   1HB   GLN   4          1HB       GLN   4   7.382   0.105  -0.971
  165   2HB   GLN   4          2HB       GLN   4   7.068  -0.133  -2.690
  166   1HG   GLN   4          1HG       GLN   4   9.798   0.047  -1.382
  167   2HG   GLN   4          2HG       GLN   4   9.049  -1.410  -2.034
  168   1HE2  GLN   4          1HE2      GLN   4   9.090  -1.721  -4.331
  169   2HE2  GLN   4          2HE2      GLN   4   9.894  -0.664  -5.388
  170    H    HIS   5           H        HIS   5   6.947   2.845  -4.345
  171    HA   HIS   5           HA       HIS   5   4.392   3.721  -3.114
  172   1HB   HIS   5          1HB       HIS   5   4.873   4.295  -5.976
  173   2HB   HIS   5          2HB       HIS   5   4.328   5.370  -4.690
  174    HD2  HIS   5           HD2      HIS   5   6.594   6.133  -2.889
  175    HE1  HIS   5           HE1      HIS   5   9.390   5.689  -6.029
  176    HE2  HIS   5           HE2      HIS   5   9.017   6.639  -3.690
  177    H    LEU   6           H        LEU   6   2.553   2.563  -3.432
  178    HA   LEU   6           HA       LEU   6   2.205   1.029  -5.925
  179   1HB   LEU   6          1HB       LEU   6   1.348  -0.772  -3.930
  180   2HB   LEU   6          2HB       LEU   6   2.701  -0.980  -5.040
  181    HG   LEU   6           HG       LEU   6   4.075   0.398  -3.381
  182   1HD1  LEU   6          1HD1      LEU   6   1.553   0.688  -2.187
  183   2HD1  LEU   6          2HD1      LEU   6   3.104   1.165  -1.495
  184   3HD1  LEU   6          3HD1      LEU   6   2.428  -0.423  -1.134
  185   1HD2  LEU   6          1HD2      LEU   6   4.349  -2.025  -3.601
  186   2HD2  LEU   6          2HD2      LEU   6   2.949  -2.301  -2.564
  187   3HD2  LEU   6          3HD2      LEU   6   4.416  -1.583  -1.895
  188    H    CYS   7           H        CYS   7   0.062   0.769  -6.442
  189    HA   CYS   7           HA       CYS   7  -1.920   1.842  -4.485
  190   1HB   CYS   7          1HB       CYS   7  -2.090   2.070  -7.503
  191   2HB   CYS   7          2HB       CYS   7  -3.128   2.857  -6.312
  192    H    GLY   8           H        GLY   8  -4.173   1.153  -6.149
  193   1HA   GLY   8          1HA       GLY   8  -4.768  -1.430  -5.288
  194   2HA   GLY   8          2HA       GLY   8  -5.518  -0.695  -6.704
  195    H    SER   9           H        SER   9  -3.357  -0.525  -8.449
  196    HA   SER   9           HA       SER   9  -3.190  -3.273  -9.341
  197   1HB   SER   9          1HB       SER   9  -3.139  -0.971 -10.672
  198   2HB   SER   9          2HB       SER   9  -1.400  -1.178 -10.489
  199    HG   SER   9           HG       SER   9  -1.750  -2.361 -12.233
  200    H    ASP  10           H        ASP  10  -0.658  -0.982  -8.185
  201    HA   ASP  10           HA       ASP  10   1.347  -3.093  -8.255
  202   1HB   ASP  10          1HB       ASP  10   1.319  -0.258  -7.248
  203   2HB   ASP  10          2HB       ASP  10   2.675  -1.325  -6.891
  204    H    LEU  11           H        LEU  11  -1.022  -2.109  -5.956
  205    HA   LEU  11           HA       LEU  11   0.426  -3.078  -3.627
  206   1HB   LEU  11          1HB       LEU  11  -2.462  -2.344  -4.110
  207   2HB   LEU  11          2HB       LEU  11  -1.922  -3.031  -2.580
  208    HG   LEU  11           HG       LEU  11  -0.573  -0.623  -3.803
  209   1HD1  LEU  11          1HD1      LEU  11  -2.462  -0.243  -1.548
  210   2HD1  LEU  11          2HD1      LEU  11  -3.201  -0.573  -3.115
  211   3HD1  LEU  11          3HD1      LEU  11  -2.123   0.808  -2.923
  212   1HD2  LEU  11          1HD2      LEU  11   0.688  -1.789  -2.073
  213   2HD2  LEU  11          2HD2      LEU  11  -0.721  -1.808  -1.013
  214   3HD2  LEU  11          3HD2      LEU  11   0.068  -0.280  -1.402
  215    H    VAL  12           H        VAL  12  -1.993  -4.397  -5.826
  216    HA   VAL  12           HA       VAL  12  -2.239  -6.895  -4.383
  217    HB   VAL  12           HB       VAL  12  -3.926  -5.953  -6.060
  218   1HG1  VAL  12          1HG1      VAL  12  -3.511  -6.475  -8.421
  219   2HG1  VAL  12          2HG1      VAL  12  -1.926  -7.133  -8.013
  220   3HG1  VAL  12          3HG1      VAL  12  -2.247  -5.412  -7.805
  221   1HG2  VAL  12          1HG2      VAL  12  -3.603  -8.432  -5.190
  222   2HG2  VAL  12          2HG2      VAL  12  -3.139  -8.735  -6.866
  223   3HG2  VAL  12          3HG2      VAL  12  -4.739  -8.090  -6.495
  224    H    GLU  13           H        GLU  13  -0.389  -5.840  -7.207
  225    HA   GLU  13           HA       GLU  13   0.853  -8.330  -7.787
  226   1HB   GLU  13          1HB       GLU  13   1.035  -6.172  -9.145
  227   2HB   GLU  13          2HB       GLU  13   2.234  -5.638  -7.965
  228   1HG   GLU  13          1HG       GLU  13   3.596  -7.641  -8.439
  229   2HG   GLU  13          2HG       GLU  13   2.403  -8.168  -9.628
  230    H    ALA  14           H        ALA  14   1.337  -5.966  -5.273
  231    HA   ALA  14           HA       ALA  14   3.837  -7.167  -4.328
  232   1HB   ALA  14          1HB       ALA  14   2.536  -5.506  -2.363
  233   2HB   ALA  14          2HB       ALA  14   2.480  -4.711  -3.936
  234   3HB   ALA  14          3HB       ALA  14   4.029  -5.197  -3.249
  235    H    LEU  15           H        LEU  15   0.432  -7.599  -3.874
  236    HA   LEU  15           HA       LEU  15   0.822  -9.055  -1.334
  237   1HB   LEU  15          1HB       LEU  15  -1.662  -8.641  -3.030
  238   2HB   LEU  15          2HB       LEU  15  -1.634  -9.413  -1.444
  239    HG   LEU  15           HG       LEU  15  -0.379  -6.718  -1.656
  240   1HD1  LEU  15          1HD1      LEU  15  -3.105  -6.280  -1.041
  241   2HD1  LEU  15          2HD1      LEU  15  -3.084  -7.245  -2.516
  242   3HD1  LEU  15          3HD1      LEU  15  -2.223  -5.707  -2.457
  243   1HD2  LEU  15          1HD2      LEU  15  -2.081  -6.826   0.521
  244   2HD2  LEU  15          2HD2      LEU  15  -0.367  -7.243   0.555
  245   3HD2  LEU  15          3HD2      LEU  15  -1.577  -8.508   0.346
  246    H    TYR  16           H        TYR  16   0.514  -9.583  -4.727
  247    HA   TYR  16           HA       TYR  16  -0.047 -12.438  -4.570
  248   1HB   TYR  16          1HB       TYR  16  -0.706 -11.590  -6.637
  249   2HB   TYR  16          2HB       TYR  16   0.641 -10.459  -6.717
  250    HD1  TYR  16           HD1      TYR  16  -0.142 -14.121  -6.832
  251    HD2  TYR  16           HD2      TYR  16   2.550 -10.976  -7.983
  252    HE1  TYR  16           HE1      TYR  16   1.132 -15.725  -8.231
  253    HE2  TYR  16           HE2      TYR  16   3.825 -12.580  -9.384
  254    HH   TYR  16           HH       TYR  16   4.191 -15.117  -9.397
  255    H    LEU  17           H        LEU  17   2.697 -10.374  -4.287
  256    HA   LEU  17           HA       LEU  17   4.587 -12.609  -4.753
  257   1HB   LEU  17          1HB       LEU  17   5.200 -10.500  -5.790
  258   2HB   LEU  17          2HB       LEU  17   5.025  -9.655  -4.251
  259    HG   LEU  17           HG       LEU  17   6.784 -11.628  -3.559
  260   1HD1  LEU  17          1HD1      LEU  17   8.519 -11.399  -5.496
  261   2HD1  LEU  17          2HD1      LEU  17   7.115 -10.998  -6.485
  262   3HD1  LEU  17          3HD1      LEU  17   7.204 -12.561  -5.673
  263   1HD2  LEU  17          1HD2      LEU  17   8.516  -9.691  -4.238
  264   2HD2  LEU  17          2HD2      LEU  17   7.407  -9.513  -2.878
  265   3HD2  LEU  17          3HD2      LEU  17   7.017  -8.785  -4.437
  266    H    VAL  18           H        VAL  18   3.310 -10.583  -2.195
  267    HA   VAL  18           HA       VAL  18   5.205 -11.268  -0.167
  268    HB   VAL  18           HB       VAL  18   3.224 -10.836   1.412
  269   1HG1  VAL  18          1HG1      VAL  18   3.204  -8.418   0.051
  270   2HG1  VAL  18          2HG1      VAL  18   4.790  -9.150  -0.202
  271   3HG1  VAL  18          3HG1      VAL  18   4.190  -8.881   1.436
  272   1HG2  VAL  18          1HG2      VAL  18   1.533  -9.355   0.100
  273   2HG2  VAL  18          2HG2      VAL  18   1.249 -11.068   0.366
  274   3HG2  VAL  18          3HG2      VAL  18   1.891 -10.512  -1.177
  275    H    CYS  19           H        CYS  19   1.963 -12.402  -0.553
  276    HA   CYS  19           HA       CYS  19   2.680 -14.881   0.861
  277   1HB   CYS  19          1HB       CYS  19   0.002 -13.714   0.077
  278   2HB   CYS  19          2HB       CYS  19   0.193 -15.260   0.908
  279    H    GLY  20           H        GLY  20   0.667 -14.082  -1.992
  280   1HA   GLY  20          1HA       GLY  20   0.157 -15.438  -3.859
  281   2HA   GLY  20          2HA       GLY  20   1.915 -15.493  -3.978
  282    H    GLU  21           H        GLU  21  -0.055 -16.949  -1.394
  283    HA   GLU  21           HA       GLU  21  -0.139 -19.590  -2.433
  284   1HB   GLU  21          1HB       GLU  21   2.391 -19.238  -2.263
  285   2HB   GLU  21          2HB       GLU  21   2.171 -19.254  -0.514
  286   1HG   GLU  21          1HG       GLU  21   0.916 -21.475  -0.866
  287   2HG   GLU  21          2HG       GLU  21   1.613 -21.473  -2.487
  288    H    ARG  22           H        ARG  22   0.753 -18.063   0.696
  289    HA   ARG  22           HA       ARG  22  -0.676 -19.852   2.353
  290   1HB   ARG  22          1HB       ARG  22  -0.439 -16.881   2.879
  291   2HB   ARG  22          2HB       ARG  22  -0.520 -18.187   4.063
  292   1HG   ARG  22          1HG       ARG  22   1.665 -18.643   2.222
  293   2HG   ARG  22          2HG       ARG  22   1.808 -17.046   2.955
  294   1HD   ARG  22          1HD       ARG  22   1.079 -18.593   5.108
  295   2HD   ARG  22          2HD       ARG  22   2.092 -19.703   4.187
  296    HE   ARG  22           HE       ARG  22   3.889 -17.953   4.296
  297   1HH1  ARG  22          1HH1      ARG  22   2.140 -18.823   6.955
  298   2HH1  ARG  22          2HH1      ARG  22   2.512 -17.427   7.912
  299   1HH2  ARG  22          1HH2      ARG  22   3.978 -15.693   5.291
  300   2HH2  ARG  22          2HH2      ARG  22   3.552 -15.656   6.969
  301    H    GLY  23           H        GLY  23  -1.845 -17.483   0.163
  302   1HA   GLY  23          1HA       GLY  23  -4.417 -18.078  -0.146
  303   2HA   GLY  23          2HA       GLY  23  -4.507 -17.362   1.467
  304    H    PHE  24           H        PHE  24  -3.506 -15.141   1.657
  305    HA   PHE  24           HA       PHE  24  -3.475 -12.910   0.993
  306   1HB   PHE  24          1HB       PHE  24  -1.675 -13.045  -0.398
  307   2HB   PHE  24          2HB       PHE  24  -2.287 -14.486  -1.198
  308    HD1  PHE  24           HD1      PHE  24  -3.539 -10.947  -0.880
  309    HD2  PHE  24           HD2      PHE  24  -2.437 -14.179  -3.492
  310    HE1  PHE  24           HE1      PHE  24  -4.188  -9.583  -2.849
  311    HE2  PHE  24           HE2      PHE  24  -3.085 -12.812  -5.459
  312    HZ   PHE  24           HZ       PHE  24  -3.960 -10.513  -5.137
  313    H    PHE  25           H        PHE  25  -5.355 -11.795   0.878
  314    HA   PHE  25           HA       PHE  25  -7.168 -12.306  -1.433
  315   1HB   PHE  25          1HB       PHE  25  -7.955 -12.117   1.485
  316   2HB   PHE  25          2HB       PHE  25  -9.107 -12.003   0.159
  317    HD1  PHE  25           HD1      PHE  25  -8.914 -14.136   2.435
  318    HD2  PHE  25           HD2      PHE  25  -7.564 -14.057  -1.647
  319    HE1  PHE  25           HE1      PHE  25  -9.046 -16.610   2.341
  320    HE2  PHE  25           HE2      PHE  25  -7.697 -16.528  -1.737
  321    HZ   PHE  25           HZ       PHE  25  -8.438 -17.806   0.255
  322    H    TYR  26           H        TYR  26  -6.560 -10.326  -2.413
  323    HA   TYR  26           HA       TYR  26  -6.776  -7.843  -0.823
  324   1HB   TYR  26          1HB       TYR  26  -4.944  -7.948  -2.417
  325   2HB   TYR  26          2HB       TYR  26  -6.053  -8.352  -3.727
  326    HD1  TYR  26           HD1      TYR  26  -6.587  -5.858  -1.010
  327    HD2  TYR  26           HD2      TYR  26  -5.784  -6.488  -5.185
  328    HE1  TYR  26           HE1      TYR  26  -6.944  -3.440  -1.444
  329    HE2  TYR  26           HE2      TYR  26  -6.140  -4.071  -5.618
  330    HH   TYR  26           HH       TYR  26  -7.412  -1.932  -3.173
  331    H    THR  27           H        THR  27  -8.681  -6.747  -0.705
  332    HA   THR  27           HA       THR  27 -10.950  -7.637  -2.329
  333    HB   THR  27           HB       THR  27 -11.186  -7.016   0.080
  334    HG1  THR  27           HG1      THR  27 -12.913  -5.303  -0.544
  335   1HG2  THR  27          1HG2      THR  27 -10.318  -5.092   0.839
  336   2HG2  THR  27          2HG2      THR  27 -11.338  -4.174  -0.268
  337   3HG2  THR  27          3HG2      THR  27  -9.747  -4.728  -0.788
  338    H    LYS  28           H        LYS  28 -12.067  -6.379  -3.832
  339    HA   LYS  28           HA       LYS  28 -11.709  -3.697  -4.506
  340   1HB   LYS  28          1HB       LYS  28  -9.302  -4.698  -5.009
  341   2HB   LYS  28          2HB       LYS  28 -10.076  -5.235  -6.496
  342   1HG   LYS  28          1HG       LYS  28  -9.300  -3.122  -7.104
  343   2HG   LYS  28          2HG       LYS  28 -10.965  -2.785  -6.632
  344   1HD   LYS  28          1HD       LYS  28  -9.249  -2.683  -4.309
  345   2HD   LYS  28          2HD       LYS  28  -8.625  -1.617  -5.567
  346   1HE   LYS  28          1HE       LYS  28 -11.557  -1.610  -4.877
  347   2HE   LYS  28          2HE       LYS  28 -10.410  -0.670  -3.925
  348   1HZ   LYS  28          1HZ       LYS  28 -10.362  -0.464  -6.857
  349   2HZ   LYS  28          2HZ       LYS  28  -9.909   0.683  -5.689
  350   3HZ   LYS  28          3HZ       LYS  28 -11.553   0.377  -5.989
  351    HA   PRO  29           HA       PRO  29 -13.717  -6.024  -8.135
  352   1HB   PRO  29          1HB       PRO  29 -13.557  -8.761  -8.184
  353   2HB   PRO  29          2HB       PRO  29 -12.350  -7.703  -8.930
  354   1HG   PRO  29          1HG       PRO  29 -12.140  -9.311  -6.438
  355   2HG   PRO  29          2HG       PRO  29 -10.853  -8.712  -7.498
  356   1HD   PRO  29          1HD       PRO  29 -11.661  -7.603  -5.005
  357   2HD   PRO  29          2HD       PRO  29 -10.518  -6.893  -6.157
  358    H    THR  30           H        THR  30 -13.884  -7.236  -4.910
  359    HA   THR  30           HA       THR  30 -16.784  -7.152  -4.910
  360    HB   THR  30           HB       THR  30 -16.276  -9.802  -4.001
  361    HG1  THR  30           HG1      THR  30 -15.313 -10.721  -5.736
  362   1HG2  THR  30          1HG2      THR  30 -17.571  -9.027  -6.615
  363   2HG2  THR  30          2HG2      THR  30 -18.342  -8.694  -5.064
  364   3HG2  THR  30          3HG2      THR  30 -17.994 -10.356  -5.536
  Start of MODEL   15
    1   1H    GLY   1          1H        GLY   1 -14.960   6.287   1.965
    2   2H    GLY   1          2H        GLY   1 -13.631   6.962   2.778
    3   3H    GLY   1          3H        GLY   1 -14.466   5.649   3.459
    4   1HA   GLY   1          1HA       GLY   1 -13.125   4.268   2.329
    5   2HA   GLY   1          2HA       GLY   1 -13.626   4.979   0.764
    6    H    GLY   2           H        GLY   2 -11.370   5.419   0.141
    7   1HA   GLY   2          1HA       GLY   2  -9.173   6.466   0.960
    8   2HA   GLY   2          2HA       GLY   2  -9.238   5.248   2.233
    9    H    GLY   3           H        GLY   3  -7.015   4.893   1.032
   10   1HA   GLY   3          1HA       GLY   3  -6.453   2.536   0.115
   11   2HA   GLY   3          2HA       GLY   3  -7.434   3.032  -1.266
   12    H    GLU   4           H        GLU   4  -4.536   3.943   0.590
   13    HA   GLU   4           HA       GLU   4  -2.910   4.322  -1.711
   14   1HB   GLU   4          1HB       GLU   4  -4.700   6.502  -1.195
   15   2HB   GLU   4          2HB       GLU   4  -3.052   7.038  -0.858
   16   1HG   GLU   4          1HG       GLU   4  -2.763   5.571  -3.189
   17   2HG   GLU   4          2HG       GLU   4  -4.309   6.387  -3.424
   18    H    GLN   5           H        GLN   5  -2.675   3.176   0.877
   19    HA   GLN   5           HA       GLN   5  -0.965   5.009   2.439
   20   1HB   GLN   5          1HB       GLN   5  -0.789   3.022   3.990
   21   2HB   GLN   5          2HB       GLN   5  -2.439   3.591   3.728
   22   1HG   GLN   5          1HG       GLN   5  -2.915   1.818   2.203
   23   2HG   GLN   5          2HG       GLN   5  -1.212   1.378   2.075
   24   1HE2  GLN   5          1HE2      GLN   5  -0.202   0.768   4.351
   25   2HE2  GLN   5          2HE2      GLN   5  -1.174  -0.208   5.342
   26    H    CYS   6           H        CYS   6  -0.580   2.876  -0.143
   27    HA   CYS   6           HA       CYS   6   2.322   2.581   0.511
   28   1HB   CYS   6          1HB       CYS   6   0.459   0.645  -0.874
   29   2HB   CYS   6          2HB       CYS   6   2.215   0.507  -0.952
   30    H    CYS   7           H        CYS   7   0.565   4.543  -1.118
   31    HA   CYS   7           HA       CYS   7   1.862   4.202  -3.776
   32   1HB   CYS   7          1HB       CYS   7  -0.617   4.685  -3.621
   33   2HB   CYS   7          2HB       CYS   7  -0.203   6.259  -2.938
   34    H    THR   8           H        THR   8   1.727   6.301  -0.958
   35    HA   THR   8           HA       THR   8   3.746   8.107  -2.202
   36    HB   THR   8           HB       THR   8   1.886   9.312  -1.251
   37    HG1  THR   8           HG1      THR   8   3.586  10.465  -0.693
   38   1HG2  THR   8          1HG2      THR   8   1.831   8.838   1.459
   39   2HG2  THR   8          2HG2      THR   8   2.115   7.224   0.804
   40   3HG2  THR   8          3HG2      THR   8   0.704   8.149   0.291
   41    H    SER   9           H        SER   9   3.252   5.751   0.330
   42    HA   SER   9           HA       SER   9   5.988   6.274   1.388
   43   1HB   SER   9          1HB       SER   9   3.708   5.864   2.780
   44   2HB   SER   9          2HB       SER   9   4.247   4.196   2.617
   45    HG   SER   9           HG       SER   9   6.342   5.032   3.371
   46    H    ILE  10           H        ILE  10   6.140   3.457   2.375
   47    HA   ILE  10           HA       ILE  10   6.492   2.048  -0.236
   48    HB   ILE  10           HB       ILE  10   8.472   1.990   2.056
   49   1HG1  ILE  10          1HG1      ILE  10   8.554   3.442  -0.607
   50   2HG1  ILE  10          2HG1      ILE  10   8.498   4.189   0.991
   51   1HG2  ILE  10          1HG2      ILE  10   9.733   1.134  -0.232
   52   2HG2  ILE  10          2HG2      ILE  10   8.110   0.477  -0.442
   53   3HG2  ILE  10          3HG2      ILE  10   9.049   0.069   0.995
   54   1HD1  ILE  10          1HD1      ILE  10  10.772   4.249   0.707
   55   2HD1  ILE  10          2HD1      ILE  10  10.774   2.885  -0.410
   56   3HD1  ILE  10          3HD1      ILE  10  10.654   2.603   1.327
   57    H    CYS  11           H        CYS  11   5.926   1.824   3.241
   58    HA   CYS  11           HA       CYS  11   5.037   0.070   4.532
   59   1HB   CYS  11          1HB       CYS  11   4.050  -1.297   2.058
   60   2HB   CYS  11          2HB       CYS  11   3.240  -1.069   3.604
   61    H    SER  12           H        SER  12   4.873  -2.592   4.303
   62    HA   SER  12           HA       SER  12   7.380  -3.560   3.028
   63   1HB   SER  12          1HB       SER  12   8.101  -3.266   5.294
   64   2HB   SER  12          2HB       SER  12   6.627  -3.965   5.921
   65    HG   SER  12           HG       SER  12   8.064  -5.595   5.960
   66    H    LEU  13           H        LEU  13   7.442  -5.925   3.061
   67    HA   LEU  13           HA       LEU  13   4.863  -6.995   2.251
   68   1HB   LEU  13          1HB       LEU  13   6.464  -9.229   2.534
   69   2HB   LEU  13          2HB       LEU  13   6.273  -8.303   1.050
   70    HG   LEU  13           HG       LEU  13   8.213  -6.896   1.700
   71   1HD1  LEU  13          1HD1      LEU  13   9.506  -7.354   3.638
   72   2HD1  LEU  13          2HD1      LEU  13   8.709  -8.904   3.903
   73   3HD1  LEU  13          3HD1      LEU  13   7.836  -7.402   4.203
   74   1HD2  LEU  13          1HD2      LEU  13   9.218  -8.446   0.394
   75   2HD2  LEU  13          2HD2      LEU  13   8.261  -9.754   1.089
   76   3HD2  LEU  13          3HD2      LEU  13   9.739  -9.223   1.889
   77    H    TYR  14           H        TYR  14   6.133  -6.350   5.207
   78    HA   TYR  14           HA       TYR  14   4.986  -8.765   6.476
   79   1HB   TYR  14          1HB       TYR  14   6.992  -6.831   7.123
   80   2HB   TYR  14          2HB       TYR  14   5.775  -6.861   8.399
   81    HD1  TYR  14           HD1      TYR  14   7.241  -9.452   6.110
   82    HD2  TYR  14           HD2      TYR  14   6.409  -8.251  10.148
   83    HE1  TYR  14           HE1      TYR  14   8.155 -11.610   6.942
   84    HE2  TYR  14           HE2      TYR  14   7.322 -10.405  10.986
   85    HH   TYR  14           HH       TYR  14   7.758 -12.634  10.214
   86    H    GLN  15           H        GLN  15   4.598  -5.258   6.434
   87    HA   GLN  15           HA       GLN  15   2.156  -5.400   8.044
   88   1HB   GLN  15          1HB       GLN  15   2.035  -3.007   7.762
   89   2HB   GLN  15          2HB       GLN  15   3.732  -3.407   8.020
   90   1HG   GLN  15          1HG       GLN  15   4.011  -2.109   6.156
   91   2HG   GLN  15          2HG       GLN  15   3.632  -3.621   5.333
   92   1HE2  GLN  15          1HE2      GLN  15   1.528  -1.253   7.061
   93   2HE2  GLN  15          2HE2      GLN  15   0.473  -1.013   5.753
   94    H    LEU  16           H        LEU  16   3.057  -5.254   4.695
   95    HA   LEU  16           HA       LEU  16   0.279  -4.914   3.823
   96   1HB   LEU  16          1HB       LEU  16   1.162  -4.556   1.754
   97   2HB   LEU  16          2HB       LEU  16   2.664  -4.349   2.641
