*HEADER    PEPTIDE BINDING PROTEIN                 04-SEP-14   2MU9              
*TITLE     CHANGING ABRA PROTEIN PEPTIDE TO FIT THE HLA-DR B1*0301 MOLECULE      
*TITLE    2 RENDERS IT PROTECTION-INDUCING                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: P101/ACIDIC BASIC REPEAT ANTIGEN;                          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 161-180;                                      
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: PLASMODIUM FALCIPARUM;                          
*SOURCE   4 ORGANISM_TAXID: 5833                                                 
*KEYWDS    ACIDIC-BASIC REPEAT ANTIGEN (ABRA), PEPTIDE BINDING PROTEIN           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    21                                                                    
*AUTHOR    L.SALAZAR, M.ALBA, H.CURTIDOR, A.BERMUDEZ, L.VARGAS, Z.RIVERA,        
*AUTHOR   2 M.PATARROYO                                                          
*REVDAT   1   16-SEP-15 2MU9    0                                                


!BIOSYM restraint 1
!
#remote_prochiral_center
1:VAL_9:HG1*    1:VAL_9:HG2*    1:VAL_9:CG1     1:VAL_9:CG2     1:VAL_9:CB     
1:LEU_18:HD1*   1:LEU_18:HD2*   1:LEU_18:CD1    1:LEU_18:CD2    1:LEU_18:CG    
1:LEU_5:HD1*    1:LEU_5:HD2*    1:LEU_5:CD1     1:LEU_5:CD2     1:LEU_5:CG     
!
#chiral
1:LYS_1:CA         S
1:MET_2:CA         S
1:ASN_3:CA         S
1:MET_4:CA         S
1:LEU_5:CA         S
1:LYS_6:CA         S
1:GLU_7:CA         S
1:ASN_8:CA         S
1:VAL_9:CA         S
1:ASP_10:CA        S
1:TYR_11:CA        S
1:ILE_12:CA        S
1:ILE_12:CB        S
1:GLN_13:CA        S
1:LYS_14:CA        S
1:ASN_15:CA        S
1:GLN_16:CA        S
1:ASN_17:CA        S
1:LEU_18:CA        S
1:PHE_19:CA        S
1:LYS_20:CA        S
!
#distance
1:ASN_3:O          1:GLU_7:HN          1.800  2.500 30.00 30.00 1000.000
1:MET_4:O          1:ASN_8:HN          1.800  2.500 30.00 30.00 1000.000
1:LYS_6:O          1:ASP_10:HN         1.800  2.500 30.00 30.00 1000.000
1:ASN_8:O          1:ILE_12:HN         1.800  2.500 30.00 30.00 1000.000
1:VAL_9:O          1:GLN_13:HN         1.800  2.500 30.00 30.00 1000.000
1:ILE_12:O         1:GLN_16:HN         1.800  2.500 30.00 30.00 1000.000
1:LYS_14:O         1:LEU_18:HN         1.800  2.500 30.00 30.00 1000.000
!
#NOE_distance
1:MET_2:HN         1:MET_2:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASP_10:HN        1:ASP_10:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_17:HN        1:ASN_17:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_8:HN         1:ASN_8:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HN        1:ASN_15:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:PHE_19:HN        1:PHE_19:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HN         1:MET_4:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_3:HN         1:ASN_3:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_20:HN        1:LYS_20:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HN        1:LEU_18:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HN        1:LYS_14:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HN        1:GLN_16:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_1:HN         1:LYS_1:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_13:HN        1:GLN_13:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HN        1:ILE_12:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HN         1:VAL_9:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_6:HN         1:LYS_6:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HN         1:LEU_5:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_2:HN         1:LYS_1:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_3:HN         1:MET_2:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HN         1:ASN_3:HA          3.500  5.000  5.000 30.00 30.00 1000.000  0.00 !week:        
1:LEU_5:HN         1:MET_4:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_8:HN         1:GLU_7:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:VAL_9:HN         1:ASN_8:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:GLN_13:HN        1:ILE_12:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:LYS_14:HN        1:GLN_13:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:GLN_16:HN        1:ASN_15:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:LEU_5:HN         1:MET_2:HA          3.500  5.000  5.000 30.00 30.00 1000.000  0.00 !week:           
1:LEU_5:HN         1:ASN_3:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:GLN_16:HN        1:GLN_13:HA         3.500  5.000  5.000 30.00 30.00 1000.000  0.00 !week:        
1:ASN_17:HN        1:ASN_15:HA         3.500  5.000  5.000 30.00 30.00 1000.000  0.00 !week:         
1:ASN_8:HN         1:MET_4:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HN         1:LYS_1:HA          3.500  5.000  5.000 30.00 30.00 1000.000  0.00 !week:          
1:LYS_14:HN        1:ILE_12:HA         3.500  5.000  5.000 30.00 30.00 1000.000  0.00 !week:           
1:ASN_15:HN        1:ILE_12:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:VAL_9:HN         1:LYS_6:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:VAL_9:HN         1:VAL_9:HB          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HN         1:VAL_9:HGR*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HN         1:VAL_9:HGS*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HB         1:VAL_9:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HGR*       1:VAL_9:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HGS*       1:VAL_9:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HGR*       1:VAL_9:HB          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HGS*       1:VAL_9:HB          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HGS*       1:VAL_9:HGR*        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_2:HN         1:MET_2:HG*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_2:HN         1:MET_2:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_2:HB*        1:MET_2:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASP_10:HN        1:ASP_10:HBS        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASP_10:HN        1:ASP_10:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASP_10:HBS       1:ASP_10:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASP_10:HBR       1:ASP_10:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HN         1:MET_4:HGS         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HN         1:MET_4:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HGS        1:MET_4:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:MET_4:HB*        1:MET_4:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HN         