   98    HG   LEU  16           HG       LEU  16   3.028  -6.859   2.319
   99   1HD1  LEU  16          1HD1      LEU  16   1.412  -8.050   1.284
  100   2HD1  LEU  16          2HD1      LEU  16   1.539  -7.004  -0.132
  101   3HD1  LEU  16          3HD1      LEU  16   0.425  -6.592   1.172
  102   1HD2  LEU  16          1HD2      LEU  16   3.603  -4.629   0.729
  103   2HD2  LEU  16          2HD2      LEU  16   3.027  -5.844  -0.413
  104   3HD2  LEU  16          3HD2      LEU  16   4.395  -6.201   0.640
  105    H    GLU  17           H        GLU  17   2.455  -7.419   4.731
  106    HA   GLU  17           HA       GLU  17   1.244  -9.612   3.328
  107   1HB   GLU  17          1HB       GLU  17   3.211 -10.319   4.318
  108   2HB   GLU  17          2HB       GLU  17   2.978  -9.317   5.748
  109   1HG   GLU  17          1HG       GLU  17   1.091 -11.600   5.283
  110   2HG   GLU  17          2HG       GLU  17   2.717 -11.962   5.866
  111    H    ASN  18           H        ASN  18   0.332  -7.675   6.044
  112    HA   ASN  18           HA       ASN  18  -1.486  -9.360   7.366
  113   1HB   ASN  18          1HB       ASN  18  -0.811  -6.713   7.571
  114   2HB   ASN  18          2HB       ASN  18  -2.454  -6.604   6.940
  115   1HD2  ASN  18          1HD2      ASN  18  -4.040  -8.231   8.151
  116   2HD2  ASN  18          2HD2      ASN  18  -3.876  -8.280   9.839
  117    H    TYR  19           H        TYR  19  -1.616  -8.034   4.197
  118    HA   TYR  19           HA       TYR  19  -4.486  -8.166   3.831
  119   1HB   TYR  19          1HB       TYR  19  -2.144  -8.007   1.931
  120   2HB   TYR  19          2HB       TYR  19  -3.807  -8.123   1.357
  121    HD1  TYR  19           HD1      TYR  19  -1.331  -5.830   1.843
  122    HD2  TYR  19           HD2      TYR  19  -5.415  -6.506   2.991
  123    HE1  TYR  19           HE1      TYR  19  -1.634  -3.391   2.206
  124    HE2  TYR  19           HE2      TYR  19  -5.721  -4.069   3.356
  125    HH   TYR  19           HH       TYR  19  -4.440  -1.883   2.313
  126    H    CYS  20           H        CYS  20  -1.909 -10.478   3.705
  127    HA   CYS  20           HA       CYS  20  -3.072 -12.405   1.961
  128   1HB   CYS  20          1HB       CYS  20  -1.449 -13.104   4.408
  129   2HB   CYS  20          2HB       CYS  20  -1.532 -13.969   2.876
  130    H    ASN  21           H        ASN  21  -3.391 -14.738   3.335
  131    HA   ASN  21           HA       ASN  21  -5.867 -14.192   4.910
  132   1HB   ASN  21          1HB       ASN  21  -5.933 -15.629   2.781
  133   2HB   ASN  21          2HB       ASN  21  -5.058 -16.846   3.711
  134   1HD2  ASN  21          1HD2      ASN  21  -8.134 -15.070   3.515
  135   2HD2  ASN  21          2HD2      ASN  21  -8.996 -16.113   4.541
  136   1H    PHE   1          1H        PHE   1  13.800  -7.538  -1.030
  137   2H    PHE   1          2H        PHE   1  14.490  -7.019  -2.494
  138   3H    PHE   1          3H        PHE   1  13.721  -8.532  -2.403
  139    HA   PHE   1           HA       PHE   1  12.373  -6.802  -3.524
  140   1HB   PHE   1          1HB       PHE   1  10.356  -7.191  -1.904
  141   2HB   PHE   1          2HB       PHE   1  11.085  -8.580  -2.709
  142    HD1  PHE   1           HD1      PHE   1  11.360  -6.547   0.432
  143    HD2  PHE   1           HD2      PHE   1  11.858 -10.388  -1.433
  144    HE1  PHE   1           HE1      PHE   1  11.888  -7.551   2.638
  145    HE2  PHE   1           HE2      PHE   1  12.385 -11.391   0.775
  146    HZ   PHE   1           HZ       PHE   1  12.400  -9.970   2.810
  147    H    VAL   2           H        VAL   2  14.114  -5.008  -2.407
  148    HA   VAL   2           HA       VAL   2  12.679  -3.416  -0.384
  149    HB   VAL   2           HB       VAL   2  15.280  -3.767  -0.686
  150   1HG1  VAL   2          1HG1      VAL   2  16.408  -2.357  -2.122
  151   2HG1  VAL   2          2HG1      VAL   2  15.117  -1.156  -2.118
  152   3HG1  VAL   2          3HG1      VAL   2  14.943  -2.633  -3.065
  153   1HG2  VAL   2          1HG2      VAL   2  13.632  -1.660   0.443
  154   2HG2  VAL   2          2HG2      VAL   2  15.236  -1.066   0.015
  155   3HG2  VAL   2          3HG2      VAL   2  15.067  -2.435   1.115
  156    H    ASN   3           H        ASN   3  13.252  -0.859  -1.194
  157    HA   ASN   3           HA       ASN   3  11.958   0.818  -2.279
  158   1HB   ASN   3          1HB       ASN   3  13.830  -0.531  -4.120
  159   2HB   ASN   3          2HB       ASN   3  12.581   0.434  -4.910
  160   1HD2  ASN   3          1HD2      ASN   3  15.612   0.912  -4.343
  161   2HD2  ASN   3          2HD2      ASN   3  15.642   2.471  -3.673
  162    H    GLN   4           H        GLN   4   9.905  -0.433  -1.720
  163    HA   GLN   4           HA       GLN   4   8.637  -1.638  -4.132
  164   1HB   GLN   4          1HB       GLN   4   8.651  -2.668  -1.688
  165   2HB   GLN   4          2HB       GLN   4   7.309  -1.550  -1.445
  166   1HG   GLN   4          1HG       GLN   4   5.964  -3.060  -2.432
  167   2HG   GLN   4          2HG       GLN   4   6.828  -2.759  -3.939
  168   1HE2  GLN   4          1HE2      GLN   4   6.494  -5.003  -1.241
  169   2HE2  GLN   4          2HE2      GLN   4   7.512  -6.205  -1.876
  170    H    HIS   5           H        HIS   5   7.179  -0.424  -5.262
  171    HA   HIS   5           HA       HIS   5   5.756   1.755  -3.821
  172   1HB   HIS   5          1HB       HIS   5   7.753   2.068  -5.945
  173   2HB   HIS   5          2HB       HIS   5   6.224   2.875  -6.299
  174    HD2  HIS   5           HD2      HIS   5   8.329   2.664  -2.916
  175    HE1  HIS   5           HE1      HIS   5   7.123   6.655  -3.607
  176    HE2  HIS   5           HE2      HIS   5   8.359   5.099  -2.006
  177    H    LEU   6           H        LEU   6   3.636   1.379  -4.122
  178    HA   LEU   6           HA       LEU   6   2.666   0.771  -6.843
  179   1HB   LEU   6          1HB       LEU   6   1.052  -0.924  -5.427
  180   2HB   LEU   6          2HB       LEU   6   2.458  -1.436  -6.352
  181    HG   LEU   6           HG       LEU   6   2.346  -2.312  -3.975
  182   1HD1  LEU   6          1HD1      LEU   6   4.822  -0.799  -3.867
  183   2HD1  LEU   6          2HD1      LEU   6   4.516  -1.413  -5.492
  184   3HD1  LEU   6          3HD1      LEU   6   4.577  -2.526  -4.127
  185   1HD2  LEU   6          1HD2      LEU   6   2.067  -0.888  -2.261
  186   2HD2  LEU   6          2HD2      LEU   6   1.909   0.429  -3.416
  187   3HD2  LEU   6          3HD2      LEU   6   3.490   0.030  -2.751
  188    H    CYS   7           H        CYS   7   0.223   0.997  -6.924
  189    HA   CYS   7           HA       CYS   7  -0.863   2.635  -4.691
  190   1HB   CYS   7          1HB       CYS   7  -1.065   3.478  -7.596
  191   2HB   CYS   7          2HB       CYS   7  -1.642   4.371  -6.189
  192    H    GLY   8           H        GLY   8  -1.528   1.051  -7.813
  193   1HA   GLY   8          1HA       GLY   8  -4.087   0.069  -6.641
  194   2HA   GLY   8          2HA       GLY   8  -4.097   0.809  -8.244
  195    H    SER   9           H        SER   9  -3.497  -0.443  -9.995
  196    HA   SER   9           HA       SER   9  -3.540  -3.231  -9.913
  197   1HB   SER   9          1HB       SER   9  -1.910  -2.891 -12.026
  198   2HB   SER   9          2HB       SER   9  -3.628  -2.504 -12.094
  199    HG   SER   9           HG       SER   9  -2.927  -0.579 -12.579
  200    H    ASP  10           H        ASP  10  -0.872  -1.057  -9.228
  201    HA   ASP  10           HA       ASP  10   1.124  -3.192  -9.193
  202   1HB   ASP  10          1HB       ASP  10   1.416  -0.583  -9.573
  203   2HB   ASP  10          2HB       ASP  10   1.549  -0.567  -7.814
  204    H    LEU  11           H        LEU  11  -1.177  -1.862  -7.000
  205    HA   LEU  11           HA       LEU  11   0.136  -2.561  -4.540
  206   1HB   LEU  11          1HB       LEU  11  -2.393  -1.461  -5.328
  207   2HB   LEU  11          2HB       LEU  11  -2.699  -2.820  -4.251
  208    HG   LEU  11           HG       LEU  11  -2.485  -1.013  -2.769
  209   1HD1  LEU  11          1HD1      LEU  11  -0.710  -1.623  -1.435
  210   2HD1  LEU  11          2HD1      LEU  11   0.427  -1.668  -2.782
  211   3HD1  LEU  11          3HD1      LEU  11  -0.709  -2.996  -2.543
  212   1HD2  LEU  11          1HD2      LEU  11  -0.700   0.006  -4.873
  213   2HD2  LEU  11          2HD2      LEU  11  -0.161   0.381  -3.235
  214   3HD2  LEU  11          3HD2      LEU  11  -1.762   0.884  -3.773
  215    H    VAL  12           H        VAL  12  -2.381  -4.189  -6.426
  216    HA   VAL  12           HA       VAL  12  -2.353  -6.583  -4.840
  217    HB   VAL  12           HB       VAL  12  -4.262  -6.116  -6.272
  218   1HG1  VAL  12          1HG1      VAL  12  -2.118  -5.744  -8.270
  219   2HG1  VAL  12          2HG1      VAL  12  -3.704  -4.980  -8.166
  220   3HG1  VAL  12          3HG1      VAL  12  -3.544  -6.591  -8.868
  221   1HG2  VAL  12          1HG2      VAL  12  -3.119  -8.552  -6.021
  222   2HG2  VAL  12          2HG2      VAL  12  -3.068  -8.389  -7.777
  223   3HG2  VAL  12          3HG2      VAL  12  -4.610  -8.290  -6.928
  224    H    GLU  13           H        GLU  13  -0.443  -5.446  -7.525
  225    HA   GLU  13           HA       GLU  13   0.753  -7.944  -8.252
  226   1HB   GLU  13          1HB       GLU  13   0.974  -5.357  -9.154
  227   2HB   GLU  13          2HB       GLU  13   2.515  -5.571  -8.323
  228   1HG   GLU  13          1HG       GLU  13   2.345  -7.934  -9.665
  229   2HG   GLU  13          2HG       GLU  13   1.502  -6.866 -10.787
  230    H    ALA  14           H        ALA  14   1.365  -5.575  -5.720
  231    HA   ALA  14           HA       ALA  14   3.749  -6.987  -4.746
  232   1HB   ALA  14          1HB       ALA  14   2.682  -4.400  -4.432
  233   2HB   ALA  14          2HB       ALA  14   4.121  -5.049  -3.646
  234   3HB   ALA  14          3HB       ALA  14   2.556  -5.150  -2.841
  235    H    LEU  15           H        LEU  15   0.345  -7.227  -4.406
  236    HA   LEU  15           HA       LEU  15   0.493  -8.514  -1.753
  237   1HB   LEU  15          1HB       LEU  15  -1.790  -8.012  -3.682
  238   2HB   LEU  15          2HB       LEU  15  -1.983  -8.875  -2.156
  239    HG   LEU  15           HG       LEU  15  -0.755  -6.117  -2.296
  240   1HD1  LEU  15          1HD1      LEU  15  -2.840  -5.110  -2.067
  241   2HD1  LEU  15          2HD1      LEU  15  -3.598  -6.582  -1.459
  242   3HD1  LEU  15          3HD1      LEU  15  -3.228  -6.425  -3.176
  243   1HD2  LEU  15          1HD2      LEU  15  -0.569  -7.792  -0.289
  244   2HD2  LEU  15          2HD2      LEU  15  -2.256  -7.365  -0.003
  245   3HD2  LEU  15          3HD2      LEU  15  -1.011  -6.117   0.035
  246    H    TYR  16           H        TYR  16   0.224  -9.299  -5.128
  247    HA   TYR  16           HA       TYR  16  -0.370 -12.119  -4.758
  248   1HB   TYR  16          1HB       TYR  16  -1.008 -11.325  -6.871
  249   2HB   TYR  16          2HB       TYR  16   0.456 -10.361  -7.059
  250    HD1  TYR  16           HD1      TYR  16  -0.711 -13.917  -6.809
  251    HD2  TYR  16           HD2      TYR  16   2.272 -11.201  -8.287
  252    HE1  TYR  16           HE1      TYR  16   0.371 -15.777  -8.045
  253    HE2  TYR  16           HE2      TYR  16   3.353 -13.059  -9.525
  254    HH   TYR  16           HH       TYR  16   1.952 -16.331  -9.518
  255    H    LEU  17           H        LEU  17   2.474 -10.140  -4.739
  256    HA   LEU  17           HA       LEU  17   4.251 -12.504  -4.990
  257   1HB   LEU  17          1HB       LEU  17   4.856 -10.505  -6.275
  258   2HB   LEU  17          2HB       LEU  17   4.839  -9.532  -4.806
  259    HG   LEU  17           HG       LEU  17   6.574 -11.412  -4.011
  260   1HD1  LEU  17          1HD1      LEU  17   6.946 -11.241  -7.015
  261   2HD1  LEU  17          2HD1      LEU  17   6.416 -12.672  -6.131
  262   3HD1  LEU  17          3HD1      LEU  17   8.044 -12.038  -5.887
  263   1HD2  LEU  17          1HD2      LEU  17   7.231  -9.060  -5.810
  264   2HD2  LEU  17          2HD2      LEU  17   8.371  -9.858  -4.727
  265   3HD2  LEU  17          3HD2      LEU  17   6.986  -8.988  -4.065
  266    H    VAL  18           H        VAL  18   2.835 -10.444  -2.630
  267    HA   VAL  18           HA       VAL  18   4.850 -10.832  -0.579
  268    HB   VAL  18           HB       VAL  18   2.119  -9.638  -0.712
  269   1HG1  VAL  18          1HG1      VAL  18   3.291 -10.936   1.699
  270   2HG1  VAL  18          2HG1      VAL  18   1.602 -10.614   1.307
  271   3HG1  VAL  18          3HG1      VAL  18   2.627  -9.318   1.926
  272   1HG2  VAL  18          1HG2      VAL  18   4.143  -8.382   0.939
  273   2HG2  VAL  18          2HG2      VAL  18   3.323  -7.760  -0.493
  274   3HG2  VAL  18          3HG2      VAL  18   4.766  -8.760  -0.668
  275    H    CYS  19           H        CYS  19   1.568 -12.125  -1.000
  276    HA   CYS  19           HA       CYS  19   2.162 -14.114   1.066
  277   1HB   CYS  19          1HB       CYS  19  -0.359 -14.224  -0.544
  278   2HB   CYS  19          2HB       CYS  19  -0.120 -14.515   1.177
  279    H    GLY  20           H        GLY  20   0.638 -14.476  -2.132
  280   1HA   GLY  20          1HA       GLY  20   0.717 -16.338  -3.590
  281   2HA   GLY  20          2HA       GLY  20   2.444 -16.003  -3.516
  282    H    GLU  21           H        GLU  21   0.379 -17.222  -0.874
  283    HA   GLU  21           HA       GLU  21   1.128 -19.967  -1.155
  284   1HB   GLU  21          1HB       GLU  21   3.382 -18.989  -0.627
  285   2HB   GLU  21          2HB       GLU  21   2.740 -18.481   0.936
  286   1HG   GLU  21          1HG       GLU  21   3.209 -20.530   1.742
  287   2HG   GLU  21          2HG       GLU  21   2.010 -21.196   0.631
  288    H    ARG  22           H        ARG  22   1.182 -18.022   1.844
  289    HA   ARG  22           HA       ARG  22  -0.584 -19.723   3.255
  290   1HB   ARG  22          1HB       ARG  22  -0.085 -16.752   3.609
  291   2HB   ARG  22          2HB       ARG  22  -0.940 -17.763   4.773
  292   1HG   ARG  22          1HG       ARG  22   0.982 -18.638   5.580
  293   2HG   ARG  22          2HG       ARG  22   1.628 -18.910   3.961
  294   1HD   ARG  22          1HD       ARG  22   2.836 -16.998   4.011
  295   2HD   ARG  22          2HD       ARG  22   1.483 -16.069   4.657
  296    HE   ARG  22           HE       ARG  22   2.260 -16.547   6.871
  297   1HH1  ARG  22          1HH1      ARG  22   4.821 -16.472   4.968
  298   2HH1  ARG  22          2HH1      ARG  22   5.761 -17.700   5.748
  299   1HH2  ARG  22          1HH2      ARG  22   3.116 -18.883   7.655
  300   2HH2  ARG  22          2HH2      ARG  22   4.796 -19.064   7.271
  301    H    GLY  23           H        GLY  23  -1.236 -17.059   1.059
  302   1HA   GLY  23          1HA       GLY  23  -3.667 -17.725   0.086
  303   2HA   GLY  23          2HA       GLY  23  -4.117 -17.099   1.675
  304    H    PHE  24           H        PHE  24  -5.258 -15.400   0.407
  305    HA   PHE  24           HA       PHE  24  -4.037 -12.913   0.468
  306   1HB   PHE  24          1HB       PHE  24  -2.394 -13.477  -1.152
  307   2HB   PHE  24          2HB       PHE  24  -3.558 -14.342  -2.154
  308    HD1  PHE  24           HD1      PHE  24  -3.812 -10.972  -0.547
  309    HD2  PHE  24           HD2      PHE  24  -3.592 -13.202  -4.213
  310    HE1  PHE  24           HE1      PHE  24  -4.241  -8.895  -1.837
  311    HE2  PHE  24           HE2      PHE  24  -4.019 -11.127  -5.502
  312    HZ   PHE  24           HZ       PHE  24  -4.344  -8.974  -4.314
  313    H    PHE  25           H        PHE  25  -5.569 -11.331  -0.041
  314    HA   PHE  25           HA       PHE  25  -7.783 -11.949  -1.859
  315   1HB   PHE  25          1HB       PHE  25  -9.164 -12.770  -0.271
  316   2HB   PHE  25          2HB       PHE  25  -8.016 -12.389   1.005
  317    HD1  PHE  25           HD1      PHE  25 -10.891 -11.141  -0.955
  318    HD2  PHE  25           HD2      PHE  25  -8.193 -10.339   2.293
  319    HE1  PHE  25           HE1      PHE  25 -12.354  -9.285  -0.198
  320    HE2  PHE  25           HE2      PHE  25  -9.656  -8.483   3.050
  321    HZ   PHE  25           HZ       PHE  25 -11.736  -7.956   1.805
  322    H    TYR  26           H        TYR  26  -8.230 -10.072  -2.900
  323    HA   TYR  26           HA       TYR  26  -8.291  -7.526  -1.446
  324   1HB   TYR  26          1HB       TYR  26  -5.858  -7.915  -2.068
  325   2HB   TYR  26          2HB       TYR  26  -6.357  -7.823  -3.757
  326    HD1  TYR  26           HD1      TYR  26  -6.347  -5.946  -0.536
  327    HD2  TYR  26           HD2      TYR  26  -6.744  -5.728  -4.810
  328    HE1  TYR  26           HE1      TYR  26  -6.282  -3.469  -0.416
  329    HE2  TYR  26           HE2      TYR  26  -6.678  -3.249  -4.689
  330    HH   TYR  26           HH       TYR  26  -5.535  -1.558  -2.286
  331    H    THR  27           H        THR  27  -9.006  -5.735  -2.955
  332    HA   THR  27           HA       THR  27 -10.432  -6.816  -5.346
  333    HB   THR  27           HB       THR  27 -12.036  -4.743  -4.376
  334    HG1  THR  27           HG1      THR  27 -11.412  -6.525  -2.269
  335   1HG2  THR  27          1HG2      THR  27 -12.270  -7.752  -4.116
  336   2HG2  THR  27          2HG2      THR  27 -12.880  -6.752  -5.434
  337   3HG2  THR  27          3HG2      THR  27 -13.600  -6.629  -3.829
  338    H    LYS  28           H        LYS  28  -9.836  -5.685  -7.128
  339    HA   LYS  28           HA       LYS  28  -8.243  -3.281  -6.918
  340   1HB   LYS  28          1HB       LYS  28  -8.552  -5.178  -8.855
  341   2HB   LYS  28          2HB       LYS  28  -9.508  -3.856  -9.525
  342   1HG   LYS  28          1HG       LYS  28  -7.651  -2.341  -9.426
  343   2HG   LYS  28          2HG       LYS  28  -6.703  -3.471  -8.458
  344   1HD   LYS  28          1HD       LYS  28  -5.836  -4.267 -10.378
  345   2HD   LYS  28          2HD       LYS  28  -7.433  -4.910 -10.758
  346   1HE   LYS  28          1HE       LYS  28  -7.474  -2.116 -11.330
  347   2HE   LYS  28          2HE       LYS  28  -6.021  -2.792 -12.067
  348   1HZ   LYS  28          1HZ       LYS  28  -7.462  -4.566 -13.002
  349   2HZ   LYS  28          2HZ       LYS  28  -7.794  -3.013 -13.609
  350   3HZ   LYS  28          3HZ       LYS  28  -8.815  -3.710 -12.443
  351    HA   PRO  29           HA       PRO  29 -12.193  -1.138  -8.529
  352   1HB   PRO  29          1HB       PRO  29 -14.517  -2.607  -8.538
  353   2HB   PRO  29          2HB       PRO  29 -13.412  -2.512  -9.919
  354   1HG   PRO  29          1HG       PRO  29 -13.836  -4.757  -8.009
  355   2HG   PRO  29          2HG       PRO  29 -13.255  -4.802  -9.681
  356   1HD   PRO  29          1HD       PRO  29 -11.655  -5.006  -7.355
  357   2HD   PRO  29          2HD       PRO  29 -11.064  -4.740  -9.009
  358    H    THR  30           H        THR  30 -14.618  -0.729  -7.452
  359    HA   THR  30           HA       THR  30 -14.050  -0.621  -4.547
  360    HB   THR  30           HB       THR  30 -15.928   0.970  -4.469
  361    HG1  THR  30           HG1      THR  30 -17.176   1.309  -6.201
  362   1HG2  THR  30          1HG2      THR  30 -14.955   2.714  -5.921
  363   2HG2  THR  30          2HG2      THR  30 -14.032   1.480  -6.778
  364   3HG2  THR  30          3HG2      THR  30 -13.696   1.811  -5.078
  Start of MODEL   16
    1   1H    GLY   1          1H        GLY   1 -10.127   1.410   7.153
    2   2H    GLY   1          2H        GLY   1  -8.621   2.184   7.023
    3   3H    GLY   1          3H        GLY   1  -8.800   0.838   8.043
    4   1HA   GLY   1          1HA       GLY   1  -7.978   0.708   5.470
    5   2HA   GLY   1          2HA       GLY   1  -8.481  -0.703   6.449
    6    H    GLY   2           H        GLY   2 -10.110   2.270   5.114
    7   1HA   GLY   2          1HA       GLY   2 -10.911   0.750   2.668
    8   2HA   GLY   2          2HA       GLY   2 -11.869   2.043   3.390
    9    H    GLY   3           H        GLY   3  -8.431   1.773   2.439
   10   1HA   GLY   3          1HA       GLY   3  -8.801   3.866   0.404
   11   2HA   GLY   3          2HA       GLY   3  -7.796   4.327   1.781
   12    H    GLU   4           H        GLU   4  -5.804   4.398   0.691
   13    HA   GLU   4           HA       GLU   4  -4.965   1.989  -0.823
   14   1HB   GLU   4          1HB       GLU   4  -3.220   4.393  -0.350
   15   2HB   GLU   4          2HB       GLU   4  -3.257   3.305  -1.737
   16   1HG   GLU   4          1HG       GLU   4  -5.528   4.179  -2.309
   17   2HG   GLU   4          2HG       GLU   4  -5.371   5.345  -0.994
   18    H    GLN   5           H        GLN   5  -3.345   4.086   1.578
   19    HA   GLN   5           HA       GLN   5  -2.254   3.480   3.578
   20   1HB   GLN   5          1HB       GLN   5  -4.031   1.611   3.643
   21   2HB   GLN   5          2HB       GLN   5  -2.782   0.576   2.949
   22   1HG   GLN   5          1HG       GLN   5  -1.490   0.615   4.856
   23   2HG   GLN   5          2HG       GLN   5  -2.033   2.228   5.320
   24   1HE2  GLN   5          1HE2      GLN   5  -2.104  -0.639   6.667
   25   2HE2  GLN   5          2HE2      GLN   5  -3.685  -0.715   7.277
   26    H    CYS   6           H        CYS   6  -1.520   2.305   0.448
   27    HA   CYS   6           HA       CYS   6   1.316   2.041   1.284
   28   1HB   CYS   6          1HB       CYS   6  -0.247   0.070  -0.395
   29   2HB   CYS   6          2HB       CYS   6   1.515   0.123  -0.389
   30    H    CYS   7           H        CYS   7   0.192   4.303   0.145
   31    HA   CYS   7           HA       CYS   7   1.463   4.266  -2.556
   32   1HB   CYS   7          1HB       CYS   7  -1.012   4.307  -2.770
   33   2HB   CYS   7          2HB       CYS   7  -1.059   5.766  -1.781
   34    H    THR   8           H        THR   8   0.582   6.131   0.331
   35    HA   THR   8           HA       THR   8   2.077   8.490  -0.508
   36    HB   THR   8           HB       THR   8   1.779   8.411   2.334
   37    HG1  THR   8           HG1      THR   8   0.049   7.279   2.571
   38   1HG2  THR   8          1HG2      THR   8  -0.231   9.817   0.672
   39   2HG2  THR   8          2HG2      THR   8   1.454  10.206   0.328
   40   3HG2  THR   8          3HG2      THR   8   0.808  10.442   1.952
   41    H    SER   9           H        SER   9   2.652   6.716   2.524
   42    HA   SER   9           HA       SER   9   5.507   7.220   2.352
   43   1HB   SER   9          1HB       SER   9   4.147   6.964   4.495
   44   2HB   SER   9          2HB       SER   9   4.115   5.234   4.168
   45    HG   SER   9           HG       SER   9   6.366   6.909   4.590
   46    H    ILE  10           H        ILE  10   5.755   4.224   3.452
   47    HA   ILE  10           HA       ILE  10   5.517   2.762   0.910
   48    HB   ILE  10           HB       ILE  10   8.225   3.088   2.237
   49   1HG1  ILE  10          1HG1      ILE  10   6.953   4.380  -0.179
   50   2HG1  ILE  10          2HG1      ILE  10   7.839   5.151   1.136
   51   1HG2  ILE  10          1HG2      ILE  10   7.620   1.896  -0.468
   52   2HG2  ILE  10          2HG2      ILE  10   7.540   0.908   0.992
   53   3HG2  ILE  10          3HG2      ILE  10   9.057   1.681   0.532
   54   1HD1  ILE  10          1HD1      ILE  10   9.588   5.126  -0.320
   55   2HD1  ILE  10          2HD1      ILE  10   8.847   3.884  -1.328
   56   3HD1  ILE  10          3HD1      ILE  10   9.726   3.426   0.131
   57    H    CYS  11           H        CYS  11   4.131   1.361   2.052
   58    HA   CYS  11           HA       CYS  11   4.440   0.242   4.587
   59   1HB   CYS  11          1HB       CYS  11   3.528  -1.320   2.155
   60   2HB   CYS  11          2HB       CYS  11   3.062  -1.587   3.831
   61    H    SER  12           H        SER  12   4.888  -2.343   4.738
   62    HA   SER  12           HA       SER  12   7.491  -2.871   3.379
   63   1HB   SER  12          1HB       SER  12   7.303  -2.344   6.074
   64   2HB   SER  12          2HB       SER  12   7.190  -4.086   6.035
   65    HG   SER  12           HG       SER  12   9.362  -3.306   6.122
   66    H    LEU  13           H        LEU  13   7.981  -5.327   4.121
   67    HA   LEU  13           HA       LEU  13   5.996  -6.897   2.752
   68   1HB   LEU  13          1HB       LEU  13   7.958  -8.191   4.611
   69   2HB   LEU  13          2HB       LEU  13   7.465  -8.686   2.992
   70    HG   LEU  13           HG       LEU  13   8.629  -6.198   2.575
   71   1HD1  LEU  13          1HD1      LEU  13   9.856  -7.589   4.910
   72   2HD1  LEU  13          2HD1      LEU  13   9.765  -5.864   4.549
   73   3HD1  LEU  13          3HD1      LEU  13  10.954  -6.876   3.728
   74   1HD2  LEU  13          1HD2      LEU  13   9.079  -7.890   1.020
   75   2HD2  LEU  13          2HD2      LEU  13   9.528  -9.052   2.269
   76   3HD2  LEU  13          3HD2      LEU  13  10.630  -7.740   1.846
   77    H    TYR  14           H        TYR  14   6.150  -5.668   5.885
   78    HA   TYR  14           HA       TYR  14   4.709  -7.810   7.243
   79   1HB   TYR  14          1HB       TYR  14   5.590  -5.037   7.831
   80   2HB   TYR  14          2HB       TYR  14   4.282  -5.695   8.802
   81    HD1  TYR  14           HD1      TYR  14   7.681  -6.601   7.504
   82    HD2  TYR  14           HD2      TYR  14   4.805  -7.018  10.670
   83    HE1  TYR  14           HE1      TYR  14   9.333  -7.887   8.836
   84    HE2  TYR  14           HE2      TYR  14   6.457  -8.304  12.002
   85    HH   TYR  14           HH       TYR  14   9.333  -9.538  10.668
   86    H    GLN  15           H        GLN  15   3.909  -4.530   6.229
   87    HA   GLN  15           HA       GLN  15   1.109  -4.707   6.723
   88   1HB   GLN  15          1HB       GLN  15   2.785  -2.981   4.918
   89   2HB   GLN  15          2HB       GLN  15   1.027  -2.834   4.934
   90   1HG   GLN  15          1HG       GLN  15   1.518  -2.804   7.596
   91   2HG   GLN  15          2HG       GLN  15   3.013  -2.074   7.007
   92   1HE2  GLN  15          1HE2      GLN  15  -0.333  -1.467   7.639
   93   2HE2  GLN  15          2HE2      GLN  15  -0.401   0.086   6.955
   94    H    LEU  16           H        LEU  16   3.091  -5.536   3.954
   95    HA   LEU  16           HA       LEU  16   0.892  -6.122   2.174
   96   1HB   LEU  16          1HB       LEU  16   3.734  -7.195   2.175
   97   2HB   LEU  16          2HB       LEU  16   2.595  -7.317   0.834
   98    HG   LEU  16           HG       LEU  16   3.552  -4.706   2.046
   99   1HD1  LEU  16          1HD1      LEU  16   4.280  -5.959  -0.616
  100   2HD1  LEU  16          2HD1      LEU  16   5.315  -6.018   0.810
  101   3HD1  LEU  16          3HD1      LEU  16   4.926  -4.467   0.067
  102   1HD2  LEU  16          1HD2      LEU  16   2.517  -3.797  -0.077
  103   2HD2  LEU  16          2HD2      LEU  16   1.354  -4.469   1.067
  104   3HD2  LEU  16          3HD2      LEU  16   1.833  -5.398  -0.354
  105    H    GLU  17           H        GLU  17   2.617  -7.860   4.692
  106    HA   GLU  17           HA       GLU  17   1.444 -10.448   3.979
  107   1HB   GLU  17          1HB       GLU  17   3.081  -9.420   6.293
  108   2HB   GLU  17          2HB       GLU  17   2.322 -11.011   6.364
  109   1HG   GLU  17          1HG       GLU  17   4.040 -10.160   4.028
  110   2HG   GLU  17          2HG       GLU  17   4.722 -10.935   5.459
  111    H    ASN  18           H        ASN  18   0.408  -7.653   5.619
  112    HA   ASN  18           HA       ASN  18  -1.444  -8.974   7.442
  113   1HB   ASN  18          1HB       ASN  18  -0.396  -6.449   7.308
  114   2HB   ASN  18          2HB       ASN  18  -2.006  -6.185   6.636
  115   1HD2  ASN  18          1HD2      ASN  18  -3.754  -7.591   8.047
  116   2HD2  ASN  18          2HD2      ASN  18  -3.618  -7.344   9.721
  117    H    TYR  19           H        TYR  19  -1.386  -8.526   4.113
  118    HA   TYR  19           HA       TYR  19  -4.338  -8.287   3.877
  119   1HB   TYR  19          1HB       TYR  19  -2.057  -8.163   1.909
  120   2HB   TYR  19          2HB       TYR  19  -3.732  -8.293   1.375
  121    HD1  TYR  19           HD1      TYR  19  -1.245  -6.162   3.057
  122    HD2  TYR  19           HD2      TYR  19  -5.319  -6.474   1.732
  123    HE1  TYR  19           HE1      TYR  19  -1.541  -3.722   3.396
  124    HE2  TYR  19           HE2      TYR  19  -5.617  -4.034   2.070
  125    HH   TYR  19           HH       TYR  19  -4.596  -2.233   3.412
  126    H    CYS  20           H        CYS  20  -1.813 -10.609   3.808
  127    HA   CYS  20           HA       CYS  20  -3.215 -12.575   2.179
  128   1HB   CYS  20          1HB       CYS  20  -1.071 -13.295   4.155
  129   2HB   CYS  20          2HB       CYS  20  -1.377 -13.967   2.555
  130    H    ASN  21           H        ASN  21  -3.196 -14.898   3.522
  131    HA   ASN  21           HA       ASN  21  -5.536 -15.004   5.001
  132   1HB   ASN  21          1HB       ASN  21  -4.243 -16.973   6.265
  133   2HB   ASN  21          2HB       ASN  21  -4.737 -17.131   4.580
  134   1HD2  ASN  21          1HD2      ASN  21  -2.133 -17.713   6.511
  135   2HD2  ASN  21          2HD2      ASN  21  -0.875 -17.471   5.397
  136   1H    PHE   1          1H        PHE   1  11.885  -3.109   3.753
  137   2H    PHE   1          2H        PHE   1  11.502  -2.140   5.094
  138   3H    PHE   1          3H        PHE   1  12.787  -3.246   5.184
  139    HA   PHE   1           HA       PHE   1  13.589  -0.971   4.915
  140   1HB   PHE   1          1HB       PHE   1  14.704  -1.542   2.524
  141   2HB   PHE   1          2HB       PHE   1  15.212  -2.325   4.019
  142    HD1  PHE   1           HD1      PHE   1  13.291  -2.711   0.896
  143    HD2  PHE   1           HD2      PHE   1  14.568  -4.624   4.526
  144    HE1  PHE   1           HE1      PHE   1  12.607  -4.913  -0.023
  145    HE2  PHE   1           HE2      PHE   1  13.884  -6.825   3.608
  146    HZ   PHE   1           HZ       PHE   1  12.904  -6.970   1.334
  147    H    VAL   2           H        VAL   2  14.065   0.576   2.909
  148    HA   VAL   2           HA       VAL   2  11.441   1.542   2.053
  149    HB   VAL   2           HB       VAL   2  13.487   2.956   2.719
  150   1HG1  VAL   2          1HG1      VAL   2  15.130   3.433   1.091
  151   2HG1  VAL   2          2HG1      VAL   2  14.185   2.679  -0.192
  152   3HG1  VAL   2          3HG1      VAL   2  14.956   1.679   1.040
  153   1HG2  VAL   2          1HG2      VAL   2  11.264   3.536   1.291
  154   2HG2  VAL   2          2HG2      VAL   2  12.514   3.997   0.135
  155   3HG2  VAL   2          3HG2      VAL   2  12.475   4.740   1.734
  156    H    ASN   3           H        ASN   3  11.544   2.401  -0.380
  157    HA   ASN   3           HA       ASN   3  12.776   1.178  -2.514
  158   1HB   ASN   3          1HB       ASN   3  11.229  -0.774  -1.028
  159   2HB   ASN   3          2HB       ASN   3  10.599  -0.609  -2.663
  160   1HD2  ASN   3          1HD2      ASN   3  13.275  -1.815  -0.775
  161   2HD2  ASN   3          2HD2      ASN   3  14.193  -2.396  -2.079
  162    H    GLN   4           H        GLN   4  10.602   0.425  -4.148
  163    HA   GLN   4           HA       GLN   4   9.433   3.046  -4.689
  164   1HB   GLN   4          1HB       GLN   4   9.213   0.319  -5.975
  165   2HB   GLN   4          2HB       GLN   4   8.205   1.665  -6.500
  166   1HG   GLN   4          1HG       GLN   4  10.111   2.974  -7.122
  167   2HG   GLN   4          2HG       GLN   4  11.217   1.858  -6.321
  168   1HE2  GLN   4          1HE2      GLN   4   8.475   0.712  -8.265
  169   2HE2  GLN   4          2HE2      GLN   4   9.414   0.069  -9.524
  170    H    HIS   5           H        HIS   5   6.833   2.350  -5.504
  171    HA   HIS   5           HA       HIS   5   5.478   0.989  -3.318
  172   1HB   HIS   5          1HB       HIS   5   6.110   3.587  -2.780
  173   2HB   HIS   5          2HB       HIS   5   4.523   3.776  -3.531
  174    HD2  HIS   5           HD2      HIS   5   3.727   4.372  -0.741
  175    HE1  HIS   5           HE1      HIS   5   3.670   0.273   0.285
  176    HE2  HIS   5           HE2      HIS   5   3.004   2.619   1.035
  177    H    LEU   6           H        LEU   6   2.983   1.391  -3.591
  178    HA   LEU   6           HA       LEU   6   2.325   1.831  -6.459
  179   1HB   LEU   6          1HB       LEU   6   0.900  -0.452  -5.270
  180   2HB   LEU   6          2HB       LEU   6   1.656  -0.305  -6.851
  181    HG   LEU   6           HG       LEU   6   3.884  -0.394  -5.355
  182   1HD1  LEU   6          1HD1      LEU   6   1.752  -1.168  -3.558
  183   2HD1  LEU   6          2HD1      LEU   6   3.462  -0.924  -3.212
  184   3HD1  LEU   6          3HD1      LEU   6   2.892  -2.493  -3.781
  185   1HD2  LEU   6          1HD2      LEU   6   4.197  -2.380  -6.380
  186   2HD2  LEU   6          2HD2      LEU   6   2.632  -2.053  -7.122
  187   3HD2  LEU   6          3HD2      LEU   6   2.731  -3.073  -5.688
  188    H    CYS   7           H        CYS   7  -0.299   1.555  -6.581
  189    HA   CYS   7           HA       CYS   7  -1.552   2.622  -4.123
  190   1HB   CYS   7          1HB       CYS   7  -1.829   4.176  -6.696
  191   2HB   CYS   7          2HB       CYS   7  -2.268   4.676  -5.065
  192    H    GLY   8           H        GLY   8  -1.764   0.396  -6.414
  193   1HA   GLY   8          1HA       GLY   8  -4.541  -0.099  -6.067
  194   2HA   GLY   8          2HA       GLY   8  -4.338   0.744  -7.603
  195    H    SER   9           H        SER   9  -4.311  -0.685  -9.258
  196    HA   SER   9           HA       SER   9  -4.094  -3.435  -9.178
  197   1HB   SER   9          1HB       SER   9  -4.509  -1.934 -11.222
  198   2HB   SER   9          2HB       SER   9  -2.756  -1.841 -11.372
  199    HG   SER   9           HG       SER   9  -4.305  -3.723 -12.280
  200    H    ASP  10           H        ASP  10  -1.366  -1.151  -9.508
  201    HA   ASP  10           HA       ASP  10   0.683  -3.132  -9.575
  202   1HB   ASP  10          1HB       ASP  10   0.722  -0.273  -8.569
  203   2HB   ASP  10          2HB       ASP  10   2.168  -1.267  -8.749
  204    H    LEU  11           H        LEU  11  -1.077  -1.635  -6.946
  205    HA   LEU  11           HA       LEU  11   0.568  -2.487  -4.781
  206   1HB   LEU  11          1HB       LEU  11  -1.985  -1.244  -5.101
  207   2HB   LEU  11          2HB       LEU  11  -2.187  -2.606  -4.001
  208    HG   LEU  11           HG       LEU  11   0.012  -0.551  -3.694
  209   1HD1  LEU  11          1HD1      LEU  11  -2.117   0.597  -3.468
  210   2HD1  LEU  11          2HD1      LEU  11  -1.418   0.375  -1.865
  211   3HD1  LEU  11          3HD1      LEU  11  -2.728  -0.673  -2.408
  212   1HD2  LEU  11          1HD2      LEU  11   0.167  -2.897  -2.652
  213   2HD2  LEU  11          2HD2      LEU  11  -1.185  -2.405  -1.631
  214   3HD2  LEU  11          3HD2      LEU  11   0.344  -1.531  -1.550
  215    H    VAL  12           H        VAL  12  -1.842  -4.159  -6.691
  216    HA   VAL  12           HA       VAL  12  -1.960  -6.460  -4.914
  217    HB   VAL  12           HB       VAL  12  -3.449  -7.407  -6.464
  218   1HG1  VAL  12          1HG1      VAL  12  -3.987  -4.971  -5.634
  219   2HG1  VAL  12          2HG1      VAL  12  -5.008  -5.719  -6.861
  220   3HG1  VAL  12          3HG1      VAL  12  -3.773  -4.552  -7.334
  221   1HG2  VAL  12          1HG2      VAL  12  -2.575  -7.650  -8.550
  222   2HG2  VAL  12          2HG2      VAL  12  -1.624  -6.172  -8.416
  223   3HG2  VAL  12          3HG2      VAL  12  -3.320  -6.087  -8.886
  224    H    GLU  13           H        GLU  13   0.032  -5.416  -7.552
  225    HA   GLU  13           HA       GLU  13   1.171  -7.955  -8.247
  226   1HB   GLU  13          1HB       GLU  13   1.453  -5.773  -9.531
  227   2HB   GLU  13          2HB       GLU  13   2.596  -5.276  -8.283
  228   1HG   GLU  13          1HG       GLU  13   3.518  -7.783  -8.894
  229   2HG   GLU  13          2HG       GLU  13   2.929  -7.235 -10.464
  230    H    ALA  14           H        ALA  14   1.724  -5.624  -5.689
  231    HA   ALA  14           HA       ALA  14   4.083  -7.070  -4.681
  232   1HB   ALA  14          1HB       ALA  14   3.850  -5.388  -2.781
  233   2HB   ALA  14          2HB       ALA  14   2.512  -4.681  -3.687
  234   3HB   ALA  14          3HB       ALA  14   4.135  -4.691  -4.376
  235    H    LEU  15           H        LEU  15   0.674  -7.237  -4.395
  236    HA   LEU  15           HA       LEU  15   0.728  -8.456  -1.710
  237   1HB   LEU  15          1HB       LEU  15  -1.392  -7.730  -3.697
  238   2HB   LEU  15          2HB       LEU  15  -1.758  -8.971  -2.501
  239    HG   LEU  15           HG       LEU  15  -0.514  -6.387  -1.613
  240   1HD1  LEU  15          1HD1      LEU  15  -3.474  -6.856  -2.097
  241   2HD1  LEU  15          2HD1      LEU  15  -2.451  -5.760  -3.025
  242   3HD1  LEU  15          3HD1      LEU  15  -2.770  -5.437  -1.320
  243   1HD2  LEU  15          1HD2      LEU  15  -2.677  -7.815  -0.149
  244   2HD2  LEU  15          2HD2      LEU  15  -1.200  -7.076   0.469
  245   3HD2  LEU  15          3HD2      LEU  15  -1.139  -8.664  -0.295
  246    H    TYR  16           H        TYR  16   0.439  -9.343  -5.070
  247    HA   TYR  16           HA       TYR  16  -0.088 -12.152  -4.617
  248   1HB   TYR  16          1HB       TYR  16  -0.714 -11.461  -6.758
  249   2HB   TYR  16          2HB       TYR  16   0.702 -10.432  -6.950
  250    HD1  TYR  16           HD1      TYR  16  -0.169 -14.062  -6.494
  251    HD2  TYR  16           HD2      TYR  16   2.445 -11.176  -8.313
  252    HE1  TYR  16           HE1      TYR  16   1.012 -15.885  -7.694
  253    HE2  TYR  16           HE2      TYR  16   3.625 -12.999  -9.514
  254    HH   TYR  16           HH       TYR  16   2.638 -15.680 -10.209
  255    H    LEU  17           H        LEU  17   2.754 -10.124  -4.820
  256    HA   LEU  17           HA       LEU  17   4.581 -12.425  -4.970
  257   1HB   LEU  17          1HB       LEU  17   5.299 -10.476  -6.160
  258   2HB   LEU  17          2HB       LEU  17   4.994  -9.435  -4.768
  259    HG   LEU  17           HG       LEU  17   6.759 -10.656  -3.508
  260   1HD1  LEU  17          1HD1      LEU  17   8.244 -12.185  -4.737
  261   2HD1  LEU  17          2HD1      LEU  17   7.261 -11.992  -6.188
  262   3HD1  LEU  17          3HD1      LEU  17   6.586 -12.786  -4.765
  263   1HD2  LEU  17          1HD2      LEU  17   8.630  -9.942  -5.339
  264   2HD2  LEU  17          2HD2      LEU  17   7.755  -8.772  -4.352
  265   3HD2  LEU  17          3HD2      LEU  17   7.223  -9.107  -6.000
  266    H    VAL  18           H        VAL  18   3.024 -10.544  -2.561
  267    HA   VAL  18           HA       VAL  18   5.016 -11.208  -0.485
  268    HB   VAL  18           HB       VAL  18   2.490  -9.572  -0.549
  269   1HG1  VAL  18          1HG1      VAL  18   2.983  -9.191   1.952
  270   2HG1  VAL  18          2HG1      VAL  18   3.925 -10.681   1.873
  271   3HG1  VAL  18          3HG1      VAL  18   2.197 -10.710   1.521
  272   1HG2  VAL  18          1HG2      VAL  18   5.190  -9.029  -0.847
  273   2HG2  VAL  18          2HG2      VAL  18   4.855  -8.574   0.823
  274   3HG2  VAL  18          3HG2      VAL  18   3.930  -7.848  -0.492
  275    H    CYS  19           H        CYS  19   1.565 -11.726  -1.032
  276    HA   CYS  19           HA       CYS  19   1.352 -13.643   1.074
  277   1HB   CYS  19          1HB       CYS  19  -0.473 -13.253  -1.313
  278   2HB   CYS  19          2HB       CYS  19  -0.890 -14.090   0.183
  279    H    GLY  20           H        GLY  20   1.545 -14.014  -2.478
  280   1HA   GLY  20          1HA       GLY  20   2.130 -15.883  -3.773
  281   2HA   GLY  20          2HA       GLY  20   3.137 -16.356  -2.403
  282    H    GLU  21           H        GLU  21   2.584 -18.260  -1.468
  283    HA   GLU  21           HA       GLU  21  -0.234 -19.203  -1.826
  284   1HB   GLU  21          1HB       GLU  21   2.042 -20.465  -2.673
  285   2HB   GLU  21          2HB       GLU  21   1.827 -21.187  -1.078
  286   1HG   GLU  21          1HG       GLU  21  -0.662 -21.474  -1.808
  287   2HG   GLU  21          2HG       GLU  21  -0.034 -21.255  -3.442
  288    H    ARG  22           H        ARG  22  -1.330 -18.900   0.026
  289    HA   ARG  22           HA       ARG  22  -0.784 -20.177   2.472
  290   1HB   ARG  22          1HB       ARG  22   0.689 -17.660   2.089
  291   2HB   ARG  22          2HB       ARG  22  -0.298 -17.673   3.549
  292   1HG   ARG  22          1HG       ARG  22   0.866 -19.454   4.488
  293   2HG   ARG  22          2HG       ARG  22   1.408 -20.061   2.924
  294   1HD   ARG  22          1HD       ARG  22   3.371 -19.030   3.402
  295   2HD   ARG  22          2HD       ARG  22   2.524 -17.536   3.004
  296    HE   ARG  22           HE       ARG  22   2.243 -17.112   5.366
  297   1HH1  ARG  22          1HH1      ARG  22   1.923 -19.886   6.383
  298   2HH1  ARG  22          2HH1      ARG  22   3.431 -20.169   7.188
  299   1HH2  ARG  22          1HH2      ARG  22   5.056 -17.530   5.632
  300   2HH2  ARG  22          2HH2      ARG  22   5.206 -18.833   6.764
  301    H    GLY  23           H        GLY  23  -2.046 -17.329   0.859
  302   1HA   GLY  23          1HA       GLY  23  -4.721 -17.611   1.278
  303   2HA   GLY  23          2HA       GLY  23  -4.187 -16.930   2.817
  304    H    PHE  24           H        PHE  24  -5.917 -15.507   1.045
  305    HA   PHE  24           HA       PHE  24  -4.443 -13.037   0.838
  306   1HB   PHE  24          1HB       PHE  24  -3.589 -14.318  -1.160
  307   2HB   PHE  24          2HB       PHE  24  -5.235 -14.337  -1.785
  308    HD1  PHE  24           HD1      PHE  24  -4.378 -11.374   0.118
  309    HD2  PHE  24           HD2      PHE  24  -4.214 -13.154  -3.793
  310    HE1  PHE  24           HE1      PHE  24  -4.016  -9.139  -0.888
  311    HE2  PHE  24           HE2      PHE  24  -3.853 -10.916  -4.796
  312    HZ   PHE  24           HZ       PHE  24  -3.754  -8.907  -3.343
  313    H    PHE  25           H        PHE  25  -6.064 -11.700   1.525
  314    HA   PHE  25           HA       PHE  25  -8.825 -12.195   0.486
  315   1HB   PHE  25          1HB       PHE  25  -7.769 -10.976   3.032
  316   2HB   PHE  25          2HB       PHE  25  -9.400 -10.610   2.476
  317    HD1  PHE  25           HD1      PHE  25  -8.498 -13.827   1.307
  318    HD2  PHE  25           HD2      PHE  25  -9.787 -11.761   4.852
  319    HE1  PHE  25           HE1      PHE  25  -9.313 -15.967   2.261
  320    HE2  PHE  25           HE2      PHE  25 -10.599 -13.904   5.804
  321    HZ   PHE  25           HZ       PHE  25 -10.363 -16.005   4.506
  322    H    TYR  26           H        TYR  26  -8.432 -11.020  -1.500
  323    HA   TYR  26           HA       TYR  26  -8.451  -8.064  -1.088
  324   1HB   TYR  26          1HB       TYR  26  -6.183  -8.729  -1.819
  325   2HB   TYR  26          2HB       TYR  26  -6.877  -9.534  -3.226
  326    HD1  TYR  26           HD1      TYR  26  -6.511  -6.228  -1.545
  327    HD2  TYR  26           HD2      TYR  26  -7.499  -8.310  -5.174
  328    HE1  TYR  26           HE1      TYR  26  -6.519  -4.075  -2.779
  329    HE2  TYR  26           HE2      TYR  26  -7.506  -6.154  -6.407