1:MET_4:HGR         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HGR        1:MET_4:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:GLU_7:HN         1:GLU_7:HG*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLU_7:HN         1:GLU_7:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLU_7:HB*        1:GLU_7:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HN        1:ASN_15:HBS        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HN        1:ASN_15:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HBS       1:ASN_15:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HBR       1:ASN_15:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:PHE_19:HN        1:PHE_19:HBR        2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:PHE_19:HN        1:PHE_19:HBS        2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:PHE_19:HBR       1:PHE_19:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:PHE_19:HBS       1:PHE_19:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HN        1:LEU_18:HB*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HN        1:LEU_18:HG         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HN        1:LEU_18:HDR*       1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HN        1:LEU_18:HDS*       1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HB*       1:LEU_18:HA         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HG        1:LEU_18:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HDS*      1:LEU_18:HA         2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:ILE_12:HN        1:ILE_12:HB         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HN        1:ILE_12:HG1*       3.500  6.000  5.000 30.00 30.00 1000.000  0.00 !week:         
1:ILE_12:HN        1:ILE_12:HG2*       2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:ILE_12:HN        1:ILE_12:HD1*       1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HB        1:ILE_12:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HG2*      1:ILE_12:HA         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HD1*      1:ILE_12:HA         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HN        1:TYR_11:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HN        1:TYR_11:HBS        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HBR       1:TYR_11:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HBS       1:TYR_11:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HN         1:LEU_5:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HN         1:LEU_5:HG          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HN         1:LEU_5:HDR*        2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:      
1:LEU_5:HN         1:LEU_5:HDS*        2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:LEU_5:HDS*       1:LEU_5:HA          2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:LEU_5:HDR*       1:LEU_5:HA          2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:LEU_5:HG         1:LEU_5:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:LEU_5:HB*        1:LEU_5:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HN        1:GLN_16:HG*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HN        1:GLN_16:HB*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HG*       1:GLN_16:HA         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_13:HN        1:GLN_13:HG*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_13:HG*       1:GLN_13:HA         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_13:HBR       1:GLN_13:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_13:HBS       1:GLN_13:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_17:HN        1:ASN_17:HB*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_17:HB*       1:ASN_17:HA         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_1:HN         1:LYS_1:HD*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_1:HN         1:LYS_1:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_1:HN         1:LYS_1:HG*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_1:HB*        1:LYS_1:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:      
1:LYS_6:HN         1:LYS_6:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_6:HB*        1:LYS_6:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HN        1:LYS_14:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HN        1:LYS_14:HBS        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HN        1:LYS_14:HG*        2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:       
1:LYS_14:HBR       1:LYS_14:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_20:HN        1:LYS_20:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_20:HN        1:LYS_20:HBS        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_20:HBR       1:LYS_20:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_20:HBS       1:LYS_20:HA         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_8:HN         1:ASN_8:HBS         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_8:HN         1:ASN_8:HBR         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_8:HBS        1:ASN_8:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HBR       1:ASN_8:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HBS       1:ASN_8:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_3:HB*        1:ASN_3:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASP_10:HBS       1:GLU_7:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASP_10:HBR       1:GLU_7:HA          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_6:HB*        1:ASN_3:HA          3.500  6.000  5.000 30.00 30.00 1000.000  0.00 !week:             
1:LEU_5:HB*        1:MET_2:HA          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HB        1:VAL_9:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:       
1:ILE_12:HG2*      1:ILE_12:HB         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HD1*      1:ILE_12:HB         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HG2*      1:ILE_12:HG1*       1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HDR*       1:LEU_5:HB*         1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HDS*       1:LEU_5:HB*         1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HDR*       1:LEU_5:HG          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HDS*       1:LEU_5:HG          1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HDS*      1:LEU_18:HB*        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HDR*      1:LEU_18:HB*        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HDR*      1:LEU_18:HG         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HDS*      1:LEU_18:HG         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HG        1:LEU_18:HB*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HE21      1:GLN_16:HG*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HE22      1:GLN_16:HG*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HD21      1:ASN_15:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HD21      1:ASN_15:HBS        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_3:HD21       1:ASN_3:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_3:HD22       1:ASN_3:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_17:HD21      1:ASN_17:HB*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_17:HD22      1:ASN_17:HB*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:PHE_19:HD*       1:PHE_19:HBS        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:PHE_19:HD*       1:PHE_19:HBR        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HD*       1:TYR_11:HBS        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HD*       1:TYR_11:HBR        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HE*       1:TYR_11:HBS        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HE*       1:TYR_11:HBR        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:PHE_19:HD*       1:PHE_19:HA         1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HD*       1:ASN_8:HA          1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HD*       1:TYR_11:HA         1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HE*       1:TYR_11:HA         1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HN        1:ASN_17:HB*        3.500  6.000  5.000 30.00 30.00 1000.000  0.00 !week:       
1:ASN_17:HN        1:GLN_16:HG*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HN        1:ASN_15:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_3:HN         1:MET_2:HB*         3.500  6.000  5.000 30.00 30.00 1000.000  0.00 !week:           
1:LYS_1:HN         1:MET_2:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_17:HN        1:GLN_16:HB*        2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:       
1:ASN_8:HN         1:GLU_7:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_13:HN        1:ILE_12:HB         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HN        1:ASN_15:HBS        2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:PHE_19:HBS       1:PHE_19:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASP_10:HBR       1:ASP_10:HBS        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HBR       1:ASN_15:HBS        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HB*       1:GLN_16:HG*        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HB*       1:ASN_15:HBR        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_13:HBS       1:GLN_13:HG*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:VAL_9:HB         1:ASN_8:HBR         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:LYS_20:HBS       1:LYS_20:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HBS       1:LYS_14:HBR        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HG*       1:LYS_14:HBR        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HG*       1:LYS_14:HBS        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HD1*      1:ILE_12:HG1*       1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HD1*      1:ILE_12:HG2*       1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_15:HD22      1:ASN_15:HD21       1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:GLN_16:HE22      1:GLN_16:HE21       1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_17:HD22      1:ASN_17:HD21       1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_3:HD22       1:ASN_3:HD21        1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:TYR_11:HE*       1:TYR_11:HD*        1.800  6.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_5:HN         1:ASN_8:HN          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:ASN_15:HN        1:GLN_16:HN         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LEU_18:HN        1:ASN_17:HN         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HN        1:ILE_12:HN         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:         
1:LYS_14:HN        1:ASP_10:HN         3.500  5.000  5.000 30.00 30.00 1000.000  0.00 !week:        
1:GLN_16:HN        1:ASN_17:HN         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ILE_12:HN        1:GLN_13:HN         1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_3:HN         1:MET_2:HN          1.800  2.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:PHE_19:HD*       1:LEU_18:HN         2.800  5.500  3.500 30.00 30.00 1000.000  0.00 !medium:        
1:TYR_11:HD*       1:LYS_14:HN         2.800  5.500  3.500 30.00 30.00 1000.000  0.00 !medium:       
1:LYS_14:HG*       1:LYS_14:HE*        1.800  4.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:LYS_14:HBS       1:LYS_14:HE*        1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:MET_4:HN         1:ASN_3:HB*         1.800  3.800  2.800 30.00 30.00 1000.000  0.00 !strong:        
1:ASN_8:HN         1:LEU_5:HB*         3.500  6.000  5.000 30.00 30.00 1000.000  0.00 !week:        
1:ASP_10:HN        1:GLU_7:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:      
1:TYR_11:HN        1:ASP_10:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:                           
1:TYR_11:HN        1:ASN_8:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:GLU_7:HN         1:GLU_7:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:TYR_11:HN        1:TYR_11:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:GLN_13:HN        1:GLN_13:HBR        2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:GLN_13:HN        1:GLN_13:HBS        2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:LYS_6:HN         1:LEU_5:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:                       
1:GLU_7:HN         1:LYS_6:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:ASP_10:HN        1:VAL_9:HA          2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:                                
1:ILE_12:HN        1:TYR_11:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:ASN_15:HN        1:LYS_14:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:ASN_17:HN        1:GLN_16:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:LEU_18:HN        1:ASN_17:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:PHE_19:HN        1:LEU_18:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:LYS_20:HN        1:PHE_19:HA         2.800  3.500  3.500 30.00 30.00 1000.000  0.00 !medium:
1:ASN_3:HB*        1:ASN_3:HN          2.800  4.500  3.500 30.00 30.00 1000.000  0.00 !medium:
!
#mixing_times
6.000000E+02 
!