  330    HH   TYR  26           HH       TYR  26  -7.661  -3.842  -6.065
  331    H    THR  27           H        THR  27 -10.282  -7.263  -1.988
  332    HA   THR  27           HA       THR  27 -11.574  -8.835  -4.173
  333    HB   THR  27           HB       THR  27 -13.083  -8.559  -2.335
  334    HG1  THR  27           HG1      THR  27 -14.678  -7.621  -3.404
  335   1HG2  THR  27          1HG2      THR  27 -13.451  -5.854  -1.898
  336   2HG2  THR  27          2HG2      THR  27 -11.704  -5.986  -2.100
  337   3HG2  THR  27          3HG2      THR  27 -12.524  -6.939  -0.862
  338    H    LYS  28           H        LYS  28 -13.105  -6.982  -5.408
  339    HA   LYS  28           HA       LYS  28 -12.246  -4.424  -5.924
  340   1HB   LYS  28          1HB       LYS  28 -10.003  -5.040  -6.380
  341   2HB   LYS  28          2HB       LYS  28 -10.485  -6.410  -7.369
  342   1HG   LYS  28          1HG       LYS  28 -11.659  -4.508  -8.821
  343   2HG   LYS  28          2HG       LYS  28 -10.448  -3.494  -8.040
  344   1HD   LYS  28          1HD       LYS  28  -8.797  -5.415  -8.742
  345   2HD   LYS  28          2HD       LYS  28 -10.056  -5.804  -9.915
  346   1HE   LYS  28          1HE       LYS  28  -8.920  -3.017  -9.593
  347   2HE   LYS  28          2HE       LYS  28  -8.270  -4.192 -10.737
  348   1HZ   LYS  28          1HZ       LYS  28 -11.020  -4.189 -11.072
  349   2HZ   LYS  28          2HZ       LYS  28  -9.846  -3.583 -12.142
  350   3HZ   LYS  28          3HZ       LYS  28 -10.558  -2.559 -10.988
  351    HA   PRO  29           HA       PRO  29 -14.394  -6.104  -9.851
  352   1HB   PRO  29          1HB       PRO  29 -14.867  -8.805  -9.999
  353   2HB   PRO  29          2HB       PRO  29 -13.414  -8.030 -10.649
  354   1HG   PRO  29          1HG       PRO  29 -13.720  -9.662  -8.170
  355   2HG   PRO  29          2HG       PRO  29 -12.296  -9.444  -9.201
  356   1HD   PRO  29          1HD       PRO  29 -12.732  -8.167  -6.734
  357   2HD   PRO  29          2HD       PRO  29 -11.541  -7.682  -7.953
  358    H    THR  30           H        THR  30 -15.680  -8.967  -8.354
  359    HA   THR  30           HA       THR  30 -17.902  -9.378  -7.662
  360    HB   THR  30           HB       THR  30 -17.941  -7.069  -5.860
  361    HG1  THR  30           HG1      THR  30 -16.046  -8.330  -4.770
  362   1HG2  THR  30          1HG2      THR  30 -17.616  -9.364  -4.377
  363   2HG2  THR  30          2HG2      THR  30 -18.349  -9.979  -5.857
  364   3HG2  THR  30          3HG2      THR  30 -19.167  -8.727  -4.923
  Start of MODEL   17
    1   1H    GLY   1          1H        GLY   1 -10.370   3.365   7.877
    2   2H    GLY   1          2H        GLY   1  -9.601   4.771   7.313
    3   3H    GLY   1          3H        GLY   1  -8.785   3.282   7.275
    4   1HA   GLY   1          1HA       GLY   1  -9.707   2.837   5.286
    5   2HA   GLY   1          2HA       GLY   1 -11.363   3.138   5.891
    6    H    GLY   2           H        GLY   2  -8.091   4.753   5.451
    7   1HA   GLY   2          1HA       GLY   2  -8.889   6.733   3.590
    8   2HA   GLY   2          2HA       GLY   2  -7.227   6.175   3.794
    9    H    GLY   3           H        GLY   3  -7.904   3.386   3.092
   10   1HA   GLY   3          1HA       GLY   3  -8.652   2.148   1.134
   11   2HA   GLY   3          2HA       GLY   3  -8.703   3.667   0.237
   12    H    GLU   4           H        GLU   4  -6.472   4.775   0.055
   13    HA   GLU   4           HA       GLU   4  -4.596   2.786  -1.007
   14   1HB   GLU   4          1HB       GLU   4  -3.238   4.882  -1.548
   15   2HB   GLU   4          2HB       GLU   4  -4.825   4.780  -2.313
   16   1HG   GLU   4          1HG       GLU   4  -5.554   6.626  -1.240
   17   2HG   GLU   4          2HG       GLU   4  -4.989   6.020   0.317
   18    H    GLN   5           H        GLN   5  -4.060   1.742   1.042
   19    HA   GLN   5           HA       GLN   5  -2.666   3.358   3.071
   20   1HB   GLN   5          1HB       GLN   5  -4.205   1.154   3.306
   21   2HB   GLN   5          2HB       GLN   5  -2.620   0.388   3.203
   22   1HG   GLN   5          1HG       GLN   5  -1.845   2.007   5.003
   23   2HG   GLN   5          2HG       GLN   5  -3.538   2.461   5.208
   24   1HE2  GLN   5          1HE2      GLN   5  -1.410   0.701   6.815
   25   2HE2  GLN   5          2HE2      GLN   5  -2.343  -0.640   7.274
   26    H    CYS   6           H        CYS   6  -1.855   1.594   0.249
   27    HA   CYS   6           HA       CYS   6   1.021   1.745   1.041
   28   1HB   CYS   6          1HB       CYS   6  -0.360  -0.505  -0.445
   29   2HB   CYS   6          2HB       CYS   6   1.389  -0.341  -0.307
   30    H    CYS   7           H        CYS   7  -0.252   3.779  -0.391
   31    HA   CYS   7           HA       CYS   7   0.806   3.330  -3.148
   32   1HB   CYS   7          1HB       CYS   7  -1.595   3.664  -3.240
   33   2HB   CYS   7          2HB       CYS   7  -1.480   5.088  -2.206
   34    H    THR   8           H        THR   8   0.165   5.971  -0.798
   35    HA   THR   8           HA       THR   8   2.411   7.483  -2.001
   36    HB   THR   8           HB       THR   8   0.817   9.077  -1.572
   37    HG1  THR   8           HG1      THR   8   2.300   9.931  -0.298
   38   1HG2  THR   8          1HG2      THR   8  -0.641   8.882   0.583
   39   2HG2  THR   8          2HG2      THR   8  -0.084   7.210   0.607
   40   3HG2  THR   8          3HG2      THR   8  -0.990   7.817  -0.778
   41    H    SER   9           H        SER   9   1.442   6.364   1.268
   42    HA   SER   9           HA       SER   9   3.996   6.996   2.441
   43   1HB   SER   9          1HB       SER   9   1.583   6.298   3.471
   44   2HB   SER   9          2HB       SER   9   2.431   4.760   3.605
   45    HG   SER   9           HG       SER   9   3.548   7.224   4.448
   46    H    ILE  10           H        ILE  10   4.591   4.480   3.741
   47    HA   ILE  10           HA       ILE  10   5.281   2.703   1.463
   48    HB   ILE  10           HB       ILE  10   7.317   3.698   3.478
   49   1HG1  ILE  10          1HG1      ILE  10   7.039   4.278   0.509
   50   2HG1  ILE  10          2HG1      ILE  10   6.645   5.414   1.798
   51   1HG2  ILE  10          1HG2      ILE  10   7.615   1.955   1.009
   52   2HG2  ILE  10          2HG2      ILE  10   7.649   1.366   2.671
   53   3HG2  ILE  10          3HG2      ILE  10   8.914   2.451   2.094
   54   1HD1  ILE  10          1HD1      ILE  10   9.146   5.085   0.593
   55   2HD1  ILE  10          2HD1      ILE  10   9.304   4.282   2.155
   56   3HD1  ILE  10          3HD1      ILE  10   8.812   5.974   2.078
   57    H    CYS  11           H        CYS  11   3.802   1.186   2.358
   58    HA   CYS  11           HA       CYS  11   3.753   0.329   5.078
   59   1HB   CYS  11          1HB       CYS  11   3.210  -1.486   2.730
   60   2HB   CYS  11          2HB       CYS  11   2.462  -1.513   4.327
   61    H    SER  12           H        SER  12   4.132  -2.509   4.653
   62    HA   SER  12           HA       SER  12   7.022  -2.779   4.061
   63   1HB   SER  12          1HB       SER  12   7.239  -2.416   6.391
   64   2HB   SER  12          2HB       SER  12   5.789  -3.323   6.750
   65    HG   SER  12           HG       SER  12   7.781  -4.460   7.143
   66    H    LEU  13           H        LEU  13   7.631  -5.081   4.171
   67    HA   LEU  13           HA       LEU  13   5.652  -6.648   2.799
   68   1HB   LEU  13          1HB       LEU  13   7.388  -8.596   3.561
   69   2HB   LEU  13          2HB       LEU  13   7.619  -7.596   2.137
   70    HG   LEU  13           HG       LEU  13   9.620  -7.861   3.705
   71   1HD1  LEU  13          1HD1      LEU  13   8.567  -5.494   2.378
   72   2HD1  LEU  13          2HD1      LEU  13  10.207  -6.142   2.385
   73   3HD1  LEU  13          3HD1      LEU  13   9.672  -5.080   3.687
   74   1HD2  LEU  13          1HD2      LEU  13   7.683  -6.613   5.518
   75   2HD2  LEU  13          2HD2      LEU  13   9.227  -5.774   5.472
   76   3HD2  LEU  13          3HD2      LEU  13   9.164  -7.487   5.887
   77    H    TYR  14           H        TYR  14   6.047  -5.856   6.011
   78    HA   TYR  14           HA       TYR  14   4.723  -8.347   6.953
   79   1HB   TYR  14          1HB       TYR  14   6.454  -6.319   8.082
   80   2HB   TYR  14          2HB       TYR  14   5.024  -6.574   9.077
   81    HD1  TYR  14           HD1      TYR  14   6.834  -8.992   6.882
   82    HD2  TYR  14           HD2      TYR  14   5.807  -7.874  10.902
   83    HE1  TYR  14           HE1      TYR  14   7.807 -11.115   7.723
   84    HE2  TYR  14           HE2      TYR  14   6.781  -9.998  11.744
   85    HH   TYR  14           HH       TYR  14   8.535 -11.660  10.938
   86    H    GLN  15           H        GLN  15   4.375  -4.853   6.891
   87    HA   GLN  15           HA       GLN  15   1.697  -4.875   8.000
   88   1HB   GLN  15          1HB       GLN  15   3.380  -2.795   6.606
   89   2HB   GLN  15          2HB       GLN  15   1.683  -2.482   6.977
   90   1HG   GLN  15          1HG       GLN  15   2.064  -2.334   9.224
   91   2HG   GLN  15          2HG       GLN  15   3.281  -3.610   9.201
   92   1HE2  GLN  15          1HE2      GLN  15   2.784  -0.135   8.856
   93   2HE2  GLN  15          2HE2      GLN  15   4.429   0.279   8.816
   94    H    LEU  16           H        LEU  16   3.113  -5.087   4.817
   95    HA   LEU  16           HA       LEU  16   0.487  -4.792   3.535
   96   1HB   LEU  16          1HB       LEU  16   1.734  -4.298   1.738
   97   2HB   LEU  16          2HB       LEU  16   3.161  -4.482   2.731
   98    HG   LEU  16           HG       LEU  16   3.401  -5.805   0.751
   99   1HD1  LEU  16          1HD1      LEU  16   2.818  -8.092   2.448
  100   2HD1  LEU  16          2HD1      LEU  16   3.671  -6.815   3.312
  101   3HD1  LEU  16          3HD1      LEU  16   4.362  -7.504   1.845
  102   1HD2  LEU  16          1HD2      LEU  16   1.776  -7.118  -0.181
  103   2HD2  LEU  16          2HD2      LEU  16   0.717  -6.046   0.735
  104   3HD2  LEU  16          3HD2      LEU  16   1.145  -7.625   1.383
  105    H    GLU  17           H        GLU  17   2.600  -7.255   4.774
  106    HA   GLU  17           HA       GLU  17   1.407  -9.549   3.509
  107   1HB   GLU  17          1HB       GLU  17   3.339  -9.063   5.562
  108   2HB   GLU  17          2HB       GLU  17   2.128 -10.153   6.220
  109   1HG   GLU  17          1HG       GLU  17   3.534 -10.574   3.570
  110   2HG   GLU  17          2HG       GLU  17   3.991 -11.362   5.079
  111    H    ASN  18           H        ASN  18   0.389  -7.358   5.970
  112    HA   ASN  18           HA       ASN  18  -1.390  -8.941   7.464
  113   1HB   ASN  18          1HB       ASN  18  -0.727  -6.423   7.708
  114   2HB   ASN  18          2HB       ASN  18  -2.124  -6.137   6.669
  115   1HD2  ASN  18          1HD2      ASN  18  -1.930  -5.367   9.507
  116   2HD2  ASN  18          2HD2      ASN  18  -3.153  -6.213  10.324
  117    H    TYR  19           H        TYR  19  -1.556  -8.027   4.166
  118    HA   TYR  19           HA       TYR  19  -4.464  -8.283   3.953
  119   1HB   TYR  19          1HB       TYR  19  -2.236  -7.979   1.941
  120   2HB   TYR  19          2HB       TYR  19  -3.907  -8.252   1.448
  121    HD1  TYR  19           HD1      TYR  19  -1.553  -5.763   2.018
  122    HD2  TYR  19           HD2      TYR  19  -5.653  -6.721   2.877
  123    HE1  TYR  19           HE1      TYR  19  -2.044  -3.354   2.354
  124    HE2  TYR  19           HE2      TYR  19  -6.146  -4.309   3.214
  125    HH   TYR  19           HH       TYR  19  -4.889  -2.024   2.231
  126    H    CYS  20           H        CYS  20  -1.668 -10.338   3.581
  127    HA   CYS  20           HA       CYS  20  -3.171 -12.454   2.232
  128   1HB   CYS  20          1HB       CYS  20  -0.547 -12.914   3.620
  129   2HB   CYS  20          2HB       CYS  20  -1.165 -13.649   2.143
  130    H    ASN  21           H        ASN  21  -2.561 -14.748   3.450
  131    HA   ASN  21           HA       ASN  21  -4.448 -15.186   5.415
  132   1HB   ASN  21          1HB       ASN  21  -2.718 -16.820   4.279
  133   2HB   ASN  21          2HB       ASN  21  -1.780 -16.524   5.742
  134   1HD2  ASN  21          1HD2      ASN  21  -3.423 -16.583   7.825
  135   2HD2  ASN  21          2HD2      ASN  21  -4.404 -17.967   7.865
  136   1H    PHE   1          1H        PHE   1  15.916  -3.523   0.928
  137   2H    PHE   1          2H        PHE   1  15.403  -5.121   1.191
  138   3H    PHE   1          3H        PHE   1  14.951  -3.891   2.272
  139    HA   PHE   1           HA       PHE   1  13.776  -4.664  -0.241
  140   1HB   PHE   1          1HB       PHE   1  12.867  -3.033   2.151
  141   2HB   PHE   1          2HB       PHE   1  11.821  -3.533   0.820
  142    HD1  PHE   1           HD1      PHE   1  12.317  -4.306   4.040
  143    HD2  PHE   1           HD2      PHE   1  12.623  -6.233   0.213
  144    HE1  PHE   1           HE1      PHE   1  11.976  -6.511   5.125
  145    HE2  PHE   1           HE2      PHE   1  12.282  -8.440   1.296
  146    HZ   PHE   1           HZ       PHE   1  11.958  -8.578   3.752
  147    H    VAL   2           H        VAL   2  12.310  -1.840   0.269
  148    HA   VAL   2           HA       VAL   2  14.292  -0.107  -1.061
  149    HB   VAL   2           HB       VAL   2  11.706  -0.178  -2.474
  150   1HG1  VAL   2          1HG1      VAL   2  13.058   0.392  -4.310
  151   2HG1  VAL   2          2HG1      VAL   2  14.493  -0.345  -3.598
  152   3HG1  VAL   2          3HG1      VAL   2  13.861   1.167  -2.944
  153   1HG2  VAL   2          1HG2      VAL   2  12.202  -2.141  -3.760
  154   2HG2  VAL   2          2HG2      VAL   2  12.219  -2.600  -2.057
  155   3HG2  VAL   2          3HG2      VAL   2  13.738  -2.364  -2.925
  156    H    ASN   3           H        ASN   3  12.220   1.583  -2.083
  157    HA   ASN   3           HA       ASN   3  10.727   2.459   0.310
  158   1HB   ASN   3          1HB       ASN   3  13.055   3.894  -0.866
  159   2HB   ASN   3          2HB       ASN   3  11.671   4.877  -0.386
  160   1HD2  ASN   3          1HD2      ASN   3  13.966   2.425   0.876
  161   2HD2  ASN   3          2HD2      ASN   3  13.822   2.899   2.500
  162    H    GLN   4           H        GLN   4   9.445   1.426  -1.767
  163    HA   GLN   4           HA       GLN   4   8.018   3.736  -2.897
  164   1HB   GLN   4          1HB       GLN   4   9.989   3.048  -4.465
  165   2HB   GLN   4          2HB       GLN   4   8.983   1.650  -4.843
  166   1HG   GLN   4          1HG       GLN   4   7.187   3.053  -5.621
  167   2HG   GLN   4          2HG       GLN   4   7.991   4.505  -5.023
  168   1HE2  GLN   4          1HE2      GLN   4   9.743   1.885  -6.658
  169   2HE2  GLN   4          2HE2      GLN   4  10.125   2.776  -8.050
  170    H    HIS   5           H        HIS   5   5.879   3.151  -3.544
  171    HA   HIS   5           HA       HIS   5   5.175   0.286  -3.112
  172   1HB   HIS   5          1HB       HIS   5   4.435   2.518  -1.485
  173   2HB   HIS   5          2HB       HIS   5   2.990   1.901  -2.283
  174    HD2  HIS   5           HD2      HIS   5   5.200   1.015   0.688
  175    HE1  HIS   5           HE1      HIS   5   3.074  -2.508  -0.279
  176    HE2  HIS   5           HE2      HIS   5   4.567  -1.388   1.459
  177    H    LEU   6           H        LEU   6   2.518   0.329  -3.687
  178    HA   LEU   6           HA       LEU   6   2.339   1.600  -6.387
  179   1HB   LEU   6          1HB       LEU   6   0.865  -0.931  -6.130
  180   2HB   LEU   6          2HB       LEU   6   1.889  -0.360  -7.440
  181    HG   LEU   6           HG       LEU   6   2.907  -2.338  -6.524
  182   1HD1  LEU   6          1HD1      LEU   6   4.920  -1.383  -6.723
  183   2HD1  LEU   6          2HD1      LEU   6   4.771  -0.686  -5.110
  184   3HD1  LEU   6          3HD1      LEU   6   4.171   0.200  -6.513
  185   1HD2  LEU   6          1HD2      LEU   6   2.896  -2.894  -4.331
  186   2HD2  LEU   6          2HD2      LEU   6   1.724  -1.589  -4.148
  187   3HD2  LEU   6          3HD2      LEU   6   3.433  -1.292  -3.831
  188    H    CYS   7           H        CYS   7  -0.177   1.197  -7.112
  189    HA   CYS   7           HA       CYS   7  -1.920   1.690  -4.747
  190   1HB   CYS   7          1HB       CYS   7  -2.275   3.478  -7.126
  191   2HB   CYS   7          2HB       CYS   7  -2.660   3.776  -5.433
  192    H    GLY   8           H        GLY   8  -3.472   0.121  -5.007
  193   1HA   GLY   8          1HA       GLY   8  -5.388  -0.847  -6.019
  194   2HA   GLY   8          2HA       GLY   8  -5.055   0.090  -7.474
  195    H    SER   9           H        SER   9  -4.955  -1.416  -9.078
  196    HA   SER   9           HA       SER   9  -4.336  -4.092  -9.009
  197   1HB   SER   9          1HB       SER   9  -2.985  -2.993 -11.297
  198   2HB   SER   9          2HB       SER   9  -4.517  -3.856 -11.235
  199    HG   SER   9           HG       SER   9  -5.581  -1.976 -11.026
  200    H    ASP  10           H        ASP  10  -1.831  -1.646  -9.809
  201    HA   ASP  10           HA       ASP  10   0.406  -3.284  -9.692
  202   1HB   ASP  10          1HB       ASP  10   0.331  -0.533  -8.436
  203   2HB   ASP  10          2HB       ASP  10   1.705  -1.323  -9.211
  204    H    LEU  11           H        LEU  11  -1.434  -1.949  -7.019
  205    HA   LEU  11           HA       LEU  11   0.332  -2.692  -4.907
  206   1HB   LEU  11          1HB       LEU  11  -2.298  -1.603  -5.147
  207   2HB   LEU  11          2HB       LEU  11  -2.379  -2.967  -4.033
  208    HG   LEU  11           HG       LEU  11  -0.480  -0.610  -3.854
  209   1HD1  LEU  11          1HD1      LEU  11  -1.984  -0.985  -1.493
  210   2HD1  LEU  11          2HD1      LEU  11  -3.130  -1.131  -2.826
  211   3HD1  LEU  11          3HD1      LEU  11  -2.146   0.324  -2.663
  212   1HD2  LEU  11          1HD2      LEU  11   0.820  -1.879  -2.524
  213   2HD2  LEU  11          2HD2      LEU  11  -0.180  -3.277  -2.923
  214   3HD2  LEU  11          3HD2      LEU  11  -0.569  -2.284  -1.516
  215    H    VAL  12           H        VAL  12  -1.874  -4.531  -6.861
  216    HA   VAL  12           HA       VAL  12  -1.936  -6.826  -5.065
  217    HB   VAL  12           HB       VAL  12  -3.238  -7.907  -6.709
  218   1HG1  VAL  12          1HG1      VAL  12  -4.867  -6.264  -7.415
  219   2HG1  VAL  12          2HG1      VAL  12  -3.679  -4.966  -7.293
  220   3HG1  VAL  12          3HG1      VAL  12  -4.253  -5.776  -5.834
  221   1HG2  VAL  12          1HG2      VAL  12  -2.219  -8.008  -8.744
  222   2HG2  VAL  12          2HG2      VAL  12  -1.480  -6.419  -8.557
  223   3HG2  VAL  12          3HG2      VAL  12  -3.152  -6.553  -9.098
  224    H    GLU  13           H        GLU  13   0.059  -5.703  -7.691
  225    HA   GLU  13           HA       GLU  13   1.427  -8.152  -8.254
  226   1HB   GLU  13          1HB       GLU  13   1.614  -6.016  -9.600
  227   2HB   GLU  13          2HB       GLU  13   2.613  -5.357  -8.305
  228   1HG   GLU  13          1HG       GLU  13   3.500  -8.014  -9.141
  229   2HG   GLU  13          2HG       GLU  13   3.531  -6.849 -10.465
  230    H    ALA  14           H        ALA  14   1.737  -5.700  -5.755
  231    HA   ALA  14           HA       ALA  14   4.140  -6.935  -4.608
  232   1HB   ALA  14          1HB       ALA  14   3.518  -5.261  -2.699
  233   2HB   ALA  14          2HB       ALA  14   2.367  -4.617  -3.870
  234   3HB   ALA  14          3HB       ALA  14   4.093  -4.614  -4.237
  235    H    LEU  15           H        LEU  15   0.728  -7.334  -4.417
  236    HA   LEU  15           HA       LEU  15   0.901  -8.654  -1.769
  237   1HB   LEU  15          1HB       LEU  15  -1.356  -7.837  -3.584
  238   2HB   LEU  15          2HB       LEU  15  -1.631  -9.045  -2.328
  239    HG   LEU  15           HG       LEU  15  -0.225  -6.502  -1.596
  240   1HD1  LEU  15          1HD1      LEU  15  -2.550  -5.587  -1.043
  241   2HD1  LEU  15          2HD1      LEU  15  -3.188  -6.832  -2.117
  242   3HD1  LEU  15          3HD1      LEU  15  -2.107  -5.591  -2.750
  243   1HD2  LEU  15          1HD2      LEU  15  -0.747  -8.647  -0.139
  244   2HD2  LEU  15          2HD2      LEU  15  -2.351  -7.922  -0.022
  245   3HD2  LEU  15          3HD2      LEU  15  -0.940  -7.038   0.558
  246    H    TYR  16           H        TYR  16   0.830  -9.342  -5.140
  247    HA   TYR  16           HA       TYR  16   0.042 -12.139  -4.876
  248   1HB   TYR  16          1HB       TYR  16  -0.438 -11.508  -7.028
  249   2HB   TYR  16          2HB       TYR  16   0.810 -10.267  -7.044
  250    HD1  TYR  16           HD1      TYR  16   0.109 -13.863  -7.571
  251    HD2  TYR  16           HD2      TYR  16   3.070 -10.754  -7.767
  252    HE1  TYR  16           HE1      TYR  16   1.595 -15.359  -8.877
  253    HE2  TYR  16           HE2      TYR  16   4.555 -12.251  -9.074
  254    HH   TYR  16           HH       TYR  16   4.707 -15.025  -9.208
  255    H    LEU  17           H        LEU  17   3.017 -10.279  -4.915
  256    HA   LEU  17           HA       LEU  17   4.657 -12.748  -4.934
  257   1HB   LEU  17          1HB       LEU  17   5.548 -11.000  -6.301
  258   2HB   LEU  17          2HB       LEU  17   5.294  -9.792  -5.043
  259    HG   LEU  17           HG       LEU  17   6.965 -11.990  -4.109
  260   1HD1  LEU  17          1HD1      LEU  17   7.582 -10.661  -6.705
  261   2HD1  LEU  17          2HD1      LEU  17   7.991 -12.283  -6.149
  262   3HD1  LEU  17          3HD1      LEU  17   8.914 -10.895  -5.572
  263   1HD2  LEU  17          1HD2      LEU  17   8.482  -9.925  -3.712
  264   2HD2  LEU  17          2HD2      LEU  17   6.941  -9.980  -2.855
  265   3HD2  LEU  17          3HD2      LEU  17   7.111  -8.980  -4.299
  266    H    VAL  18           H        VAL  18   3.199 -10.568  -2.765
  267    HA   VAL  18           HA       VAL  18   5.110 -10.865  -0.594
  268    HB   VAL  18           HB       VAL  18   2.513  -9.511  -1.047
  269   1HG1  VAL  18          1HG1      VAL  18   1.978  -9.224   1.282
  270   2HG1  VAL  18          2HG1      VAL  18   3.420 -10.097   1.786
  271   3HG1  VAL  18          3HG1      VAL  18   2.094 -10.955   1.004
  272   1HG2  VAL  18          1HG2      VAL  18   4.930  -8.776   0.609
  273   2HG2  VAL  18          2HG2      VAL  18   3.679  -7.689   0.004
  274   3HG2  VAL  18          3HG2      VAL  18   4.793  -8.467  -1.121
  275    H    CYS  19           H        CYS  19   1.862 -12.138  -1.231
  276    HA   CYS  19           HA       CYS  19   2.013 -13.847   1.114
  277   1HB   CYS  19          1HB       CYS  19  -0.011 -14.362  -1.026
  278   2HB   CYS  19          2HB       CYS  19  -0.207 -14.373   0.723
  279    H    GLY  20           H        GLY  20   1.546 -14.653  -2.339
  280   1HA   GLY  20          1HA       GLY  20   2.604 -16.349  -3.610
  281   2HA   GLY  20          2HA       GLY  20   3.627 -16.705  -2.219
  282    H    GLU  21           H        GLU  21   0.122 -16.858  -2.948
  283    HA   GLU  21           HA       GLU  21  -1.442 -18.531  -2.446
  284   1HB   GLU  21          1HB       GLU  21   0.533 -19.683  -3.932
  285   2HB   GLU  21          2HB       GLU  21   0.585 -20.687  -2.481
  286   1HG   GLU  21          1HG       GLU  21  -2.096 -20.046  -3.636
  287   2HG   GLU  21          2HG       GLU  21  -1.098 -21.235  -4.475
  288    H    ARG  22           H        ARG  22  -2.091 -18.362  -0.392
  289    HA   ARG  22           HA       ARG  22  -1.368 -20.206   1.613
  290   1HB   ARG  22          1HB       ARG  22   0.611 -18.243   1.364
  291   2HB   ARG  22          2HB       ARG  22  -0.353 -17.716   2.744
  292   1HG   ARG  22          1HG       ARG  22  -0.190 -20.139   3.580
  293   2HG   ARG  22          2HG       ARG  22   1.077 -20.352   2.371
  294   1HD   ARG  22          1HD       ARG  22   2.155 -18.243   3.401
  295   2HD   ARG  22          2HD       ARG  22   1.060 -18.505   4.760
  296    HE   ARG  22           HE       ARG  22   2.310 -20.972   4.338
  297   1HH1  ARG  22          1HH1      ARG  22   2.607 -18.330   6.283
  298   2HH1  ARG  22          2HH1      ARG  22   4.305 -18.487   6.588
  299   1HH2  ARG  22          1HH2      ARG  22   4.784 -20.924   4.171
  300   2HH2  ARG  22          2HH2      ARG  22   5.535 -19.953   5.392
  301    H    GLY  23           H        GLY  23  -2.583 -17.044   0.757
  302   1HA   GLY  23          1HA       GLY  23  -5.133 -17.258   1.738
  303   2HA   GLY  23          2HA       GLY  23  -4.217 -16.748   3.157
  304    H    PHE  24           H        PHE  24  -3.548 -15.817  -0.185
  305    HA   PHE  24           HA       PHE  24  -3.372 -13.026   0.515
  306   1HB   PHE  24          1HB       PHE  24  -2.033 -13.794  -1.315
  307   2HB   PHE  24          2HB       PHE  24  -3.424 -14.518  -2.118
  308    HD1  PHE  24           HD1      PHE  24  -3.592 -11.237  -0.445
  309    HD2  PHE  24           HD2      PHE  24  -3.145 -13.284  -4.196
  310    HE1  PHE  24           HE1      PHE  24  -4.001  -9.110  -1.656
  311    HE2  PHE  24           HE2      PHE  24  -3.556 -11.160  -5.407
  312    HZ   PHE  24           HZ       PHE  24  -3.982  -9.071  -4.137
  313    H    PHE  25           H        PHE  25  -5.078 -11.667   0.774
  314    HA   PHE  25           HA       PHE  25  -7.612 -12.333  -0.673
  315   1HB   PHE  25          1HB       PHE  25  -7.147 -12.012   2.120
  316   2HB   PHE  25          2HB       PHE  25  -8.100 -10.629   1.583
  317    HD1  PHE  25           HD1      PHE  25  -8.009 -14.299   1.914
  318    HD2  PHE  25           HD2      PHE  25 -10.336 -10.918   0.640
  319    HE1  PHE  25           HE1      PHE  25 -10.031 -15.732   1.803
  320    HE2  PHE  25           HE2      PHE  25 -12.359 -12.352   0.529
  321    HZ   PHE  25           HZ       PHE  25 -12.206 -14.758   1.111
  322    H    TYR  26           H        TYR  26  -8.235 -10.792  -2.098
  323    HA   TYR  26           HA       TYR  26  -7.388  -7.978  -1.597
  324   1HB   TYR  26          1HB       TYR  26  -5.809  -8.687  -3.233
  325   2HB   TYR  26          2HB       TYR  26  -7.028  -9.589  -4.132
  326    HD1  TYR  26           HD1      TYR  26  -6.010  -6.142  -3.119
  327    HD2  TYR  26           HD2      TYR  26  -8.313  -8.552  -5.832
  328    HE1  TYR  26           HE1      TYR  26  -6.488  -4.135  -4.497
  329    HE2  TYR  26           HE2      TYR  26  -8.792  -6.544  -7.209
  330    HH   TYR  26           HH       TYR  26  -7.211  -3.973  -7.324
  331    H    THR  27           H        THR  27  -8.868  -6.418  -2.403
  332    HA   THR  27           HA       THR  27 -11.267  -7.345  -3.834
  333    HB   THR  27           HB       THR  27 -11.727  -5.876  -1.251
  334    HG1  THR  27           HG1      THR  27 -12.024  -7.947  -0.292
  335   1HG2  THR  27          1HG2      THR  27 -13.373  -6.562  -3.289
  336   2HG2  THR  27          2HG2      THR  27 -13.916  -6.415  -1.618
  337   3HG2  THR  27          3HG2      THR  27 -13.520  -8.000  -2.280
  338    H    LYS  28           H        LYS  28 -12.481  -4.714  -2.554
  339    HA   LYS  28           HA       LYS  28 -11.480  -3.000  -4.712
  340   1HB   LYS  28          1HB       LYS  28 -13.869  -2.990  -4.237
  341   2HB   LYS  28          2HB       LYS  28 -13.562  -2.535  -2.560
  342   1HG   LYS  28          1HG       LYS  28 -12.189  -0.584  -3.915
  343   2HG   LYS  28          2HG       LYS  28 -13.560  -0.863  -4.989
  344   1HD   LYS  28          1HD       LYS  28 -14.314  -0.763  -2.152
  345   2HD   LYS  28          2HD       LYS  28 -13.612   0.744  -2.743
  346   1HE   LYS  28          1HE       LYS  28 -15.930  -0.752  -4.002
  347   2HE   LYS  28          2HE       LYS  28 -16.041   0.754  -3.092
  348   1HZ   LYS  28          1HZ       LYS  28 -14.097   0.993  -5.124
  349   2HZ   LYS  28          2HZ       LYS  28 -15.519   1.894  -4.897
  350   3HZ   LYS  28          3HZ       LYS  28 -15.555   0.455  -5.802
  351    HA   PRO  29           HA       PRO  29  -8.536  -1.173  -1.875
  352   1HB   PRO  29          1HB       PRO  29  -7.315   0.387  -3.776
  353   2HB   PRO  29          2HB       PRO  29  -6.965  -1.336  -3.555
  354   1HG   PRO  29          1HG       PRO  29  -8.544  -0.002  -5.704
  355   2HG   PRO  29          2HG       PRO  29  -7.657  -1.536  -5.751
  356   1HD   PRO  29          1HD       PRO  29 -10.460  -1.248  -5.471
  357   2HD   PRO  29          2HD       PRO  29  -9.530  -2.735  -5.192
  358    H    THR  30           H        THR  30  -8.981   1.307  -4.301
  359    HA   THR  30           HA       THR  30 -10.562   2.922  -2.347
  360    HB   THR  30           HB       THR  30  -8.649   4.341  -4.134
  361    HG1  THR  30           HG1      THR  30  -7.195   3.912  -2.128
  362   1HG2  THR  30          1HG2      THR  30  -8.918   5.997  -2.601
  363   2HG2  THR  30          2HG2      THR  30  -8.796   4.885  -1.238
  364   3HG2  THR  30          3HG2      THR  30 -10.326   5.062  -2.097
  Start of MODEL   18
    1   1H    GLY   1          1H        GLY   1  -6.939   7.565   8.979
    2   2H    GLY   1          2H        GLY   1  -7.188   8.992   9.867
    3   3H    GLY   1          3H        GLY   1  -6.836   7.539  10.674
    4   1HA   GLY   1          1HA       GLY   1  -4.956   8.981   8.965
    5   2HA   GLY   1          2HA       GLY   1  -4.852   8.909  10.749
    6    H    GLY   2           H        GLY   2  -5.673   6.081   8.923
    7   1HA   GLY   2          1HA       GLY   2  -2.862   5.362   8.422
    8   2HA   GLY   2          2HA       GLY   2  -4.253   4.291   8.247
    9    H    GLY   3           H        GLY   3  -5.604   6.516   6.640
   10   1HA   GLY   3          1HA       GLY   3  -5.471   7.415   4.421
   11   2HA   GLY   3          2HA       GLY   3  -3.962   6.533   4.182
   12    H    GLU   4           H        GLU   4  -4.161   4.889   2.754
   13    HA   GLU   4           HA       GLU   4  -6.792   3.465   2.634
   14   1HB   GLU   4          1HB       GLU   4  -4.818   4.109   0.427
   15   2HB   GLU   4          2HB       GLU   4  -6.153   2.972   0.231
   16   1HG   GLU   4          1HG       GLU   4  -6.421   5.891   1.010
   17   2HG   GLU   4          2HG       GLU   4  -6.796   5.209  -0.573
   18    H    GLN   5           H        GLN   5  -3.438   2.886   1.509
   19    HA   GLN   5           HA       GLN   5  -3.190   0.545   3.239
   20   1HB   GLN   5          1HB       GLN   5  -4.532  -0.439   1.461
   21   2HB   GLN   5          2HB       GLN   5  -3.434   0.203   0.239
   22   1HG   GLN   5          1HG       GLN   5  -1.585  -1.136   1.328
   23   2HG   GLN   5          2HG       GLN   5  -2.818  -1.898   2.331
   24   1HE2  GLN   5          1HE2      GLN   5  -4.760  -1.659  -0.066
   25   2HE2  GLN   5          2HE2      GLN   5  -4.321  -2.955  -1.070
   26    H    CYS   6           H        CYS   6  -1.607   0.548   0.145
   27    HA   CYS   6           HA       CYS   6   0.912   1.359   1.522
   28   1HB   CYS   6          1HB       CYS   6   0.342  -0.417  -0.853
   29   2HB   CYS   6          2HB       CYS   6   1.956   0.235  -0.563
   30    H    CYS   7           H        CYS   7  -1.343   2.930  -0.027
   31    HA   CYS   7           HA       CYS   7   0.316   4.197  -2.122
   32   1HB   CYS   7          1HB       CYS   7  -2.287   3.680  -2.170
   33   2HB   CYS   7          2HB       CYS   7  -2.384   5.231  -1.337
   34    H    THR   8           H        THR   8   0.634   6.566  -2.091
   35    HA   THR   8           HA       THR   8   1.536   8.426  -0.964
   36    HB   THR   8           HB       THR   8  -0.009   9.522   0.499
   37    HG1  THR   8           HG1      THR   8  -0.309   7.753   1.912
   38   1HG2  THR   8          1HG2      THR   8  -1.759   7.774  -1.237
   39   2HG2  THR   8          2HG2      THR   8  -0.751   9.061  -1.899
   40   3HG2  THR   8          3HG2      THR   8  -2.037   9.448  -0.756
   41    H    SER   9           H        SER   9   2.276   5.642  -0.034
   42    HA   SER   9           HA       SER   9   3.614   6.502   2.448
   43   1HB   SER   9          1HB       SER   9   1.547   5.550   3.320
   44   2HB   SER   9          2HB       SER   9   1.754   4.109   2.329
   45    HG   SER   9           HG       SER   9   3.544   5.016   4.344
   46    H    ILE  10           H        ILE  10   4.232   3.621   3.024
   47    HA   ILE  10           HA       ILE  10   5.822   2.901   0.613
   48    HB   ILE  10           HB       ILE  10   7.049   2.926   3.375
   49   1HG1  ILE  10          1HG1      ILE  10   7.117   5.065   1.225
   50   2HG1  ILE  10          2HG1      ILE  10   6.480   5.232   2.861
   51   1HG2  ILE  10          1HG2      ILE  10   8.708   3.256   0.971
   52   2HG2  ILE  10          2HG2      ILE  10   7.822   1.731   1.011
   53   3HG2  ILE  10          3HG2      ILE  10   8.909   2.154   2.334
   54   1HD1  ILE  10          1HD1      ILE  10   8.537   5.969   3.438
   55   2HD1  ILE  10          2HD1      ILE  10   9.243   5.411   1.921
   56   3HD1  ILE  10          3HD1      ILE  10   9.062   4.294   3.273
   57    H    CYS  11           H        CYS  11   5.008   1.939   3.958
   58    HA   CYS  11           HA       CYS  11   4.694  -0.197   4.881
   59   1HB   CYS  11          1HB       CYS  11   2.850  -1.320   3.956
   60   2HB   CYS  11          2HB       CYS  11   2.622   0.333   3.397
   61    H    SER  12           H        SER  12   4.672  -2.735   4.027
   62    HA   SER  12           HA       SER  12   6.800  -3.219   2.060
   63   1HB   SER  12          1HB       SER  12   7.632  -2.828   4.654
   64   2HB   SER  12          2HB       SER  12   7.418  -4.560   4.598
   65    HG   SER  12           HG       SER  12   9.446  -3.212   3.687
   66    H    LEU  13           H        LEU  13   7.429  -5.755   2.612
   67    HA   LEU  13           HA       LEU  13   5.110  -7.239   1.848
   68   1HB   LEU  13          1HB       LEU  13   6.555  -9.251   2.566
   69   2HB   LEU  13          2HB       LEU  13   7.207  -8.218   1.293
   70    HG   LEU  13           HG       LEU  13   7.893  -7.283   3.983
   71   1HD1  LEU  13          1HD1      LEU  13   7.856  -9.774   4.323
   72   2HD1  LEU  13          2HD1      LEU  13   9.453  -9.055   4.525
   73   3HD1  LEU  13          3HD1      LEU  13   9.056  -9.918   3.039
   74   1HD2  LEU  13          1HD2      LEU  13   8.874  -7.175   1.335
   75   2HD2  LEU  13          2HD2      LEU  13  10.096  -8.041   2.266
   76   3HD2  LEU  13          3HD2      LEU  13   9.587  -6.428   2.765
   77    H    TYR  14           H        TYR  14   6.141  -6.049   4.865
   78    HA   TYR  14           HA       TYR  14   4.841  -8.085   6.499
   79   1HB   TYR  14          1HB       TYR  14   6.207  -5.499   6.899
   80   2HB   TYR  14          2HB       TYR  14   5.007  -5.928   8.114
   81    HD1  TYR  14           HD1      TYR  14   7.844  -7.466   6.195
   82    HD2  TYR  14           HD2      TYR  14   5.657  -7.295   9.888
   83    HE1  TYR  14           HE1      TYR  14   9.451  -9.059   7.221
   84    HE2  TYR  14           HE2      TYR  14   7.260  -8.887  10.916
   85    HH   TYR  14           HH       TYR  14   8.959 -10.297  10.516
   86    H    GLN  15           H        GLN  15   4.130  -4.696   5.778
   87    HA   GLN  15           HA       GLN  15   1.509  -4.681   6.890
   88   1HB   GLN  15          1HB       GLN  15   2.737  -3.036   4.664
   89   2HB   GLN  15          2HB       GLN  15   1.149  -2.702   5.360
   90   1HG   GLN  15          1HG       GLN  15   2.904  -3.040   7.546
   91   2HG   GLN  15          2HG       GLN  15   3.755  -2.012   6.393
   92   1HE2  GLN  15          1HE2      GLN  15   3.321   0.164   6.758
   93   2HE2  GLN  15          2HE2      GLN  15   1.845   0.785   7.319
   94    H    LEU  16           H        LEU  16   2.772  -5.711   3.814
   95    HA   LEU  16           HA       LEU  16   0.163  -6.039   2.560
   96   1HB   LEU  16          1HB       LEU  16   2.823  -7.308   1.822
   97   2HB   LEU  16          2HB       LEU  16   1.404  -7.168   0.783
   98    HG   LEU  16           HG       LEU  16   2.762  -4.755   1.992
   99   1HD1  LEU  16          1HD1      LEU  16   4.383  -5.989   0.586
  100   2HD1  LEU  16          2HD1      LEU  16   3.910  -4.463  -0.160
  101   3HD1  LEU  16          3HD1      LEU  16   3.224  -5.979  -0.744
  102   1HD2  LEU  16          1HD2      LEU  16   0.832  -5.190  -0.306
  103   2HD2  LEU  16          2HD2      LEU  16   1.600  -3.645   0.058
  104   3HD2  LEU  16          3HD2      LEU  16   0.493  -4.374   1.220
  105    H    GLU  17           H        GLU  17   2.317  -7.930   4.572
  106    HA   GLU  17           HA       GLU  17   0.939 -10.460   4.082
  107   1HB   GLU  17          1HB       GLU  17   3.276  -9.560   5.525
  108   2HB   GLU  17          2HB       GLU  17   2.272 -10.554   6.580
  109   1HG   GLU  17          1HG       GLU  17   3.101 -11.364   3.780
  110   2HG   GLU  17          2HG       GLU  17   3.936 -11.878   5.247
  111    H    ASN  18           H        ASN  18   0.304  -7.665   5.933
  112    HA   ASN  18           HA       ASN  18  -1.152  -8.945   8.086
  113   1HB   ASN  18          1HB       ASN  18  -0.445  -6.266   7.311
  114   2HB   ASN  18          2HB       ASN  18  -2.171  -6.332   7.665
  115   1HD2  ASN  18          1HD2      ASN  18  -2.768  -7.341   9.836
  116   2HD2  ASN  18          2HD2      ASN  18  -1.679  -7.176  11.127
  117    H    TYR  19           H        TYR  19  -1.813  -8.522   4.788
  118    HA   TYR  19           HA       TYR  19  -4.763  -8.616   5.257
  119   1HB   TYR  19          1HB       TYR  19  -3.376  -8.253   2.595
  120   2HB   TYR  19          2HB       TYR  19  -5.049  -7.876   3.009
  121    HD1  TYR  19           HD1      TYR  19  -1.965  -6.422   2.399
  122    HD2  TYR  19           HD2      TYR  19  -5.190  -6.290   5.234
  123    HE1  TYR  19           HE1      TYR  19  -1.285  -4.128   3.065
  124    HE2  TYR  19           HE2      TYR  19  -4.513  -3.997   5.902
  125    HH   TYR  19           HH       TYR  19  -2.338  -2.634   5.847
  126    H    CYS  20           H        CYS  20  -2.337 -10.756   5.048
  127    HA   CYS  20           HA       CYS  20  -3.970 -12.660   3.417
  128   1HB   CYS  20          1HB       CYS  20  -1.091 -13.245   3.872
  129   2HB   CYS  20          2HB       CYS  20  -2.082 -13.525   2.443
  130    H    ASN  21           H        ASN  21  -3.063 -15.038   4.102
  131    HA   ASN  21           HA       ASN  21  -4.171 -15.664   6.587
  132   1HB   ASN  21          1HB       ASN  21  -3.421 -17.287   4.781
  133   2HB   ASN  21          2HB       ASN  21  -1.785 -17.117   5.419
  134   1HD2  ASN  21          1HD2      ASN  21  -4.297 -19.206   5.574
  135   2HD2  ASN  21          2HD2      ASN  21  -4.133 -19.768   7.167
  136   1H    PHE   1          1H        PHE   1  16.161  -4.284   0.502
  137   2H    PHE   1          2H        PHE   1  14.915  -5.355   0.068
  138   3H    PHE   1          3H        PHE   1  15.744  -5.561   1.537
  139    HA   PHE   1           HA       PHE   1  13.385  -4.274   1.250
  140   1HB   PHE   1          1HB       PHE   1  15.515  -4.514   3.290
  141   2HB   PHE   1          2HB       PHE   1  14.397  -3.170   3.528
  142    HD1  PHE   1           HD1      PHE   1  13.918  -6.612   2.113
  143    HD2  PHE   1           HD2      PHE   1  12.829  -3.777   5.154
  144    HE1  PHE   1           HE1      PHE   1  12.202  -8.188   2.968
  145    HE2  PHE   1           HE2      PHE   1  11.114  -5.352   6.008
  146    HZ   PHE   1           HZ       PHE   1  10.800  -7.558   4.915
  147    H    VAL   2           H        VAL   2  12.944  -2.445   0.110
  148    HA   VAL   2           HA       VAL   2  14.688  -0.075   0.588
  149    HB   VAL   2           HB       VAL   2  14.945  -1.376  -1.711
  150   1HG1  VAL   2          1HG1      VAL   2  12.903   0.579  -2.643
  151   2HG1  VAL   2          2HG1      VAL   2  12.317  -0.935  -1.955
  152   3HG1  VAL   2          3HG1      VAL   2  13.391  -0.960  -3.353
  153   1HG2  VAL   2          1HG2      VAL   2  14.777   1.375  -2.473
  154   2HG2  VAL   2          2HG2      VAL   2  16.217   0.434  -2.084
  155   3HG2  VAL   2          3HG2      VAL   2  15.351   1.289  -0.807
  156    H    ASN   3           H        ASN   3  13.213   1.625  -1.098
  157    HA   ASN   3           HA       ASN   3  10.610   1.725   0.375
  158   1HB   ASN   3          1HB       ASN   3  12.010   4.085  -0.897
  159   2HB   ASN   3          2HB       ASN   3  10.718   4.106   0.304
  160   1HD2  ASN   3          1HD2      ASN   3  11.296   3.340   2.533
  161   2HD2  ASN   3          2HD2      ASN   3  12.907   3.443   3.057
  162    H    GLN   4           H        GLN   4   8.829   1.472  -0.884
  163    HA   GLN   4           HA       GLN   4   8.858   2.463  -3.666
  164   1HB   GLN   4          1HB       GLN   4   9.437  -0.227  -3.130
  165   2HB   GLN   4          2HB       GLN   4   7.742  -0.219  -3.619
  166   1HG   GLN   4          1HG       GLN   4   8.928   1.537  -5.412
  167   2HG   GLN   4          2HG       GLN   4  10.139   0.269  -5.224
  168   1HE2  GLN   4          1HE2      GLN   4   9.841  -1.427  -6.663
  169   2HE2  GLN   4          2HE2      GLN   4   8.344  -1.934  -7.285
  170    H    HIS   5           H        HIS   5   6.901   3.368  -4.084
  171    HA   HIS   5           HA       HIS   5   4.692   2.857  -2.176
  172   1HB   HIS   5          1HB       HIS   5   4.987   4.900  -4.401
  173   2HB   HIS   5          2HB       HIS   5   3.623   4.808  -3.288
  174    HD2  HIS   5           HD2      HIS   5   6.990   4.134  -1.559
  175    HE1  HIS   5           HE1      HIS   5   5.994   8.172  -0.794
  176    HE2  HIS   5           HE2      HIS   5   7.569   6.261  -0.178
  177    H    LEU   6           H        LEU   6   2.737   1.926  -2.814
  178    HA   LEU   6           HA       LEU   6   2.544   1.079  -5.674
  179   1HB   LEU   6          1HB       LEU   6   2.113  -0.571  -3.179
  180   2HB   LEU   6          2HB       LEU   6   1.425  -1.030  -4.735
  181    HG   LEU   6           HG       LEU   6   3.528  -2.178  -4.531
  182   1HD1  LEU   6          1HD1      LEU   6   4.268  -1.662  -6.617
  183   2HD1  LEU   6          2HD1      LEU   6   4.546   0.029  -6.202
  184   3HD1  LEU   6          3HD1      LEU   6   2.925  -0.518  -6.629
  185   1HD2  LEU   6          1HD2      LEU   6   4.256   0.106  -3.037
  186   2HD2  LEU   6          2HD2      LEU   6   5.351   0.061  -4.421
  187   3HD2  LEU   6          3HD2      LEU   6   5.239  -1.328  -3.340
  188    H    CYS   7           H        CYS   7   0.486   1.248  -6.557
  189    HA   CYS   7           HA       CYS   7  -1.821   1.723  -4.784
  190   1HB   CYS   7          1HB       CYS   7  -1.015   3.791  -6.849
  191   2HB   CYS   7          2HB       CYS   7  -2.384   3.878  -5.740
  192    H    GLY   8           H        GLY   8  -3.401   0.485  -5.654
  193   1HA   GLY   8          1HA       GLY   8  -4.950  -0.167  -7.342
  194   2HA   GLY   8          2HA       GLY   8  -3.938   0.635  -8.543
  195    H    SER   9           H        SER   9  -3.629  -1.024  -9.996
  196    HA   SER   9           HA       SER   9  -3.373  -3.756  -9.536
  197   1HB   SER   9          1HB       SER   9  -3.436  -2.729 -11.790
  198   2HB   SER   9          2HB       SER   9  -1.797  -2.129 -11.554