#NMR_dihedral
1:LYS_1:CA         1:LYS_1:C          1:MET_2:N          1:MET_2:CA         178.000 180.000 500.00 500.00 1000.000
1:MET_2:CA         1:MET_2:C          1:ASN_3:N          1:ASN_3:CA         178.000 180.000 500.00 500.00 1000.000
1:ASN_3:CA         1:ASN_3:C          1:MET_4:N          1:MET_4:CA         178.000 180.000 500.00 500.00 1000.000
1:MET_4:CA         1:MET_4:C          1:LEU_5:N          1:LEU_5:CA         178.000 180.000 500.00 500.00 1000.000
1:LEU_5:CA         1:LEU_5:C          1:LYS_6:N          1:LYS_6:CA         178.000 180.000 500.00 500.00 1000.000
1:LYS_6:CA         1:LYS_6:C          1:GLU_7:N          1:GLU_7:CA         178.000 180.000 500.00 500.00 1000.000
1:GLU_7:CA         1:GLU_7:C          1:ASN_8:N          1:ASN_8:CA         178.000 180.000 500.00 500.00 1000.000
1:ASN_8:CA         1:ASN_8:C          1:VAL_9:N          1:VAL_9:CA         178.000 180.000 500.00 500.00 1000.000
1:VAL_9:CA         1:VAL_9:C          1:ASP_10:N         1:ASP_10:CA        178.000 180.000 500.00 500.00 1000.000
1:ASP_10:CA        1:ASP_10:C         1:TYR_11:N         1:TYR_11:CA        178.000 180.000 500.00 500.00 1000.000
1:TYR_11:CA        1:TYR_11:C         1:ILE_12:N         1:ILE_12:CA        178.000 180.000 500.00 500.00 1000.000
1:ILE_12:CA        1:ILE_12:C         1:GLN_13:N         1:GLN_13:CA        178.000 180.000 500.00 500.00 1000.000
1:GLN_13:CA        1:GLN_13:C         1:LYS_14:N         1:LYS_14:CA        178.000 180.000 500.00 500.00 1000.000
1:LYS_14:CA        1:LYS_14:C         1:ASN_15:N         1:ASN_15:CA        178.000 180.000 500.00 500.00 1000.000
1:ASN_15:CA        1:ASN_15:C         1:GLN_16:N         1:GLN_16:CA        178.000 180.000 500.00 500.00 1000.000
1:GLN_16:CA        1:GLN_16:C         1:ASN_17:N         1:ASN_17:CA        178.000 180.000 500.00 500.00 1000.000
1:ASN_17:CA        1:ASN_17:C         1:LEU_18:N         1:LEU_18:CA        178.000 180.000 500.00 500.00 1000.000
1:LEU_18:CA        1:LEU_18:C         1:PHE_19:N         1:PHE_19:CA        178.000 180.000 500.00 500.00 1000.000
1:PHE_19:CA        1:PHE_19:C         1:LYS_20:N         1:LYS_20:CA        178.000 180.000 500.00 500.00 1000.000

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           H        LYS   1  16.699  -2.478   1.081
    2    HA   LYS   1           HA       LYS   1  14.557  -1.618   2.804
    3    HB2  LYS   1           1HB      LYS   1  14.269   0.710   1.678
    4    HB3  LYS   1           2HB      LYS   1  15.305   0.518   3.069
    5    HG2  LYS   1           2HG      LYS   1  16.389   2.064   1.693
    6    HG3  LYS   1           1HG      LYS   1  17.363   0.607   1.651
    7    HD2  LYS   1           1HD      LYS   1  16.531   0.057  -0.629
    8    HD3  LYS   1           2HD      LYS   1  15.392   1.413  -0.583
    9    HE2  LYS   1           2HE      LYS   1  17.353   3.032  -0.428
   10    HE3  LYS   1           1HE      LYS   1  18.480   1.668  -0.471
   11    HZ2  LYS   1           1HZ      LYS   1  18.205   2.616  -2.638
   12    HZ3  LYS   1           2HZ      LYS   1  17.636   1.083  -2.649
   13    H    MET   2           H        MET   2  13.762  -3.404   1.776
   14    HA   MET   2           HA       MET   2  12.749  -3.040  -0.943
   15    HB2  MET   2           2HB      MET   2  13.924  -4.804  -2.097
   16    HB3  MET   2           1HB      MET   2  15.133  -3.796  -1.344
   17    HG2  MET   2           2HG      MET   2  15.412  -5.520   0.512
   18    HG3  MET   2           1HG      MET   2  14.295  -6.591  -0.359
   19    HE1  MET   2           1HE      MET   2  17.327  -7.399   0.383
   20    HE2  MET   2           2HE      MET   2  16.198  -8.481  -0.493
   21    HE3  MET   2           3HE      MET   2  17.837  -8.181  -1.143
   22    H    ASN   3           H        ASN   3  11.155  -2.983   0.760
   23    HA   ASN   3           HA       ASN   3   9.458  -5.334   0.584
   24    HB2  ASN   3           2HB      ASN   3   8.898  -5.688   2.968
   25    HB3  ASN   3           1HB      ASN   3  10.549  -6.118   2.633
   26   HD21  ASN   3          1HD2      ASN   3  12.241  -4.841   3.595