  199    HG   SER   9           HG       SER   9  -2.700  -4.650 -12.168
  200    H    ASP  10           H        ASP  10  -0.506  -1.672 -10.063
  201    HA   ASP  10           HA       ASP  10   1.504  -3.366  -9.290
  202   1HB   ASP  10          1HB       ASP  10   1.302  -0.492  -8.353
  203   2HB   ASP  10          2HB       ASP  10   2.785  -1.426  -8.555
  204    H    LEU  11           H        LEU  11  -0.899  -1.969  -7.186
  205    HA   LEU  11           HA       LEU  11   0.463  -2.593  -4.715
  206   1HB   LEU  11          1HB       LEU  11  -1.860  -1.202  -5.429
  207   2HB   LEU  11          2HB       LEU  11  -2.430  -2.576  -4.480
  208    HG   LEU  11           HG       LEU  11  -0.208  -0.707  -3.616
  209   1HD1  LEU  11          1HD1      LEU  11  -3.130  -0.522  -3.424
  210   2HD1  LEU  11          2HD1      LEU  11  -1.906   0.717  -3.145
  211   3HD1  LEU  11          3HD1      LEU  11  -2.325  -0.415  -1.860
  212   1HD2  LEU  11          1HD2      LEU  11   0.132  -2.748  -2.500
  213   2HD2  LEU  11          2HD2      LEU  11  -1.595  -3.091  -2.405
  214   3HD2  LEU  11          3HD2      LEU  11  -0.882  -1.855  -1.367
  215    H    VAL  12           H        VAL  12  -1.806  -4.302  -6.779
  216    HA   VAL  12           HA       VAL  12  -2.144  -6.500  -4.902
  217    HB   VAL  12           HB       VAL  12  -3.444  -7.548  -6.591
  218   1HG1  VAL  12          1HG1      VAL  12  -4.086  -4.967  -7.733
  219   2HG1  VAL  12          2HG1      VAL  12  -3.805  -4.818  -5.998
  220   3HG1  VAL  12          3HG1      VAL  12  -5.022  -5.943  -6.601
  221   1HG2  VAL  12          1HG2      VAL  12  -1.523  -6.182  -8.375
  222   2HG2  VAL  12          2HG2      VAL  12  -3.179  -6.226  -8.979
  223   3HG2  VAL  12          3HG2      VAL  12  -2.345  -7.728  -8.581
  224    H    GLU  13           H        GLU  13   0.044  -5.679  -7.481
  225    HA   GLU  13           HA       GLU  13   1.212  -8.285  -7.824
  226   1HB   GLU  13          1HB       GLU  13   1.558  -5.891  -9.083
  227   2HB   GLU  13          2HB       GLU  13   3.002  -5.925  -8.068
  228   1HG   GLU  13          1HG       GLU  13   3.459  -8.250  -8.931
  229   2HG   GLU  13          2HG       GLU  13   2.129  -8.029 -10.067
  230    H    ALA  14           H        ALA  14   1.425  -5.814  -5.412
  231    HA   ALA  14           HA       ALA  14   3.835  -6.978  -4.174
  232   1HB   ALA  14          1HB       ALA  14   4.033  -4.939  -3.225
  233   2HB   ALA  14          2HB       ALA  14   2.426  -5.072  -2.510
  234   3HB   ALA  14          3HB       ALA  14   2.614  -4.435  -4.144
  235    H    LEU  15           H        LEU  15   0.398  -7.252  -4.019
  236    HA   LEU  15           HA       LEU  15   0.486  -8.509  -1.331
  237   1HB   LEU  15          1HB       LEU  15  -1.628  -7.450  -3.134
  238   2HB   LEU  15          2HB       LEU  15  -2.073  -8.848  -2.154
  239    HG   LEU  15           HG       LEU  15  -0.729  -6.415  -0.967
  240   1HD1  LEU  15          1HD1      LEU  15  -3.260  -6.132  -0.144
  241   2HD1  LEU  15          2HD1      LEU  15  -3.583  -6.897  -1.700
  242   3HD1  LEU  15          3HD1      LEU  15  -2.681  -5.382  -1.631
  243   1HD2  LEU  15          1HD2      LEU  15  -0.668  -7.837   0.793
  244   2HD2  LEU  15          2HD2      LEU  15  -1.712  -9.001  -0.023
  245   3HD2  LEU  15          3HD2      LEU  15  -2.421  -7.655   0.869
  246    H    TYR  16           H        TYR  16   0.022  -9.227  -4.705
  247    HA   TYR  16           HA       TYR  16  -0.582 -12.051  -4.282
  248   1HB   TYR  16          1HB       TYR  16  -1.516 -11.419  -6.287
  249   2HB   TYR  16          2HB       TYR  16  -0.310 -10.168  -6.568
  250    HD1  TYR  16           HD1      TYR  16  -0.848 -13.868  -6.656
  251    HD2  TYR  16           HD2      TYR  16   1.542 -10.552  -7.988
  252    HE1  TYR  16           HE1      TYR  16   0.354 -15.364  -8.228
  253    HE2  TYR  16           HE2      TYR  16   2.744 -12.049  -9.559
  254    HH   TYR  16           HH       TYR  16   3.227 -14.632  -9.627
  255    H    LEU  17           H        LEU  17   2.229 -10.097  -4.388
  256    HA   LEU  17           HA       LEU  17   3.954 -12.409  -5.090
  257   1HB   LEU  17          1HB       LEU  17   4.392 -10.254  -6.234
  258   2HB   LEU  17          2HB       LEU  17   4.688  -9.500  -4.667
  259    HG   LEU  17           HG       LEU  17   6.340 -11.664  -4.511
  260   1HD1  LEU  17          1HD1      LEU  17   7.569 -11.611  -6.752
  261   2HD1  LEU  17          2HD1      LEU  17   6.135 -10.822  -7.408
  262   3HD1  LEU  17          3HD1      LEU  17   6.018 -12.451  -6.743
  263   1HD2  LEU  17          1HD2      LEU  17   8.156 -10.061  -5.054
  264   2HD2  LEU  17          2HD2      LEU  17   6.938  -9.335  -4.005
  265   3HD2  LEU  17          3HD2      LEU  17   6.959  -8.954  -5.727
  266    H    VAL  18           H        VAL  18   2.984 -10.429  -2.413
  267    HA   VAL  18           HA       VAL  18   5.196 -11.234  -0.689
  268    HB   VAL  18           HB       VAL  18   2.551  -9.871  -0.172
  269   1HG1  VAL  18          1HG1      VAL  18   3.215  -9.638   2.167
  270   2HG1  VAL  18          2HG1      VAL  18   4.711 -10.523   1.862
  271   3HG1  VAL  18          3HG1      VAL  18   3.159 -11.353   1.759
  272   1HG2  VAL  18          1HG2      VAL  18   3.763  -7.962  -0.192
  273   2HG2  VAL  18          2HG2      VAL  18   4.923  -8.930  -1.107
  274   3HG2  VAL  18          3HG2      VAL  18   5.130  -8.713   0.632
  275    H    CYS  19           H        CYS  19   1.720 -11.874  -0.590
  276    HA   CYS  19           HA       CYS  19   2.388 -14.387   0.810
  277   1HB   CYS  19          1HB       CYS  19  -0.452 -13.537   0.671
  278   2HB   CYS  19          2HB       CYS  19   0.453 -14.215   2.022
  279    H    GLY  20           H        GLY  20   2.496 -14.009  -2.131
  280   1HA   GLY  20          1HA       GLY  20   0.184 -15.189  -3.360
  281   2HA   GLY  20          2HA       GLY  20   1.790 -15.113  -4.083
  282    H    GLU  21           H        GLU  21   0.322 -16.831  -1.290
  283    HA   GLU  21           HA       GLU  21   0.516 -19.434  -2.351
  284   1HB   GLU  21          1HB       GLU  21   2.972 -18.942  -2.416
  285   2HB   GLU  21          2HB       GLU  21   2.937 -18.718  -0.668
  286   1HG   GLU  21          1HG       GLU  21   3.350 -20.939  -0.536
  287   2HG   GLU  21          2HG       GLU  21   1.663 -21.153  -1.004
  288    H    ARG  22           H        ARG  22   0.870 -17.407   0.525
  289    HA   ARG  22           HA       ARG  22   0.018 -19.485   2.365
  290   1HB   ARG  22          1HB       ARG  22   1.003 -16.819   2.563
  291   2HB   ARG  22          2HB       ARG  22  -0.557 -16.863   3.386
  292   1HG   ARG  22          1HG       ARG  22   1.003 -17.499   5.054
  293   2HG   ARG  22          2HG       ARG  22   0.297 -19.021   4.511
  294   1HD   ARG  22          1HD       ARG  22   2.260 -19.752   3.646
  295   2HD   ARG  22          2HD       ARG  22   2.621 -18.185   2.923
  296    HE   ARG  22           HE       ARG  22   3.080 -18.708   5.833
  297   1HH1  ARG  22          1HH1      ARG  22   4.596 -18.548   2.840
  298   2HH1  ARG  22          2HH1      ARG  22   5.820 -17.421   3.323
  299   1HH2  ARG  22          1HH2      ARG  22   4.410 -16.812   6.432
  300   2HH2  ARG  22          2HH2      ARG  22   5.714 -16.438   5.356
  301    H    GLY  23           H        GLY  23  -1.615 -16.581   1.030
  302   1HA   GLY  23          1HA       GLY  23  -3.995 -17.534   0.211
  303   2HA   GLY  23          2HA       GLY  23  -4.209 -17.646   1.958
  304    H    PHE  24           H        PHE  24  -2.770 -15.178  -0.207
  305    HA   PHE  24           HA       PHE  24  -3.741 -12.985   1.404
  306   1HB   PHE  24          1HB       PHE  24  -1.983 -12.198   0.174
  307   2HB   PHE  24          2HB       PHE  24  -2.238 -13.371  -1.111
  308    HD1  PHE  24           HD1      PHE  24  -3.645 -10.197   0.305
  309    HD2  PHE  24           HD2      PHE  24  -3.174 -12.710  -3.148
  310    HE1  PHE  24           HE1      PHE  24  -4.645  -8.428  -1.121
  311    HE2  PHE  24           HE2      PHE  24  -4.175 -10.945  -4.573
  312    HZ   PHE  24           HZ       PHE  24  -4.911  -8.803  -3.560
  313    H    PHE  25           H        PHE  25  -5.577 -11.631   1.000
  314    HA   PHE  25           HA       PHE  25  -7.523 -12.778  -0.959
  315   1HB   PHE  25          1HB       PHE  25  -9.187 -12.757   0.605
  316   2HB   PHE  25          2HB       PHE  25  -7.839 -12.822   1.735
  317    HD1  PHE  25           HD1      PHE  25 -10.845 -11.274   1.272
  318    HD2  PHE  25           HD2      PHE  25  -6.728 -10.244   1.946
  319    HE1  PHE  25           HE1      PHE  25 -11.547  -9.088   2.215
  320    HE2  PHE  25           HE2      PHE  25  -7.429  -8.060   2.889
  321    HZ   PHE  25           HZ       PHE  25  -9.838  -7.481   3.024
  322    H    TYR  26           H        TYR  26  -9.188 -11.168  -1.706
  323    HA   TYR  26           HA       TYR  26  -8.928  -8.363  -1.439
  324   1HB   TYR  26          1HB       TYR  26  -6.682  -8.943  -2.553
  325   2HB   TYR  26          2HB       TYR  26  -7.624  -9.316  -3.995
  326    HD1  TYR  26           HD1      TYR  26  -8.161  -6.656  -1.419
  327    HD2  TYR  26           HD2      TYR  26  -7.171  -7.563  -5.503
  328    HE1  TYR  26           HE1      TYR  26  -8.259  -4.242  -1.979
  329    HE2  TYR  26           HE2      TYR  26  -7.270  -5.148  -6.062
  330    HH   TYR  26           HH       TYR  26  -6.928  -2.877  -4.468
  331    H    THR  27           H        THR  27 -10.134  -7.224  -3.306
  332    HA   THR  27           HA       THR  27 -12.224  -9.100  -4.318
  333    HB   THR  27           HB       THR  27 -12.336  -6.136  -3.716
  334    HG1  THR  27           HG1      THR  27 -13.496  -6.759  -2.026
  335   1HG2  THR  27          1HG2      THR  27 -14.914  -7.036  -4.223
  336   2HG2  THR  27          2HG2      THR  27 -13.954  -7.807  -5.485
  337   3HG2  THR  27          3HG2      THR  27 -13.935  -6.053  -5.309
  338    H    LYS  28           H        LYS  28 -12.115  -5.913  -5.646
  339    HA   LYS  28           HA       LYS  28 -10.384  -6.483  -7.886
  340   1HB   LYS  28          1HB       LYS  28 -13.153  -7.379  -8.023
  341   2HB   LYS  28          2HB       LYS  28 -12.778  -6.222  -9.300
  342   1HG   LYS  28          1HG       LYS  28 -11.134  -7.578 -10.237
  343   2HG   LYS  28          2HG       LYS  28 -10.837  -8.434  -8.724
  344   1HD   LYS  28          1HD       LYS  28 -12.060 -10.066  -9.778
  345   2HD   LYS  28          2HD       LYS  28 -13.405  -9.142  -9.108
  346   1HE   LYS  28          1HE       LYS  28 -13.967  -9.406 -11.393
  347   2HE   LYS  28          2HE       LYS  28 -13.306  -7.774 -11.298
  348   1HZ   LYS  28          1HZ       LYS  28 -11.619  -8.329 -12.607
  349   2HZ   LYS  28          2HZ       LYS  28 -12.446  -9.774 -12.947
  350   3HZ   LYS  28          3HZ       LYS  28 -11.273  -9.732 -11.718
  351    HA   PRO  29           HA       PRO  29 -11.208  -2.055  -7.348
  352   1HB   PRO  29          1HB       PRO  29  -8.668  -1.305  -8.085
  353   2HB   PRO  29          2HB       PRO  29  -9.102  -1.799  -6.439
  354   1HG   PRO  29          1HG       PRO  29  -7.598  -3.319  -8.522
  355   2HG   PRO  29          2HG       PRO  29  -7.502  -3.438  -6.757
  356   1HD   PRO  29          1HD       PRO  29  -8.878  -5.229  -8.454
  357   2HD   PRO  29          2HD       PRO  29  -9.074  -5.111  -6.693
  358    H    THR  30           H        THR  30 -10.711  -4.040  -9.991
  359    HA   THR  30           HA       THR  30 -10.860  -3.721 -12.313
  360    HB   THR  30           HB       THR  30 -12.541  -2.172 -13.014
  361    HG1  THR  30           HG1      THR  30 -13.175  -0.476 -11.585
  362   1HG2  THR  30          1HG2      THR  30 -13.207  -4.034 -11.377
  363   2HG2  THR  30          2HG2      THR  30 -14.350  -2.704 -11.567
  364   3HG2  THR  30          3HG2      THR  30 -13.299  -2.768 -10.152
  Start of MODEL   19
    1   1H    GLY   1          1H        GLY   1  -7.841   8.986  -1.851
    2   2H    GLY   1          2H        GLY   1  -8.619   7.823  -2.815
    3   3H    GLY   1          3H        GLY   1  -7.553   7.334  -1.586
    4   1HA   GLY   1          1HA       GLY   1  -9.198   7.484  -0.070
    5   2HA   GLY   1          2HA       GLY   1  -9.725   9.098  -0.637
    6    H    GLY   2           H        GLY   2  -9.450   6.006  -2.431
    7   1HA   GLY   2          1HA       GLY   2 -12.014   4.971  -1.304
    8   2HA   GLY   2          2HA       GLY   2 -11.792   5.094  -3.051
    9    H    GLY   3           H        GLY   3  -9.345   4.106  -0.680
   10   1HA   GLY   3          1HA       GLY   3  -9.075   1.600  -0.297
   11   2HA   GLY   3          2HA       GLY   3  -9.288   1.442  -2.041
   12    H    GLU   4           H        GLU   4  -7.105   2.573   0.481
   13    HA   GLU   4           HA       GLU   4  -4.887   2.388  -1.500
   14   1HB   GLU   4          1HB       GLU   4  -3.928   4.399  -0.020
   15   2HB   GLU   4          2HB       GLU   4  -4.937   4.695  -1.435
   16   1HG   GLU   4          1HG       GLU   4  -6.834   5.166  -0.147
   17   2HG   GLU   4          2HG       GLU   4  -6.217   4.295   1.258
   18    H    GLN   5           H        GLN   5  -4.580   3.585   1.788
   19    HA   GLN   5           HA       GLN   5  -3.795   2.514   3.739
   20   1HB   GLN   5          1HB       GLN   5  -4.928   0.403   2.393
   21   2HB   GLN   5          2HB       GLN   5  -3.244  -0.105   2.526
   22   1HG   GLN   5          1HG       GLN   5  -3.448  -0.490   4.740
   23   2HG   GLN   5          2HG       GLN   5  -4.201   1.083   5.007
   24   1HE2  GLN   5          1HE2      GLN   5  -4.873  -1.986   5.673
   25   2HE2  GLN   5          2HE2      GLN   5  -6.544  -2.040   5.377
   26    H    CYS   6           H        CYS   6  -2.238   1.437   0.739
   27    HA   CYS   6           HA       CYS   6   0.399   1.904   2.061
   28   1HB   CYS   6          1HB       CYS   6  -0.582  -0.074   0.091
   29   2HB   CYS   6          2HB       CYS   6   1.014   0.596  -0.252
   30    H    CYS   7           H        CYS   7  -1.552   3.805   0.570
   31    HA   CYS   7           HA       CYS   7   0.302   4.701  -1.585
   32   1HB   CYS   7          1HB       CYS   7  -2.275   4.380  -1.894
   33   2HB   CYS   7          2HB       CYS   7  -2.394   5.922  -1.045
   34    H    THR   8           H        THR   8  -1.811   6.366   0.785
   35    HA   THR   8           HA       THR   8  -0.240   8.743   0.855
   36    HB   THR   8           HB       THR   8  -2.590   8.537   1.714
   37    HG1  THR   8           HG1      THR   8  -2.240  10.086   3.163
   38   1HG2  THR   8          1HG2      THR   8  -2.205   6.366   2.898
   39   2HG2  THR   8          2HG2      THR   8  -2.969   7.585   3.918
   40   3HG2  THR   8          3HG2      THR   8  -1.250   7.234   4.099
   41    H    SER   9           H        SER   9  -0.232   5.876   2.980
   42    HA   SER   9           HA       SER   9   2.100   6.915   4.453
   43   1HB   SER   9          1HB       SER   9   0.090   5.407   5.321
   44   2HB   SER   9          2HB       SER   9   1.118   4.099   4.743
   45    HG   SER   9           HG       SER   9   2.262   4.387   6.470
   46    H    ILE  10           H        ILE  10   3.646   4.657   4.831
   47    HA   ILE  10           HA       ILE  10   4.579   4.071   2.047
   48    HB   ILE  10           HB       ILE  10   6.287   4.056   4.545
   49   1HG1  ILE  10          1HG1      ILE  10   5.268   6.317   4.080
   50   2HG1  ILE  10          2HG1      ILE  10   7.026   6.287   3.948
   51   1HG2  ILE  10          1HG2      ILE  10   6.958   4.235   1.591
   52   2HG2  ILE  10          2HG2      ILE  10   7.094   2.778   2.575
   53   3HG2  ILE  10          3HG2      ILE  10   8.120   4.171   2.917
   54   1HD1  ILE  10          1HD1      ILE  10   6.991   6.434   1.624
   55   2HD1  ILE  10          2HD1      ILE  10   5.588   7.415   2.049
   56   3HD1  ILE  10          3HD1      ILE  10   5.369   5.751   1.505
   57    H    CYS  11           H        CYS  11   3.701   2.760   5.147
   58    HA   CYS  11           HA       CYS  11   3.777   0.554   5.987
   59   1HB   CYS  11          1HB       CYS  11   2.588  -1.024   4.410
   60   2HB   CYS  11          2HB       CYS  11   1.736   0.481   4.733
   61    H    SER  12           H        SER  12   4.173  -1.904   4.738
   62    HA   SER  12           HA       SER  12   6.690  -1.826   3.249
   63   1HB   SER  12          1HB       SER  12   7.723  -1.528   5.353
   64   2HB   SER  12          2HB       SER  12   6.581  -2.597   6.161
   65    HG   SER  12           HG       SER  12   8.917  -3.180   4.958
   66    H    LEU  13           H        LEU  13   7.574  -4.272   3.316
   67    HA   LEU  13           HA       LEU  13   5.689  -5.857   1.964
   68   1HB   LEU  13          1HB       LEU  13   8.366  -6.087   2.523
   69   2HB   LEU  13          2HB       LEU  13   7.685  -7.393   3.495
   70    HG   LEU  13           HG       LEU  13   6.411  -8.129   1.444
   71   1HD1  LEU  13          1HD1      LEU  13   6.762  -5.805   0.358
   72   2HD1  LEU  13          2HD1      LEU  13   6.911  -7.223  -0.680
   73   3HD1  LEU  13          3HD1      LEU  13   8.358  -6.408  -0.087
   74   1HD2  LEU  13          1HD2      LEU  13   8.103  -9.594   1.184
   75   2HD2  LEU  13          2HD2      LEU  13   9.106  -8.538   2.178
   76   3HD2  LEU  13          3HD2      LEU  13   9.106  -8.360   0.423
   77    H    TYR  14           H        TYR  14   6.050  -5.310   5.331
   78    HA   TYR  14           HA       TYR  14   4.747  -7.723   6.245
   79   1HB   TYR  14          1HB       TYR  14   5.455  -5.077   7.413
   80   2HB   TYR  14          2HB       TYR  14   4.247  -6.050   8.247
   81    HD1  TYR  14           HD1      TYR  14   7.424  -6.801   6.388
   82    HD2  TYR  14           HD2      TYR  14   5.162  -7.263  10.011
   83    HE1  TYR  14           HE1      TYR  14   9.233  -8.214   7.337
   84    HE2  TYR  14           HE2      TYR  14   6.970  -8.676  10.962
   85    HH   TYR  14           HH       TYR  14   9.334 -10.086   9.168
   86    H    GLN  15           H        GLN  15   3.606  -4.372   6.121
   87    HA   GLN  15           HA       GLN  15   0.895  -4.817   6.598
   88   1HB   GLN  15          1HB       GLN  15   2.366  -2.794   4.941
   89   2HB   GLN  15          2HB       GLN  15   0.603  -2.835   4.879
   90   1HG   GLN  15          1HG       GLN  15   0.633  -2.769   7.424
   91   2HG   GLN  15          2HG       GLN  15   2.356  -2.411   7.308
   92   1HE2  GLN  15          1HE2      GLN  15  -0.539  -1.252   5.474
   93   2HE2  GLN  15          2HE2      GLN  15  -0.178   0.395   5.670
   94    H    LEU  16           H        LEU  16   2.754  -5.371   3.686
   95    HA   LEU  16           HA       LEU  16   0.454  -5.982   2.011
   96   1HB   LEU  16          1HB       LEU  16   3.376  -6.759   1.700
   97   2HB   LEU  16          2HB       LEU  16   2.140  -6.904   0.450
   98    HG   LEU  16           HG       LEU  16   2.795  -4.273   1.790
   99   1HD1  LEU  16          1HD1      LEU  16   4.468  -5.753   0.054
  100   2HD1  LEU  16          2HD1      LEU  16   4.642  -4.060   0.518
  101   3HD1  LEU  16          3HD1      LEU  16   3.735  -4.487  -0.933
  102   1HD2  LEU  16          1HD2      LEU  16   0.879  -3.768   0.679
  103   2HD2  LEU  16          2HD2      LEU  16   0.951  -5.239  -0.292
  104   3HD2  LEU  16          3HD2      LEU  16   1.881  -3.819  -0.771
  105    H    GLU  17           H        GLU  17   2.643  -7.738   4.126
  106    HA   GLU  17           HA       GLU  17   1.583 -10.363   3.389
  107   1HB   GLU  17          1HB       GLU  17   3.817 -10.417   4.176
  108   2HB   GLU  17          2HB       GLU  17   3.461  -9.330   5.517
  109   1HG   GLU  17          1HG       GLU  17   2.280 -11.021   6.708
  110   2HG   GLU  17          2HG       GLU  17   2.214 -12.072   5.292
  111    H    ASN  18           H        ASN  18   0.604  -7.769   5.367
  112    HA   ASN  18           HA       ASN  18  -0.876  -9.371   7.313
  113   1HB   ASN  18          1HB       ASN  18  -0.637  -6.444   6.674
  114   2HB   ASN  18          2HB       ASN  18  -1.945  -7.009   7.715
  115   1HD2  ASN  18          1HD2      ASN  18  -1.006  -8.727   9.462
  116   2HD2  ASN  18          2HD2      ASN  18   0.402  -8.209  10.255
  117    H    TYR  19           H        TYR  19  -1.312  -8.767   4.085
  118    HA   TYR  19           HA       TYR  19  -4.263  -8.519   4.231
  119   1HB   TYR  19          1HB       TYR  19  -2.247  -8.368   1.991
  120   2HB   TYR  19          2HB       TYR  19  -3.969  -8.551   1.656
  121    HD1  TYR  19           HD1      TYR  19  -1.336  -6.285   2.662
  122    HD2  TYR  19           HD2      TYR  19  -5.594  -6.840   2.548
  123    HE1  TYR  19           HE1      TYR  19  -1.662  -3.846   3.017
  124    HE2  TYR  19           HE2      TYR  19  -5.922  -4.404   2.903
  125    HH   TYR  19           HH       TYR  19  -3.423  -2.337   3.898
  126    H    CYS  20           H        CYS  20  -1.791 -10.879   3.800
  127    HA   CYS  20           HA       CYS  20  -3.550 -12.785   2.417
  128   1HB   CYS  20          1HB       CYS  20  -1.103 -13.800   3.751
  129   2HB   CYS  20          2HB       CYS  20  -1.701 -14.100   2.124
  130    H    ASN  21           H        ASN  21  -3.555 -15.090   3.515
  131    HA   ASN  21           HA       ASN  21  -3.490 -15.534   6.263
  132   1HB   ASN  21          1HB       ASN  21  -5.504 -13.618   5.649