   27   HD22  ASN   3          2HD2      ASN   3  11.874  -3.708   4.991
   28    H    MET   4           H        MET   4   9.583  -2.183   2.403
   29    HA   MET   4           HA       MET   4   6.881  -1.565   1.655
   30    HB2  MET   4           1HB      MET   4   8.963   0.564   2.392
   31    HB3  MET   4           2HB      MET   4   7.225   0.611   2.628
   32    HG2  MET   4           2HG      MET   4   7.571  -1.403   4.312
   33    HG3  MET   4           1HG      MET   4   9.285  -1.032   4.187
   34    HE1  MET   4           1HE      MET   4   7.629  -0.897   6.959
   35    HE2  MET   4           2HE      MET   4   8.287   0.611   7.662
   36    HE3  MET   4           3HE      MET   4   9.380  -0.538   6.835
   37    H    LEU   5           H        LEU   5   8.175  -2.253  -0.769
   38    HA   LEU   5           HA       LEU   5   8.693   0.172  -2.391
   39    HB2  LEU   5           1HB      LEU   5   9.841  -0.949  -4.002
   40    HB3  LEU   5           2HB      LEU   5  10.459  -1.313  -2.430
   41    HG   LEU   5           HG       LEU   5   8.803  -3.450  -2.648
   42   HD11  LEU   5          1HD1      LEU   5   8.768  -4.387  -4.943
   43   HD12  LEU   5          2HD1      LEU   5   9.646  -2.967  -5.589
   44   HD13  LEU   5          3HD1      LEU   5   7.984  -2.796  -4.999
   45   HD21  LEU   5          1HD2      LEU   5  10.831  -4.727  -3.402
   46   HD22  LEU   5          2HD2      LEU   5  11.604  -3.167  -3.871
   47   HD23  LEU   5          3HD2      LEU   5  11.179  -3.488  -2.173
   48    H    LYS   6           H        LYS   6   7.035  -2.925  -2.700
   49    HA   LYS   6           HA       LYS   6   4.759  -1.803  -4.182
   50    HB2  LYS   6           1HB      LYS   6   5.861  -4.060  -4.692
   51    HB3  LYS   6           2HB      LYS   6   5.258  -4.705  -3.187
   52    HG2  LYS   6           1HG      LYS   6   3.374  -3.563  -5.366
   53    HG3  LYS   6           2HG      LYS   6   4.038  -5.184  -5.475
   54    HD2  LYS   6           2HD      LYS   6   2.993  -5.822  -3.281
   55    HD3  LYS   6           1HD      LYS   6   2.282  -4.216  -3.134
   56    HE2  LYS   6           1HE      LYS   6   0.981  -4.573  -5.279
   57    HE3  LYS   6           2HE      LYS   6   1.685  -6.189  -5.437
   58    HZ2  LYS   6           1HZ      LYS   6   0.667  -6.801  -3.344
   59    HZ3  LYS   6           2HZ      LYS   6  -0.461  -6.293  -4.413
   60    H    GLU   7           H        GLU   7   5.349  -3.045  -0.903
   61    HA   GLU   7           HA       GLU   7   2.558  -2.858  -0.002
   62    HB2  GLU   7           2HB      GLU   7   5.102  -2.706   1.752
   63    HB3  GLU   7           1HB      GLU   7   3.468  -2.844   2.377
   64    HG2  GLU   7           1HG      GLU   7   3.188  -5.084   1.263
   65    HG3  GLU   7           2HG      GLU   7   4.816  -4.980   0.599
   66    HE2  GLU   7           HE2      GLU   7   6.466  -5.755   3.528
   67    H    ASN   8           H        ASN   8   5.141  -0.326   0.029
   68    HA   ASN   8           HA       ASN   8   3.408   1.600   1.382
   69    HB2  ASN   8           1HB      ASN   8   5.913   1.985   0.964
   70    HB3  ASN   8           2HB      ASN   8   5.540   2.249  -0.769
   71   HD21  ASN   8          2HD2      ASN   8   5.336   4.403  -1.251
   72   HD22  ASN   8          1HD2      ASN   8   4.972   5.740  -0.048
   73    H    VAL   9           H        VAL   9   3.954   1.058  -2.132
   74    HA   VAL   9           HA       VAL   9   1.968   2.870  -3.074
   75    HB   VAL   9           HB       VAL   9   4.124   1.296  -4.037
   76   HG11  VAL   9          1HG1      VAL   9   1.674   0.461  -5.730
   77   HG12  VAL   9          2HG1      VAL   9   2.591  -0.636  -4.675
   78   HG13  VAL   9          3HG1      VAL   9   3.390   0.119  -6.066
   79   HG21  VAL   9          1HG2      VAL   9   3.924   2.589  -6.066
   80   HG22  VAL   9          2HG2      VAL   9   3.639   3.586  -4.625
   81   HG23  VAL   9          3HG2      VAL   9   2.253   3.086  -5.636
   82    H    ASP  10           H        ASP  10   1.182   0.192  -1.265