  133   2HB   ASN  21          2HB       ASN  21  -6.323 -15.112   6.108
  134   1HD2  ASN  21          1HD2      ASN  21  -3.825 -12.799   7.234
  135   2HD2  ASN  21          2HD2      ASN  21  -4.007 -13.161   8.882
  136   1H    PHE   1          1H        PHE   1  14.616  -2.806  -4.431
  137   2H    PHE   1          2H        PHE   1  14.097  -4.412  -4.239
  138   3H    PHE   1          3H        PHE   1  15.557  -3.898  -3.538
  139    HA   PHE   1           HA       PHE   1  12.793  -3.304  -2.714
  140   1HB   PHE   1          1HB       PHE   1  14.827  -4.996  -1.794
  141   2HB   PHE   1          2HB       PHE   1  14.849  -3.629  -0.680
  142    HD1  PHE   1           HD1      PHE   1  12.582  -6.133  -2.274
  143    HD2  PHE   1           HD2      PHE   1  13.179  -3.380   0.972
  144    HE1  PHE   1           HE1      PHE   1  10.544  -7.005  -1.159
  145    HE2  PHE   1           HE2      PHE   1  11.140  -4.252   2.086
  146    HZ   PHE   1           HZ       PHE   1   9.824  -6.064   1.022
  147    H    VAL   2           H        VAL   2  12.326  -1.200  -2.450
  148    HA   VAL   2           HA       VAL   2  14.164   0.538  -0.998
  149    HB   VAL   2           HB       VAL   2  13.511   1.967  -3.419
  150   1HG1  VAL   2          1HG1      VAL   2  15.212   2.866  -2.138
  151   2HG1  VAL   2          2HG1      VAL   2  16.155   1.974  -3.335
  152   3HG1  VAL   2          3HG1      VAL   2  15.881   1.285  -1.734
  153   1HG2  VAL   2          1HG2      VAL   2  14.852   0.781  -4.998
  154   2HG2  VAL   2          2HG2      VAL   2  13.658  -0.354  -4.366
  155   3HG2  VAL   2          3HG2      VAL   2  15.324  -0.411  -3.786
  156    H    ASN   3           H        ASN   3  13.009   2.916  -2.088
  157    HA   ASN   3           HA       ASN   3  11.003   3.580  -0.382
  158   1HB   ASN   3          1HB       ASN   3  10.080   5.098  -2.193
  159   2HB   ASN   3          2HB       ASN   3  11.819   5.238  -1.922
  160   1HD2  ASN   3          1HD2      ASN   3  11.767   6.080  -4.262
  161   2HD2  ASN   3          2HD2      ASN   3  11.828   4.933  -5.513
  162    H    GLN   4           H        GLN   4   8.858   3.075  -0.058
  163    HA   GLN   4           HA       GLN   4   7.652   1.128  -1.977
  164   1HB   GLN   4          1HB       GLN   4   7.990   0.952   0.775
  165   2HB   GLN   4          2HB       GLN   4   6.301   1.432   0.602
  166   1HG   GLN   4          1HG       GLN   4   6.191  -0.911   0.469
  167   2HG   GLN   4          2HG       GLN   4   6.206  -0.424  -1.226
  168   1HE2  GLN   4          1HE2      GLN   4   8.224  -1.789   1.370
  169   2HE2  GLN   4          2HE2      GLN   4   9.437  -2.385   0.343
  170    H    HIS   5           H        HIS   5   5.954   1.841  -3.165
  171    HA   HIS   5           HA       HIS   5   4.057   3.784  -2.048
  172   1HB   HIS   5          1HB       HIS   5   6.235   4.698  -3.622
  173   2HB   HIS   5          2HB       HIS   5   4.798   4.788  -4.642
  174    HD2  HIS   5           HD2      HIS   5   5.166   5.664  -0.769
  175    HE1  HIS   5           HE1      HIS   5   3.369   8.905  -2.805
  176    HE2  HIS   5           HE2      HIS   5   4.119   8.033  -0.528
  177    H    LEU   6           H        LEU   6   2.457   2.206  -2.405
  178    HA   LEU   6           HA       LEU   6   1.831   1.693  -5.284
  179   1HB   LEU   6          1HB       LEU   6   1.197  -0.316  -3.133
  180   2HB   LEU   6          2HB       LEU   6   1.352  -0.573  -4.871
  181    HG   LEU   6           HG       LEU   6   3.838   0.446  -4.053
  182   1HD1  LEU   6          1HD1      LEU   6   4.502  -1.051  -2.234
  183   2HD1  LEU   6          2HD1      LEU   6   2.880  -1.742  -2.183
  184   3HD1  LEU   6          3HD1      LEU   6   3.138  -0.061  -1.716
  185   1HD2  LEU   6          1HD2      LEU   6   4.547  -1.960  -4.505
  186   2HD2  LEU   6          2HD2      LEU   6   3.608  -1.201  -5.791
  187   3HD2  LEU   6          3HD2      LEU   6   2.835  -2.341  -4.690
  188    H    CYS   7           H        CYS   7  -0.474   1.587  -5.737
  189    HA   CYS   7           HA       CYS   7  -2.287   2.207  -3.474
  190   1HB   CYS   7          1HB       CYS   7  -2.417   3.942  -5.926
  191   2HB   CYS   7          2HB       CYS   7  -3.063   4.249  -4.315
  192    H    GLY   8           H        GLY   8  -1.769   0.328  -6.120
  193   1HA   GLY   8          1HA       GLY   8  -4.493  -0.574  -6.221
  194   2HA   GLY   8          2HA       GLY   8  -4.158   0.439  -7.623
  195    H    SER   9           H        SER   9  -3.538  -0.702  -9.373
  196    HA   SER   9           HA       SER   9  -3.105  -3.422  -9.555
  197   1HB   SER   9          1HB       SER   9  -3.163  -1.641 -11.435
  198   2HB   SER   9          2HB       SER   9  -1.423  -1.525 -11.190
  199    HG   SER   9           HG       SER   9  -1.271  -3.737 -11.628
  200    H    ASP  10           H        ASP  10  -0.668  -0.958  -8.759
  201    HA   ASP  10           HA       ASP  10   1.515  -2.858  -8.647
  202   1HB   ASP  10          1HB       ASP  10   1.184  -0.059  -7.541
  203   2HB   ASP  10          2HB       ASP  10   2.681  -0.982  -7.409
  204    H    LEU  11           H        LEU  11  -0.964  -1.843  -6.450
  205    HA   LEU  11           HA       LEU  11   0.315  -2.674  -4.009
  206   1HB   LEU  11          1HB       LEU  11  -2.262  -1.656  -4.808
  207   2HB   LEU  11          2HB       LEU  11  -2.473  -3.037  -3.731
  208    HG   LEU  11           HG       LEU  11  -0.539  -0.814  -3.095
  209   1HD1  LEU  11          1HD1      LEU  11  -3.304  -0.483  -3.314
  210   2HD1  LEU  11          2HD1      LEU  11  -2.192   0.562  -2.428
  211   3HD1  LEU  11          3HD1      LEU  11  -3.028  -0.747  -1.593
  212   1HD2  LEU  11          1HD2      LEU  11  -2.045  -2.486  -1.118
  213   2HD2  LEU  11          2HD2      LEU  11  -0.435  -1.780  -0.983
  214   3HD2  LEU  11          3HD2      LEU  11  -0.689  -3.214  -1.978
  215    H    VAL  12           H        VAL  12  -2.290  -4.239  -5.847
  216    HA   VAL  12           HA       VAL  12  -2.144  -6.736  -4.520
  217    HB   VAL  12           HB       VAL  12  -3.490  -7.599  -6.271
  218   1HG1  VAL  12          1HG1      VAL  12  -4.169  -5.283  -5.100
  219   2HG1  VAL  12          2HG1      VAL  12  -5.190  -6.045  -6.318
  220   3HG1  VAL  12          3HG1      VAL  12  -4.112  -4.725  -6.771
  221   1HG2  VAL  12          1HG2      VAL  12  -2.113  -5.524  -7.997
  222   2HG2  VAL  12          2HG2      VAL  12  -3.546  -6.403  -8.530
  223   3HG2  VAL  12          3HG2      VAL  12  -2.058  -7.279  -8.171
  224    H    GLU  13           H        GLU  13  -0.163  -5.340  -7.007
  225    HA   GLU  13           HA       GLU  13   1.124  -7.720  -7.934
  226   1HB   GLU  13          1HB       GLU  13   1.345  -5.402  -8.948
  227   2HB   GLU  13          2HB       GLU  13   2.414  -4.991  -7.607
  228   1HG   GLU  13          1HG       GLU  13   3.827  -6.992  -8.252
  229   2HG   GLU  13          2HG       GLU  13   2.843  -7.128  -9.710
  230    H    ALA  14           H        ALA  14   1.601  -5.629  -5.139
  231    HA   ALA  14           HA       ALA  14   3.949  -7.143  -4.223
  232   1HB   ALA  14          1HB       ALA  14   3.478  -4.623  -3.836
  233   2HB   ALA  14          2HB       ALA  14   4.073  -5.560  -2.465
  234   3HB   ALA  14          3HB       ALA  14   2.357  -5.165  -2.587
  235    H    LEU  15           H        LEU  15   0.528  -7.346  -4.001
  236    HA   LEU  15           HA       LEU  15   0.571  -8.881  -1.479
  237   1HB   LEU  15          1HB       LEU  15  -1.642  -8.149  -3.415
  238   2HB   LEU  15          2HB       LEU  15  -1.899  -9.148  -1.984
  239    HG   LEU  15           HG       LEU  15  -0.483  -6.540  -1.635
  240   1HD1  LEU  15          1HD1      LEU  15  -3.174  -5.960  -1.187
  241   2HD1  LEU  15          2HD1      LEU  15  -3.176  -6.828  -2.724
  242   3HD1  LEU  15          3HD1      LEU  15  -2.196  -5.373  -2.531
  243   1HD2  LEU  15          1HD2      LEU  15  -2.456  -6.956   0.308
  244   2HD2  LEU  15          2HD2      LEU  15  -0.734  -7.299   0.479
  245   3HD2  LEU  15          3HD2      LEU  15  -1.838  -8.570  -0.044
  246    H    TYR  16           H        TYR  16   0.324  -9.334  -4.922
  247    HA   TYR  16           HA       TYR  16  -0.316 -12.159  -4.821
  248   1HB   TYR  16          1HB       TYR  16  -0.886 -11.188  -6.870
  249   2HB   TYR  16          2HB       TYR  16   0.570 -10.198  -6.919
  250    HD1  TYR  16           HD1      TYR  16  -0.886 -13.477  -7.681
  251    HD2  TYR  16           HD2      TYR  16   2.743 -11.179  -7.569
  252    HE1  TYR  16           HE1      TYR  16   0.241 -15.187  -9.086
  253    HE2  TYR  16           HE2      TYR  16   3.870 -12.887  -8.973
  254    HH   TYR  16           HH       TYR  16   2.217 -15.893  -9.889
  255    H    LEU  17           H        LEU  17   2.571 -10.227  -4.630
  256    HA   LEU  17           HA       LEU  17   4.312 -12.600  -4.990
  257   1HB   LEU  17          1HB       LEU  17   5.081 -10.627  -6.133
  258   2HB   LEU  17          2HB       LEU  17   4.876  -9.640  -4.687
  259    HG   LEU  17           HG       LEU  17   6.587 -11.195  -3.574
  260   1HD1  LEU  17          1HD1      LEU  17   7.425 -11.794  -6.405
  261   2HD1  LEU  17          2HD1      LEU  17   6.298 -12.860  -5.565
  262   3HD1  LEU  17          3HD1      LEU  17   7.915 -12.598  -4.914
  263   1HD2  LEU  17          1HD2      LEU  17   8.138  -9.599  -4.047
  264   2HD2  LEU  17          2HD2      LEU  17   6.847  -8.850  -4.984
  265   3HD2  LEU  17          3HD2      LEU  17   8.032  -9.883  -5.784
  266    H    VAL  18           H        VAL  18   2.916 -10.643  -2.518
  267    HA   VAL  18           HA       VAL  18   4.866 -11.468  -0.471
  268    HB   VAL  18           HB       VAL  18   2.434  -9.701  -0.522
  269   1HG1  VAL  18          1HG1      VAL  18   3.560 -11.152   1.849
  270   2HG1  VAL  18          2HG1      VAL  18   1.886 -10.727   1.491
  271   3HG1  VAL  18          3HG1      VAL  18   3.009  -9.490   2.057
  272   1HG2  VAL  18          1HG2      VAL  18   3.963  -8.048  -0.250
  273   2HG2  VAL  18          2HG2      VAL  18   5.155  -9.265  -0.708
  274   3HG2  VAL  18          3HG2      VAL  18   4.830  -8.945   0.995
  275    H    CYS  19           H        CYS  19   1.473 -12.050  -1.260
  276    HA   CYS  19           HA       CYS  19   1.156 -14.006   0.877
  277   1HB   CYS  19          1HB       CYS  19  -0.648 -13.523  -1.507
  278   2HB   CYS  19          2HB       CYS  19  -1.081 -14.304   0.014
  279    H    GLY  20           H        GLY  20   1.162 -14.258  -2.708
  280   1HA   GLY  20          1HA       GLY  20   1.562 -16.142  -4.062
  281   2HA   GLY  20          2HA       GLY  20   2.805 -16.534  -2.870
  282    H    GLU  21           H        GLU  21   2.308 -18.016  -1.201
  283    HA   GLU  21           HA       GLU  21  -0.326 -19.406  -1.494
  284   1HB   GLU  21          1HB       GLU  21   1.811 -20.679  -2.204
  285   2HB   GLU  21          2HB       GLU  21   2.191 -20.736  -0.483
  286   1HG   GLU  21          1HG       GLU  21   0.198 -21.952   0.015
  287   2HG   GLU  21          2HG       GLU  21  -0.468 -21.652  -1.590
  288    H    ARG  22           H        ARG  22  -0.672 -17.498   0.146
  289    HA   ARG  22           HA       ARG  22  -0.177 -18.591   2.883
  290   1HB   ARG  22          1HB       ARG  22   0.211 -15.813   1.811
  291   2HB   ARG  22          2HB       ARG  22  -0.271 -16.024   3.495
  292   1HG   ARG  22          1HG       ARG  22   1.867 -17.859   2.752
  293   2HG   ARG  22          2HG       ARG  22   2.334 -16.177   2.499
  294   1HD   ARG  22          1HD       ARG  22   0.990 -16.156   4.949
  295   2HD   ARG  22          2HD       ARG  22   1.961 -17.627   4.997
  296    HE   ARG  22           HE       ARG  22   3.005 -15.007   5.292
  297   1HH1  ARG  22          1HH1      ARG  22   3.589 -18.088   3.888
  298   2HH1  ARG  22          2HH1      ARG  22   5.257 -17.770   3.547
  299   1HH2  ARG  22          1HH2      ARG  22   5.142 -14.498   4.688
  300   2HH2  ARG  22          2HH2      ARG  22   6.137 -15.738   4.001
  301    H    GLY  23           H        GLY  23  -2.461 -17.777   0.590
  302   1HA   GLY  23          1HA       GLY  23  -4.830 -18.150   1.069
  303   2HA   GLY  23          2HA       GLY  23  -4.551 -17.553   2.705
  304    H    PHE  24           H        PHE  24  -3.143 -15.931  -0.031
  305    HA   PHE  24           HA       PHE  24  -3.817 -13.337   0.521
  306   1HB   PHE  24          1HB       PHE  24  -2.488 -14.081  -1.451
  307   2HB   PHE  24          2HB       PHE  24  -3.972 -14.602  -2.239
  308    HD1  PHE  24           HD1      PHE  24  -3.833 -11.583  -0.111
  309    HD2  PHE  24           HD2      PHE  24  -3.738 -13.105  -4.130
  310    HE1  PHE  24           HE1      PHE  24  -4.171  -9.288  -0.990
  311    HE2  PHE  24           HE2      PHE  24  -4.079 -10.811  -5.008
  312    HZ   PHE  24           HZ       PHE  24  -4.295  -8.900  -3.438
  313    H    PHE  25           H        PHE  25  -5.635 -12.021   0.374
  314    HA   PHE  25           HA       PHE  25  -8.124 -13.207  -0.753
  315   1HB   PHE  25          1HB       PHE  25  -8.265 -13.640   1.633
  316   2HB   PHE  25          2HB       PHE  25  -7.823 -11.973   2.001
  317    HD1  PHE  25           HD1      PHE  25 -10.200 -13.419  -0.517
  318    HD2  PHE  25           HD2      PHE  25  -9.688 -10.918   2.941
  319    HE1  PHE  25           HE1      PHE  25 -12.589 -12.755  -0.643
  320    HE2  PHE  25           HE2      PHE  25 -12.076 -10.255   2.815
  321    HZ   PHE  25           HZ       PHE  25 -13.526 -11.174   1.023
  322    H    TYR  26           H        TYR  26  -8.949 -11.760  -2.185
  323    HA   TYR  26           HA       TYR  26  -9.303  -8.974  -1.551
  324   1HB   TYR  26          1HB       TYR  26  -6.816  -9.065  -2.009
  325   2HB   TYR  26          2HB       TYR  26  -7.203  -9.547  -3.660
  326    HD1  TYR  26           HD1      TYR  26  -8.426  -6.981  -1.198
  327    HD2  TYR  26           HD2      TYR  26  -7.165  -7.824  -5.218
  328    HE1  TYR  26           HE1      TYR  26  -8.795  -4.606  -1.811
  329    HE2  TYR  26           HE2      TYR  26  -7.532  -5.447  -5.831
  330    HH   TYR  26           HH       TYR  26  -7.554  -3.091  -4.128
  331    H    THR  27           H        THR  27 -10.521  -7.886  -3.228
  332    HA   THR  27           HA       THR  27 -11.737  -9.800  -5.159
  333    HB   THR  27           HB       THR  27 -13.173  -8.484  -3.502
  334    HG1  THR  27           HG1      THR  27 -13.724  -7.953  -6.225
  335   1HG2  THR  27          1HG2      THR  27 -13.336  -6.143  -5.181
  336   2HG2  THR  27          2HG2      THR  27 -11.688  -6.343  -4.590
  337   3HG2  THR  27          3HG2      THR  27 -13.028  -6.241  -3.448
  338    H    LYS  28           H        LYS  28 -12.120  -9.060  -7.363
  339    HA   LYS  28           HA       LYS  28  -9.895  -7.401  -8.354
  340   1HB   LYS  28          1HB       LYS  28 -12.099  -8.732  -9.950
  341   2HB   LYS  28          2HB       LYS  28 -10.530  -8.186 -10.543
  342   1HG   LYS  28          1HG       LYS  28 -10.551 -10.148  -8.290
  343   2HG   LYS  28          2HG       LYS  28 -10.961 -10.743  -9.898
  344   1HD   LYS  28          1HD       LYS  28  -8.745 -10.867 -10.299
  345   2HD   LYS  28          2HD       LYS  28  -8.740  -9.103 -10.320
  346   1HE   LYS  28          1HE       LYS  28  -7.180  -9.460  -8.656
  347   2HE   LYS  28          2HE       LYS  28  -8.645  -9.437  -7.675
  348   1HZ   LYS  28          1HZ       LYS  28  -6.993 -11.714  -8.501
  349   2HZ   LYS  28          2HZ       LYS  28  -8.658 -11.962  -8.272
  350   3HZ   LYS  28          3HZ       LYS  28  -7.699 -11.383  -6.995
  351    HA   PRO  29           HA       PRO  29 -12.371  -3.788  -8.783
  352   1HB   PRO  29          1HB       PRO  29 -10.796  -2.474 -10.614
  353   2HB   PRO  29          2HB       PRO  29 -10.386  -2.617  -8.895
  354   1HG   PRO  29          1HG       PRO  29  -9.210  -4.049 -11.231
  355   2HG   PRO  29          2HG       PRO  29  -8.479  -3.671  -9.663
  356   1HD   PRO  29          1HD       PRO  29  -9.517  -6.187 -10.446
  357   2HD   PRO  29          2HD       PRO  29  -9.088  -5.703  -8.792
  358    H    THR  30           H        THR  30 -11.730  -5.958 -11.361
  359    HA   THR  30           HA       THR  30 -12.966  -6.448 -13.298
  360    HB   THR  30           HB       THR  30 -14.931  -4.281 -12.617
  361    HG1  THR  30           HG1      THR  30 -15.506  -5.247 -10.851
  362   1HG2  THR  30          1HG2      THR  30 -14.909  -6.083 -14.591
  363   2HG2  THR  30          2HG2      THR  30 -16.410  -5.580 -13.813
  364   3HG2  THR  30          3HG2      THR  30 -15.632  -7.089 -13.336
  Start of MODEL   20
    1   1H    GLY   1          1H        GLY   1 -11.930  10.792   2.394
    2   2H    GLY   1          2H        GLY   1 -10.246  10.731   2.173
    3   3H    GLY   1          3H        GLY   1 -10.964   9.913   3.478
    4   1HA   GLY   1          1HA       GLY   1 -12.162   8.626   1.621
    5   2HA   GLY   1          2HA       GLY   1 -10.864   9.227   0.547
    6    H    GLY   2           H        GLY   2 -10.430   6.870   0.426
    7   1HA   GLY   2          1HA       GLY   2  -9.354   5.373   2.557
    8   2HA   GLY   2          2HA       GLY   2 -11.060   4.938   2.456
    9    H    GLY   3           H        GLY   3  -8.599   5.646  -0.044
   10   1HA   GLY   3          1HA       GLY   3  -8.941   2.876  -1.066
   11   2HA   GLY   3          2HA       GLY   3  -9.270   4.214  -2.167
   12    H    GLU   4           H        GLU   4  -6.846   4.973   0.084
   13    HA   GLU   4           HA       GLU   4  -4.688   4.081  -1.769
   14   1HB   GLU   4          1HB       GLU   4  -3.623   6.290  -1.624
   15   2HB   GLU   4          2HB       GLU   4  -5.249   6.445  -2.292
   16   1HG   GLU   4          1HG       GLU   4  -5.895   6.753   0.270
   17   2HG   GLU   4          2HG       GLU   4  -4.214   7.273   0.389
   18    H    GLN   5           H        GLN   5  -4.305   2.478  -0.063
   19    HA   GLN   5           HA       GLN   5  -3.409   3.535   2.549
   20   1HB   GLN   5          1HB       GLN   5  -3.250   1.178   3.210
   21   2HB   GLN   5          2HB       GLN   5  -4.817   1.486   2.463
   22   1HG   GLN   5          1HG       GLN   5  -3.789   0.714   0.266
   23   2HG   GLN   5          2HG       GLN   5  -2.407   0.159   1.209
   24   1HE2  GLN   5          1HE2      GLN   5  -5.314  -0.903  -0.067
   25   2HE2  GLN   5          2HE2      GLN   5  -5.612  -2.200   0.986
   26    H    CYS   6           H        CYS   6  -2.097   2.433  -0.454
   27    HA   CYS   6           HA       CYS   6   0.636   2.793   0.682
   28   1HB   CYS   6          1HB       CYS   6  -0.346   0.490  -1.015
   29   2HB   CYS   6          2HB       CYS   6   1.364   0.884  -0.848
   30    H    CYS   7           H        CYS   7  -1.559   3.897  -1.467
   31    HA   CYS   7           HA       CYS   7   0.207   4.196  -3.795
   32   1HB   CYS   7          1HB       CYS   7  -2.334   3.997  -3.915
   33   2HB   CYS   7          2HB       CYS   7  -2.404   5.636  -3.267
   34    H    THR   8           H        THR   8  -0.832   6.088  -1.017
   35    HA   THR   8           HA       THR   8   0.739   8.413  -2.014
   36    HB   THR   8           HB       THR   8  -0.366   9.686  -0.239
   37    HG1  THR   8           HG1      THR   8  -1.584   7.212   0.417
   38   1HG2  THR   8          1HG2      THR   8  -1.731   9.715  -2.127
   39   2HG2  THR   8          2HG2      THR   8  -2.830   9.063  -0.912
   40   3HG2  THR   8          3HG2      THR   8  -2.037   7.980  -2.055
   41    H    SER   9           H        SER   9   0.282   6.589   1.037
   42    HA   SER   9           HA       SER   9   2.900   7.512   2.008
   43   1HB   SER   9          1HB       SER   9   0.894   7.186   3.513
   44   2HB   SER   9          2HB       SER   9   1.048   5.453   3.242
   45    HG   SER   9           HG       SER   9   2.628   5.435   4.616
   46    H    ILE  10           H        ILE  10   4.320   5.638   3.008
   47    HA   ILE  10           HA       ILE  10   4.652   3.610   0.843
   48    HB   ILE  10           HB       ILE  10   6.711   4.347   2.930
   49   1HG1  ILE  10          1HG1      ILE  10   5.864   6.362   1.623
   50   2HG1  ILE  10          2HG1      ILE  10   7.585   6.022   1.440
   51   1HG2  ILE  10          1HG2      ILE  10   7.836   2.712   1.862
   52   2HG2  ILE  10          2HG2      ILE  10   7.836   3.726   0.420
   53   3HG2  ILE  10          3HG2      ILE  10   6.548   2.546   0.668
   54   1HD1  ILE  10          1HD1      ILE  10   7.355   5.660  -0.773
   55   2HD1  ILE  10          2HD1      ILE  10   5.707   6.272  -0.626
   56   3HD1  ILE  10          3HD1      ILE  10   6.018   4.541  -0.506
   57    H    CYS  11           H        CYS  11   4.726   1.423   1.367
   58    HA   CYS  11           HA       CYS  11   4.302   0.730   4.249
   59   1HB   CYS  11          1HB       CYS  11   3.113  -0.947   2.065
   60   2HB   CYS  11          2HB       CYS  11   2.564  -0.728   3.725
   61    H    SER  12           H        SER  12   4.461  -1.983   4.137
   62    HA   SER  12           HA       SER  12   6.852  -2.687   2.539
   63   1HB   SER  12          1HB       SER  12   7.924  -1.968   4.543
   64   2HB   SER  12          2HB       SER  12   6.725  -2.759   5.556
   65    HG   SER  12           HG       SER  12   8.757  -3.908   5.285
   66    H    LEU  13           H        LEU  13   7.381  -5.100   3.071