   83    HA   ASP  10           HA       ASP  10  -1.289  -0.608  -2.617
   84    HB2  ASP  10           2HB      ASP  10   0.549  -2.474  -2.028
   85    HB3  ASP  10           1HB      ASP  10   0.031  -2.138  -0.393
   86    HD2  ASP  10           HD2      ASP  10  -2.936  -3.844  -0.569
   87    H    TYR  11           H        TYR  11   0.472   0.520   0.244
   88    HA   TYR  11           HA       TYR  11  -1.713   0.793   2.140
   89    HB2  TYR  11           2HB      TYR  11   0.897   0.753   2.592
   90    HB3  TYR  11           1HB      TYR  11   0.817   2.420   2.191
   91    HD1  TYR  11           HD1      TYR  11  -0.663  -0.135   4.509
   92    HD2  TYR  11           HD2      TYR  11  -0.107   4.059   3.794
   93    HE1  TYR  11           HE1      TYR  11  -1.398   0.355   6.814
   94    HE2  TYR  11           HE2      TYR  11  -0.839   4.549   6.100
   95    HH   TYR  11           HH       TYR  11  -1.800   1.933   8.326
   96    H    ILE  12           H        ILE  12  -0.441   3.065  -0.247
   97    HA   ILE  12           HA       ILE  12  -1.926   5.413   0.741
   98    HB   ILE  12           HB       ILE  12  -0.033   5.036  -1.521
   99   HG12  ILE  12          2HG1      ILE  12   0.964   7.216  -0.584
  100   HG13  ILE  12          1HG1      ILE  12  -0.223   7.163   0.704
  101   HG21  ILE  12          1HG2      ILE  12  -1.839   6.264  -2.685
  102   HG22  ILE  12          2HG2      ILE  12  -0.456   7.333  -2.441
  103   HG23  ILE  12          3HG2      ILE  12  -1.890   7.486  -1.391
  104   HD11  ILE  12          1HD1      ILE  12   2.021   6.349   1.429
  105   HD12  ILE  12          2HD1      ILE  12   0.852   5.022   1.568
  106   HD13  ILE  12          3HD1      ILE  12   1.999   5.071   0.198
  107    H    GLN  13           H        GLN  13  -2.111   3.262  -2.107
  108    HA   GLN  13           HA       GLN  13  -4.723   3.964  -2.959
  109    HB2  GLN  13           1HB      GLN  13  -3.482   1.240  -3.277
  110    HB3  GLN  13           2HB      GLN  13  -4.875   1.849  -4.096
  111    HG2  GLN  13           1HG      GLN  13  -3.537   3.687  -5.186
  112    HG3  GLN  13           2HG      GLN  13  -2.081   3.067  -4.433
  113   HE21  GLN  13          2HE2      GLN  13  -4.262   2.673  -7.067
  114   HE22  GLN  13          1HE2      GLN  13  -3.420   1.226  -7.820
  115    H    LYS  14           H        LYS  14  -3.768   1.711  -0.330
  116    HA   LYS  14           HA       LYS  14  -6.453   0.650   0.097
  117    HB2  LYS  14           1HB      LYS  14  -4.386  -0.503   0.865
  118    HB3  LYS  14           2HB      LYS  14  -4.130   0.749   2.095
  119    HG2  LYS  14           1HG      LYS  14  -6.305   0.015   3.198
  120    HG3  LYS  14           2HG      LYS  14  -6.558  -1.144   1.898
  121    HD2  LYS  14           1HD      LYS  14  -5.718  -2.376   3.769
  122    HD3  LYS  14           2HD      LYS  14  -4.442  -2.366   2.559
  123    HE2  LYS  14           1HE      LYS  14  -3.245  -0.515   3.854
  124    HE3  LYS  14           2HE      LYS  14  -4.551  -0.508   5.046
  125    HZ2  LYS  14           1HZ      LYS  14  -4.030  -2.837   5.524
  126    HZ3  LYS  14           2HZ      LYS  14  -2.825  -2.840   4.419
  127    H    ASN  15           H        ASN  15  -4.883   3.553   1.403
  128    HA   ASN  15           HA       ASN  15  -6.720   4.205   3.508
  129    HB2  ASN  15           1HB      ASN  15  -4.385   5.271   2.926
  130    HB3  ASN  15           2HB      ASN  15  -5.348   6.268   1.808
  131   HD21  ASN  15          1HD2      ASN  15  -4.560   8.072   3.001
  132   HD22  ASN  15          2HD2      ASN  15  -5.298   8.528   4.619
  133    H    GLN  16           H        GLN  16  -6.590   5.460   0.242
  134    HA   GLN  16           HA       GLN  16  -9.106   6.898   0.355
  135    HB2  GLN  16           1HB      GLN  16  -8.357   7.878  -1.628
  136    HB3  GLN  16           2HB      GLN  16  -6.930   7.610  -0.673
  137    HG2  GLN  16           2HG      GLN  16  -6.449   5.487  -2.089
  138    HG3  GLN  16           1HG      GLN  16  -7.793   5.936  -3.123
  139   HE21  GLN  16          2HE2      GLN  16  -4.487   6.570  -2.382
  140   HE22  GLN  16          1HE2      GLN  16  -4.244   7.872  -3.653
  141    H    ASN  17           H        ASN  17  -8.213   3.895  -1.302
  142    HA   ASN  17           HA       ASN  17 -10.892   3.632  -2.537
  143    HB2  ASN  17           1HB      ASN  17  -8.701   3.027  -3.742
  144    HB3  ASN  17           2HB      ASN  17  -8.597   1.614  -2.721
  145   HD21  ASN  17          1HD2      ASN  17 -10.269   3.089  -5.409
  146   HD22  ASN  17          2HD2      ASN  17 -11.184   1.580  -5.911
  147    H    LEU  18           H        LEU  18  -9.528   2.409   0.448
  148    HA   LEU  18           HA       LEU  18  -9.799   0.534   1.807
  149    HB2  LEU  18           1HB      LEU  18 -12.506   1.818   1.342
  150    HB3  LEU  18           2HB      LEU  18 -12.066   0.901   2.759
  151    HG   LEU  18           HG       LEU  18 -10.195   3.219   1.982
  152   HD11  LEU  18          1HD1      LEU  18 -11.527   4.894   3.076
  153   HD12  LEU  18          2HD1      LEU  18 -12.884   3.732   3.290
  154   HD13  LEU  18          3HD1      LEU  18 -12.350   4.225   1.653
  155   HD21  LEU  18          1HD2      LEU  18  -9.838   3.432   4.371
  156   HD22  LEU  18          2HD2      LEU  18 -11.067   2.175   4.719
  157   HD23  LEU  18          3HD2      LEU  18  -9.558   1.757   3.859
  158    H    PHE  19           H        PHE  19  -9.346  -0.957  -0.364
  159    HA   PHE  19           HA       PHE  19 -11.465  -2.814  -0.940
  160    HB2  PHE  19           2HB      PHE  19  -9.575  -3.994  -2.167
  161    HB3  PHE  19           1HB      PHE  19 -10.049  -2.386  -2.659
  162    HD1  PHE  19           HD1      PHE  19  -7.353  -4.107  -0.543
  163    HD2  PHE  19           HD2      PHE  19  -8.377  -0.735  -3.015
  164    HE1  PHE  19           HE1      PHE  19  -5.007  -3.395  -0.560
  165    HE2  PHE  19           HE2      PHE  19  -6.023  -0.054  -3.038
  166    HZ   PHE  19           HZ       PHE  19  -4.330  -1.376  -1.815
  167    H    LYS  20           H        LYS  20 -11.490  -2.993   1.806
  168    HA   LYS  20           HA       LYS  20  -9.968  -5.232   2.804
  169    HB2  LYS  20           2HB      LYS  20 -10.771  -3.340   4.154
  170    HB3  LYS  20           1HB      LYS  20 -12.412  -3.968   3.974
  171    HG2  LYS  20           1HG      LYS  20 -11.704  -6.099   5.156
  172    HG3  LYS  20           2HG      LYS  20 -10.074  -5.470   5.328
  173    HD2  LYS  20           2HD      LYS  20 -12.619  -4.205   6.538
  174    HD3  LYS  20           1HD      LYS  20 -11.559  -5.295   7.399
  175    HE2  LYS  20           2HE      LYS  20 -10.713  -2.506   6.350
  176    HE3  LYS  20           1HE      LYS  20 -11.227  -2.867   7.993
  177    HZ2  LYS  20           1HZ      LYS  20  -8.860  -2.839   7.850
  178    HZ3  LYS  20           2HZ      LYS  20  -9.354  -4.345   8.250
  Start of MODEL    2
    1    H1   LYS   1           H        LYS   1  17.645  -1.355  -0.934
    2    HA   LYS   1           HA       LYS   1  15.497  -1.626  -2.839
    3    HB2  LYS   1           1HB      LYS   1  14.682  -3.918  -1.935
    4    HB3  LYS   1           2HB      LYS   1  15.828  -3.855  -3.240
    5    HG2  LYS   1           1HG      LYS   1  16.509  -5.681  -1.934
    6    HG3  LYS   1           2HG      LYS   1  17.721  -4.444  -1.730
    7    HD2  LYS   1           1HD      LYS   1  17.419  -5.533   0.376
    8    HD3  LYS   1           2HD      LYS   1  16.819  -3.898   0.554
    9    HE2  LYS   1           2HE      LYS   1  14.412  -4.816   0.258
   10    HE3  LYS   1           1HE      LYS   1  15.086  -6.444   0.134
   11    HZ2  LYS   1           1HZ      LYS   1  14.370  -5.978   2.357
   12    HZ3  LYS   1           2HZ      LYS   1  15.990  -6.197   2.354
   13    H    MET   2           H        MET   2  15.121   0.235  -1.696
   14    HA   MET   2           HA       MET   2  13.777  -0.086   0.900
   15    HB2  MET   2           2HB      MET   2  15.208   1.273   2.272
   16    HB3  MET   2           1HB      MET   2  16.231   0.108   1.489
   17    HG2  MET   2           1HG      MET   2  17.584   1.944   1.287