   67    HA   LEU  13           HA       LEU  13   5.137  -6.655   2.304
   68   1HB   LEU  13          1HB       LEU  13   6.548  -8.521   2.400
   69   2HB   LEU  13          2HB       LEU  13   7.697  -7.203   2.190
   70    HG   LEU  13           HG       LEU  13   6.911  -8.316   4.900
   71   1HD1  LEU  13          1HD1      LEU  13   8.934  -9.603   4.868
   72   2HD1  LEU  13          2HD1      LEU  13   9.453  -8.866   3.353
   73   3HD1  LEU  13          3HD1      LEU  13   8.078  -9.971   3.370
   74   1HD2  LEU  13          1HD2      LEU  13   9.036  -7.149   5.563
   75   2HD2  LEU  13          2HD2      LEU  13   7.782  -6.047   4.994
   76   3HD2  LEU  13          3HD2      LEU  13   9.124  -6.479   3.933
   77    H    TYR  14           H        TYR  14   6.020  -5.437   5.353
   78    HA   TYR  14           HA       TYR  14   4.857  -7.430   7.050
   79   1HB   TYR  14          1HB       TYR  14   5.576  -4.548   7.290
   80   2HB   TYR  14          2HB       TYR  14   4.546  -5.257   8.531
   81    HD1  TYR  14           HD1      TYR  14   7.904  -4.953   7.257
   82    HD2  TYR  14           HD2      TYR  14   5.336  -7.392   9.688
   83    HE1  TYR  14           HE1      TYR  14   9.895  -6.001   8.307
   84    HE2  TYR  14           HE2      TYR  14   7.326  -8.441  10.741
   85    HH   TYR  14           HH       TYR  14   9.543  -8.453  10.875
   86    H    GLN  15           H        GLN  15   3.581  -4.253   6.132
   87    HA   GLN  15           HA       GLN  15   0.930  -4.771   7.019
   88   1HB   GLN  15          1HB       GLN  15   0.700  -2.592   6.480
   89   2HB   GLN  15          2HB       GLN  15   2.311  -2.627   5.773
   90   1HG   GLN  15          1HG       GLN  15   1.470  -3.051   3.599
   91   2HG   GLN  15          2HG       GLN  15  -0.111  -3.540   4.214
   92   1HE2  GLN  15          1HE2      GLN  15   1.410  -0.737   5.667
   93   2HE2  GLN  15          2HE2      GLN  15   0.405   0.423   4.942
   94    H    LEU  16           H        LEU  16   2.512  -5.276   3.919
   95    HA   LEU  16           HA       LEU  16   0.178  -6.235   2.529
   96   1HB   LEU  16          1HB       LEU  16   3.076  -6.982   2.020
   97   2HB   LEU  16          2HB       LEU  16   1.743  -7.070   0.868
   98    HG   LEU  16           HG       LEU  16   2.527  -4.472   2.190
   99   1HD1  LEU  16          1HD1      LEU  16   3.841  -3.969   0.164
  100   2HD1  LEU  16          2HD1      LEU  16   3.530  -5.595  -0.445
  101   3HD1  LEU  16          3HD1      LEU  16   4.503  -5.368   1.008
  102   1HD2  LEU  16          1HD2      LEU  16   1.261  -3.485   0.416
  103   2HD2  LEU  16          2HD2      LEU  16   0.286  -4.832   1.004
  104   3HD2  LEU  16          3HD2      LEU  16   1.215  -4.999  -0.485
  105    H    GLU  17           H        GLU  17   2.586  -7.701   4.636
  106    HA   GLU  17           HA       GLU  17   1.670 -10.434   4.132
  107   1HB   GLU  17          1HB       GLU  17   3.592  -9.121   6.036
  108   2HB   GLU  17          2HB       GLU  17   3.035 -10.760   6.370
  109   1HG   GLU  17          1HG       GLU  17   3.702 -10.654   3.611
  110   2HG   GLU  17          2HG       GLU  17   5.030  -9.903   4.496
  111    H    ASN  18           H        ASN  18   0.669  -7.788   6.053
  112    HA   ASN  18           HA       ASN  18  -0.681  -9.429   8.073
  113   1HB   ASN  18          1HB       ASN  18   0.029  -6.658   7.751
  114   2HB   ASN  18          2HB       ASN  18  -1.698  -6.782   8.086
  115   1HD2  ASN  18          1HD2      ASN  18  -0.077  -5.670  10.076
  116   2HD2  ASN  18          2HD2      ASN  18   0.074  -6.755  11.372
  117    H    TYR  19           H        TYR  19  -1.289  -8.854   4.894
  118    HA   TYR  19           HA       TYR  19  -4.232  -8.598   5.256
  119   1HB   TYR  19          1HB       TYR  19  -2.339  -8.083   2.996
  120   2HB   TYR  19          2HB       TYR  19  -4.011  -8.495   2.617
  121    HD1  TYR  19           HD1      TYR  19  -2.092  -5.771   2.692
  122    HD2  TYR  19           HD2      TYR  19  -5.547  -7.275   4.757
  123    HE1  TYR  19           HE1      TYR  19  -2.784  -3.449   3.225
  124    HE2  TYR  19           HE2      TYR  19  -6.240  -4.953   5.291
  125    HH   TYR  19           HH       TYR  19  -5.571  -2.795   5.311
  126    H    CYS  20           H        CYS  20  -1.739 -10.780   4.168
  127    HA   CYS  20           HA       CYS  20  -3.799 -12.724   3.252
  128   1HB   CYS  20          1HB       CYS  20  -0.836 -13.210   3.100
  129   2HB   CYS  20          2HB       CYS  20  -2.115 -13.803   2.040
  130    H    ASN  21           H        ASN  21  -2.461 -15.098   3.758
  131    HA   ASN  21           HA       ASN  21  -2.000 -16.656   5.457
  132   1HB   ASN  21          1HB       ASN  21  -1.557 -14.276   7.276
  133   2HB   ASN  21          2HB       ASN  21  -0.916 -15.909   7.464
  134   1HD2  ASN  21          1HD2      ASN  21   0.515 -16.643   5.497
  135   2HD2  ASN  21          2HD2      ASN  21   1.548 -15.466   4.842
  136   1H    PHE   1          1H        PHE   1  15.682  -6.900  -0.769
  137   2H    PHE   1          2H        PHE   1  15.276  -6.074   0.658
  138   3H    PHE   1          3H        PHE   1  16.360  -5.378  -0.451
  139    HA   PHE   1           HA       PHE   1  14.657  -5.068  -2.064
  140   1HB   PHE   1          1HB       PHE   1  12.295  -5.730  -1.420
  141   2HB   PHE   1          2HB       PHE   1  13.377  -7.085  -1.746
  142    HD1  PHE   1           HD1      PHE   1  11.886  -5.028   0.982
  143    HD2  PHE   1           HD2      PHE   1  13.908  -8.675  -0.061
  144    HE1  PHE   1           HE1      PHE   1  11.480  -5.906   3.267
  145    HE2  PHE   1           HE2      PHE   1  13.502  -9.552   2.225
  146    HZ   PHE   1           HZ       PHE   1  12.289  -8.168   3.889
  147    H    VAL   2           H        VAL   2  13.313  -3.181  -1.979
  148    HA   VAL   2           HA       VAL   2  13.283  -1.851   0.700
  149    HB   VAL   2           HB       VAL   2  14.775  -0.966  -1.316
  150   1HG1  VAL   2          1HG1      VAL   2  12.462   0.810  -1.844
  151   2HG1  VAL   2          2HG1      VAL   2  12.388  -0.792  -2.575
  152   3HG1  VAL   2          3HG1      VAL   2  13.744   0.277  -2.931
  153   1HG2  VAL   2          1HG2      VAL   2  13.345   0.305   0.905
  154   2HG2  VAL   2          2HG2      VAL   2  13.820   1.439  -0.360
  155   3HG2  VAL   2          3HG2      VAL   2  15.039   0.442   0.435
  156    H    ASN   3           H        ASN   3  11.728   0.335  -0.148
  157    HA   ASN   3           HA       ASN   3   9.100  -1.026  -0.567
  158   1HB   ASN   3          1HB       ASN   3   9.596   1.666   0.732
  159   2HB   ASN   3          2HB       ASN   3   8.084   0.757   0.711
  160   1HD2  ASN   3          1HD2      ASN   3   9.179  -1.861   1.268
  161   2HD2  ASN   3          2HD2      ASN   3   9.775  -1.848   2.856
  162    H    GLN   4           H        GLN   4   7.442   0.471  -1.633
  163    HA   GLN   4           HA       GLN   4   8.512   2.559  -3.383
  164   1HB   GLN   4          1HB       GLN   4   8.630  -0.048  -4.342
  165   2HB   GLN   4          2HB       GLN   4   7.127   0.573  -5.027
  166   1HG   GLN   4          1HG       GLN   4   8.286   1.789  -6.523
  167   2HG   GLN   4          2HG       GLN   4   9.129   2.618  -5.213
  168   1HE2  GLN   4          1HE2      GLN   4  11.352   2.264  -5.146
  169   2HE2  GLN   4          2HE2      GLN   4  12.149   0.941  -5.852
  170    H    HIS   5           H        HIS   5   6.598   3.234  -4.952
  171    HA   HIS   5           HA       HIS   5   4.212   3.458  -3.215
  172   1HB   HIS   5          1HB       HIS   5   4.189   4.783  -5.862
  173   2HB   HIS   5          2HB       HIS   5   3.774   5.431  -4.277
  174    HD2  HIS   5           HD2      HIS   5   6.352   5.730  -2.643
  175    HE1  HIS   5           HE1      HIS   5   8.423   6.851  -6.154
  176    HE2  HIS   5           HE2      HIS   5   8.504   6.833  -3.604
  177    H    LEU   6           H        LEU   6   2.694   1.889  -3.466
  178    HA   LEU   6           HA       LEU   6   2.320   0.713  -6.184
  179   1HB   LEU   6          1HB       LEU   6   1.536  -0.300  -3.434
  180   2HB   LEU   6          2HB       LEU   6   1.074  -1.089  -4.941
  181    HG   LEU   6           HG       LEU   6   3.051  -2.205  -4.188
  182   1HD1  LEU   6          1HD1      LEU   6   2.919  -1.419  -6.628
  183   2HD1  LEU   6          2HD1      LEU   6   4.516  -1.874  -6.032
  184   3HD1  LEU   6          3HD1      LEU   6   4.077  -0.170  -6.172
  185   1HD2  LEU   6          1HD2      LEU   6   4.583  -1.177  -2.894
  186   2HD2  LEU   6          2HD2      LEU   6   3.636   0.304  -3.031
  187   3HD2  LEU   6          3HD2      LEU   6   4.942  -0.016  -4.172
  188    H    CYS   7           H        CYS   7   0.191   0.659  -7.084
  189    HA   CYS   7           HA       CYS   7  -1.968   1.991  -5.561
  190   1HB   CYS   7          1HB       CYS   7  -1.038   2.995  -8.268
  191   2HB   CYS   7          2HB       CYS   7  -2.398   3.624  -7.336
  192    H    GLY   8           H        GLY   8  -3.660   0.634  -5.791
  193   1HA   GLY   8          1HA       GLY   8  -5.198  -0.837  -6.767
  194   2HA   GLY   8          2HA       GLY   8  -4.849  -0.005  -8.282
  195    H    SER   9           H        SER   9  -4.328  -1.486  -9.799
  196    HA   SER   9           HA       SER   9  -3.651  -4.130  -9.551
  197   1HB   SER   9          1HB       SER   9  -3.820  -2.546 -11.674
  198   2HB   SER   9          2HB       SER   9  -2.064  -2.561 -11.545
  199    HG   SER   9           HG       SER   9  -2.263  -4.898 -11.470
  200    H    ASP  10           H        ASP  10  -1.109  -1.628  -9.942
  201    HA   ASP  10           HA       ASP  10   1.116  -3.189  -9.436
  202   1HB   ASP  10          1HB       ASP  10   0.519  -0.347  -8.619
  203   2HB   ASP  10          2HB       ASP  10   2.095  -1.087  -8.336
  204    H    LEU  11           H        LEU  11  -1.243  -2.067  -7.101
  205    HA   LEU  11           HA       LEU  11   0.298  -2.759  -4.762
  206   1HB   LEU  11          1HB       LEU  11  -2.361  -1.756  -5.328
  207   2HB   LEU  11          2HB       LEU  11  -2.422  -3.018  -4.097
  208    HG   LEU  11           HG       LEU  11  -0.586  -0.605  -4.034
  209   1HD1  LEU  11          1HD1      LEU  11  -3.314  -1.132  -3.008
  210   2HD1  LEU  11          2HD1      LEU  11  -2.524   0.402  -3.376
  211   3HD1  LEU  11          3HD1      LEU  11  -2.197  -0.415  -1.847
  212   1HD2  LEU  11          1HD2      LEU  11   0.588  -1.900  -2.595
  213   2HD2  LEU  11          2HD2      LEU  11  -0.669  -3.137  -2.576
  214   3HD2  LEU  11          3HD2      LEU  11  -0.784  -1.748  -1.497
  215    H    VAL  12           H        VAL  12  -1.572  -4.579  -7.025
  216    HA   VAL  12           HA       VAL  12  -1.936  -6.885  -5.277
  217    HB   VAL  12           HB       VAL  12  -2.074  -6.744  -8.303
  218   1HG1  VAL  12          1HG1      VAL  12  -2.751  -8.793  -6.232
  219   2HG1  VAL  12          2HG1      VAL  12  -2.084  -9.012  -7.851
  220   3HG1  VAL  12          3HG1      VAL  12  -3.801  -8.665  -7.643
  221   1HG2  VAL  12          1HG2      VAL  12  -4.625  -6.870  -6.968
  222   2HG2  VAL  12          2HG2      VAL  12  -4.029  -5.647  -8.091
  223   3HG2  VAL  12          3HG2      VAL  12  -3.713  -5.487  -6.363
  224    H    GLU  13           H        GLU  13   0.250  -5.982  -7.892
  225    HA   GLU  13           HA       GLU  13   1.767  -8.378  -7.974
  226   1HB   GLU  13          1HB       GLU  13   1.996  -6.406  -9.556
  227   2HB   GLU  13          2HB       GLU  13   2.890  -5.576  -8.282
  228   1HG   GLU  13          1HG       GLU  13   4.427  -7.617  -8.219
  229   2HG   GLU  13          2HG       GLU  13   3.647  -8.127  -9.717
  230    H    ALA  14           H        ALA  14   1.582  -5.804  -5.657
  231    HA   ALA  14           HA       ALA  14   4.030  -6.631  -4.255
  232   1HB   ALA  14          1HB       ALA  14   2.271  -4.335  -4.247
  233   2HB   ALA  14          2HB       ALA  14   3.895  -4.485  -3.575
  234   3HB   ALA  14          3HB       ALA  14   2.493  -4.936  -2.604
  235    H    LEU  15           H        LEU  15   0.617  -7.281  -4.185
  236    HA   LEU  15           HA       LEU  15   0.849  -8.555  -1.514
  237   1HB   LEU  15          1HB       LEU  15  -1.476  -7.907  -3.324
  238   2HB   LEU  15          2HB       LEU  15  -1.657  -9.001  -1.953
  239    HG   LEU  15           HG       LEU  15  -0.357  -6.323  -1.550
  240   1HD1  LEU  15          1HD1      LEU  15  -2.921  -5.845  -0.787
  241   2HD1  LEU  15          2HD1      LEU  15  -3.199  -6.871  -2.195
  242   3HD1  LEU  15          3HD1      LEU  15  -2.275  -5.378  -2.360
  243   1HD2  LEU  15          1HD2      LEU  15  -1.920  -6.868   0.615
  244   2HD2  LEU  15          2HD2      LEU  15  -0.244  -7.396   0.466
  245   3HD2  LEU  15          3HD2      LEU  15  -1.556  -8.502   0.062
  246    H    TYR  16           H        TYR  16   0.402  -9.286  -4.893
  247    HA   TYR  16           HA       TYR  16  -0.100 -12.123  -4.513
  248   1HB   TYR  16          1HB       TYR  16  -0.901 -11.381  -6.569
  249   2HB   TYR  16          2HB       TYR  16   0.461 -10.294  -6.824
  250    HD1  TYR  16           HD1      TYR  16  -0.171 -13.983  -6.400
  251    HD2  TYR  16           HD2      TYR  16   2.011 -10.895  -8.444
  252    HE1  TYR  16           HE1      TYR  16   0.941 -15.698  -7.809
  253    HE2  TYR  16           HE2      TYR  16   3.123 -12.609  -9.851
  254    HH   TYR  16           HH       TYR  16   3.342 -15.697  -9.159
  255    H    LEU  17           H        LEU  17   2.682 -10.083  -4.534
  256    HA   LEU  17           HA       LEU  17   4.492 -12.405  -4.936
  257   1HB   LEU  17          1HB       LEU  17   5.048 -10.447  -6.262
  258   2HB   LEU  17          2HB       LEU  17   5.020  -9.425  -4.825
  259    HG   LEU  17           HG       LEU  17   6.791 -11.391  -4.085
  260   1HD1  LEU  17          1HD1      LEU  17   8.362 -11.574  -6.025
  261   2HD1  LEU  17          2HD1      LEU  17   7.136 -10.814  -7.041
  262   3HD1  LEU  17          3HD1      LEU  17   6.822 -12.387  -6.306
  263   1HD2  LEU  17          1HD2      LEU  17   6.913  -8.834  -3.963
  264   2HD2  LEU  17          2HD2      LEU  17   7.600  -8.892  -5.587
  265   3HD2  LEU  17          3HD2      LEU  17   8.441  -9.669  -4.245
  266    H    VAL  18           H        VAL  18   3.431 -10.085  -2.546
  267    HA   VAL  18           HA       VAL  18   5.481 -10.653  -0.595
  268    HB   VAL  18           HB       VAL  18   2.779  -9.337  -0.524
  269   1HG1  VAL  18          1HG1      VAL  18   4.441 -10.125   1.887
  270   2HG1  VAL  18          2HG1      VAL  18   2.782 -10.611   1.542
  271   3HG1  VAL  18          3HG1      VAL  18   3.145  -8.929   1.931
  272   1HG2  VAL  18          1HG2      VAL  18   3.992  -7.408  -0.312
  273   2HG2  VAL  18          2HG2      VAL  18   5.270  -8.389  -1.029
  274   3HG2  VAL  18          3HG2      VAL  18   5.205  -8.165   0.719
  275    H    CYS  19           H        CYS  19   2.205 -11.847  -1.111
  276    HA   CYS  19           HA       CYS  19   2.670 -13.957   0.937
  277   1HB   CYS  19          1HB       CYS  19   0.032 -13.563  -0.438
  278   2HB   CYS  19          2HB       CYS  19   0.362 -14.084   1.213
  279    H    GLY  20           H        GLY  20   1.009 -13.776  -2.238
  280   1HA   GLY  20          1HA       GLY  20   1.402 -15.174  -4.130
  281   2HA   GLY  20          2HA       GLY  20   2.550 -16.108  -3.169
  282    H    GLU  21           H        GLU  21   1.829 -17.954  -2.139
  283    HA   GLU  21           HA       GLU  21  -1.094 -18.547  -2.391
  284   1HB   GLU  21          1HB       GLU  21   0.635 -19.906  -3.784
  285   2HB   GLU  21          2HB       GLU  21   1.038 -20.671  -2.246
  286   1HG   GLU  21          1HG       GLU  21  -1.825 -20.549  -2.530
  287   2HG   GLU  21          2HG       GLU  21  -1.124 -21.300  -3.964
  288    H    ARG  22           H        ARG  22  -2.093 -18.727  -0.467
  289    HA   ARG  22           HA       ARG  22  -1.370 -20.286   1.719
  290   1HB   ARG  22          1HB       ARG  22   0.250 -17.874   1.527
  291   2HB   ARG  22          2HB       ARG  22  -0.659 -17.918   3.038
  292   1HG   ARG  22          1HG       ARG  22   0.396 -19.843   3.779
  293   2HG   ARG  22          2HG       ARG  22   0.731 -20.413   2.144
  294   1HD   ARG  22          1HD       ARG  22   2.691 -19.265   2.009
  295   2HD   ARG  22          2HD       ARG  22   2.035 -17.859   2.846
  296    HE   ARG  22           HE       ARG  22   2.680 -18.842   4.935
  297   1HH1  ARG  22          1HH1      ARG  22   4.819 -19.766   2.770
  298   2HH1  ARG  22          2HH1      ARG  22   5.128 -21.362   3.367
  299   1HH2  ARG  22          1HH2      ARG  22   2.381 -21.389   5.483
  300   2HH2  ARG  22          2HH2      ARG  22   3.746 -22.282   4.901
  301    H    GLY  23           H        GLY  23  -2.670 -17.179   0.692
  302   1HA   GLY  23          1HA       GLY  23  -5.273 -17.333   1.212
  303   2HA   GLY  23          2HA       GLY  23  -4.679 -17.234   2.872
  304    H    PHE  24           H        PHE  24  -4.000 -15.584  -0.225
  305    HA   PHE  24           HA       PHE  24  -3.640 -13.051   1.251
  306   1HB   PHE  24          1HB       PHE  24  -1.949 -13.203  -0.330
  307   2HB   PHE  24          2HB       PHE  24  -2.958 -14.081  -1.476
  308    HD1  PHE  24           HD1      PHE  24  -3.620 -10.848   0.293
  309    HD2  PHE  24           HD2      PHE  24  -2.892 -12.821  -3.455
  310    HE1  PHE  24           HE1      PHE  24  -4.114  -8.737  -0.916
  311    HE2  PHE  24           HE2      PHE  24  -3.389 -10.713  -4.663
  312    HZ   PHE  24           HZ       PHE  24  -4.000  -8.670  -3.395
  313    H    PHE  25           H        PHE  25  -5.238 -11.565   1.389
  314    HA   PHE  25           HA       PHE  25  -7.179 -11.185  -0.758
  315   1HB   PHE  25          1HB       PHE  25  -7.871 -13.121   1.053
  316   2HB   PHE  25          2HB       PHE  25  -8.571 -11.685   1.800
  317    HD1  PHE  25           HD1      PHE  25  -8.393 -13.581  -1.414
  318    HD2  PHE  25           HD2      PHE  25 -10.557 -10.718   0.951
  319    HE1  PHE  25           HE1      PHE  25 -10.251 -13.628  -3.058
  320    HE2  PHE  25           HE2      PHE  25 -12.416 -10.767  -0.694
  321    HZ   PHE  25           HZ       PHE  25 -12.262 -12.221  -2.698
  322    H    TYR  26           H        TYR  26  -8.262  -9.146  -0.517
  323    HA   TYR  26           HA       TYR  26  -7.968  -7.637   1.972
  324   1HB   TYR  26          1HB       TYR  26  -6.451  -5.980   1.243
  325   2HB   TYR  26          2HB       TYR  26  -5.723  -7.487   0.692
  326    HD1  TYR  26           HD1      TYR  26  -7.245  -4.336  -0.301
  327    HD2  TYR  26           HD2      TYR  26  -5.961  -8.186  -1.710
  328    HE1  TYR  26           HE1      TYR  26  -7.311  -3.500  -2.636
  329    HE2  TYR  26           HE2      TYR  26  -6.027  -7.352  -4.047
  330    HH   TYR  26           HH       TYR  26  -7.362  -4.209  -4.839
  331    H    THR  27           H        THR  27  -8.684  -5.217   1.448
  332    HA   THR  27           HA       THR  27 -11.249  -5.462   0.020
  333    HB   THR  27           HB       THR  27 -10.464  -2.819   1.071
  334    HG1  THR  27           HG1      THR  27 -10.509  -5.150   2.654
  335   1HG2  THR  27          1HG2      THR  27 -12.748  -3.949   2.336
  336   2HG2  THR  27          2HG2      THR  27 -12.809  -4.408   0.635
  337   3HG2  THR  27          3HG2      THR  27 -12.707  -2.706   1.085
  338    H    LYS  28           H        LYS  28 -11.110  -5.215  -2.175
  339    HA   LYS  28           HA       LYS  28  -9.066  -3.449  -3.325
  340   1HB   LYS  28          1HB       LYS  28  -9.236  -5.237  -4.740
  341   2HB   LYS  28          2HB       LYS  28 -10.922  -5.534  -4.346
  342   1HG   LYS  28          1HG       LYS  28 -11.689  -3.896  -5.869
  343   2HG   LYS  28          2HG       LYS  28 -10.117  -3.101  -5.940
  344   1HD   LYS  28          1HD       LYS  28  -9.192  -4.765  -7.313
  345   2HD   LYS  28          2HD       LYS  28 -10.417  -5.950  -6.861
  346   1HE   LYS  28          1HE       LYS  28 -10.551  -4.730  -9.203
  347   2HE   LYS  28          2HE       LYS  28 -12.019  -5.038  -8.277
  348   1HZ   LYS  28          1HZ       LYS  28 -10.466  -2.521  -8.071
  349   2HZ   LYS  28          2HZ       LYS  28 -12.019  -2.833  -7.458
  350   3HZ   LYS  28          3HZ       LYS  28 -11.771  -2.720  -9.135
  351    HA   PRO  29           HA       PRO  29 -12.932  -1.032  -4.728
  352   1HB   PRO  29          1HB       PRO  29 -15.391  -1.903  -3.868
  353   2HB   PRO  29          2HB       PRO  29 -14.625  -2.453  -5.369
  354   1HG   PRO  29          1HG       PRO  29 -14.935  -3.901  -2.780
  355   2HG   PRO  29          2HG       PRO  29 -14.780  -4.554  -4.418
  356   1HD   PRO  29          1HD       PRO  29 -12.724  -4.433  -2.482
  357   2HD   PRO  29          2HD       PRO  29 -12.517  -4.771  -4.213
  358    H    THR  30           H        THR  30 -12.035  -1.805  -1.663
  359    HA   THR  30           HA       THR  30 -12.249  -0.742   0.420
  360    HB   THR  30           HB       THR  30 -12.321   1.628   0.356
  361    HG1  THR  30           HG1      THR  30 -13.944   2.427  -0.681
  362   1HG2  THR  30          1HG2      THR  30 -10.559   0.382  -1.146
  363   2HG2  THR  30          2HG2      THR  30 -10.705   2.137  -1.242
  364   3HG2  THR  30          3HG2      THR  30 -11.458   1.123  -2.473