   18    HG3  MET   2           2HG      MET   2  16.746   2.093  -0.264
   19    HE1  MET   2           1HE      MET   2  18.294   4.533   1.062
   20    HE2  MET   2           2HE      MET   2  17.105   5.858   0.889
   21    HE3  MET   2           3HE      MET   2  17.340   4.692  -0.447
   22    H    ASN   3           H        ASN   3  12.396   0.219  -0.985
   23    HA   ASN   3           HA       ASN   3  11.232   2.907  -0.839
   24    HB2  ASN   3           1HB      ASN   3  11.883   1.724  -3.636
   25    HB3  ASN   3           2HB      ASN   3  10.751   3.031  -3.372
   26   HD21  ASN   3          2HD2      ASN   3  14.031   2.325  -3.904
   27   HD22  ASN   3          1HD2      ASN   3  14.659   4.031  -3.653
   28    H    MET   4           H        MET   4  10.678  -0.141  -2.770
   29    HA   MET   4           HA       MET   4   7.917  -0.150  -1.998
   30    HB2  MET   4           1HB      MET   4   9.400  -2.684  -2.910
   31    HB3  MET   4           2HB      MET   4   7.704  -2.289  -3.120
   32    HG2  MET   4           2HG      MET   4   8.526  -0.319  -4.679
   33    HG3  MET   4           1HG      MET   4  10.098  -1.104  -4.611
   34    HE1  MET   4           1HE      MET   4   8.699  -2.223  -8.161
   35    HE2  MET   4           2HE      MET   4  10.042  -1.422  -7.293
   36    HE3  MET   4           3HE      MET   4   8.425  -0.652  -7.351
   37    H    LEU   5           H        LEU   5   9.701  -0.179   0.332
   38    HA   LEU   5           HA       LEU   5   9.028  -2.637   1.879
   39    HB2  LEU   5           1HB      LEU   5  10.738  -0.182   2.543
   40    HB3  LEU   5           2HB      LEU   5  10.426  -1.485   3.680
   41    HG   LEU   5           HG       LEU   5  11.962  -1.668   1.025
   42   HD11  LEU   5          1HD2      LEU   5  12.809  -1.921   3.971
   43   HD12  LEU   5          2HD2      LEU   5  13.889  -2.005   2.540
   44   HD13  LEU   5          3HD2      LEU   5  13.040  -0.488   2.938
   45   HD21  LEU   5          1HD1      LEU   5  12.576  -4.025   1.686
   46   HD22  LEU   5          2HD1      LEU   5  11.379  -3.968   3.010
   47   HD23  LEU   5          3HD1      LEU   5  10.854  -3.871   1.309
   48    H    LYS   6           H        LYS   6   8.943   0.760   2.894
   49    HA   LYS   6           HA       LYS   6   6.337   0.480   4.142
   50    HB2  LYS   6           1HB      LYS   6   8.196   2.070   4.912
   51    HB3  LYS   6           2HB      LYS   6   7.847   3.108   3.534
   52    HG2  LYS   6           1HG      LYS   6   5.496   3.472   4.432
   53    HG3  LYS   6           2HG      LYS   6   5.846   2.389   5.782
   54    HD2  LYS   6           2HD      LYS   6   7.703   3.940   6.541
   55    HD3  LYS   6           1HD      LYS   6   7.356   5.018   5.184
   56    HE2  LYS   6           2HE      LYS   6   5.004   5.393   6.083
   57    HE3  LYS   6           1HE      LYS   6   5.353   4.314   7.443
   58    HZ2  LYS   6           1HZ      LYS   6   5.674   6.592   8.057
   59    HZ3  LYS   6           2HZ      LYS   6   7.107   5.810   8.135
   60    H    GLU   7           H        GLU   7   7.285   1.663   0.942
   61    HA   GLU   7           HA       GLU   7   4.609   2.756   0.283
   62    HB2  GLU   7           2HB      GLU   7   6.803   1.890  -1.710
   63    HB3  GLU   7           1HB      GLU   7   5.330   2.711  -2.160
   64    HG2  GLU   7           2HG      GLU   7   7.522   3.930  -0.360
   65    HG3  GLU   7           1HG      GLU   7   7.324   4.220  -2.076
   66    HE2  GLU   7           HE2      GLU   7   6.191   4.809   0.996
   67    H    ASN   8           H        ASN   8   6.024  -0.542  -0.267
   68    HA   ASN   8           HA       ASN   8   3.602  -1.450  -1.618
   69    HB2  ASN   8           1HB      ASN   8   5.742  -2.846  -1.463
   70    HB3  ASN   8           2HB      ASN   8   5.366  -3.161   0.264
   71   HD21  ASN   8          2HD2      ASN   8   4.244  -5.059   0.568
   72   HD22  ASN   8          1HD2      ASN   8   3.369  -5.997  -0.744
   73    H    VAL   9           H        VAL   9   4.436  -1.586   1.880
   74    HA   VAL   9           HA       VAL   9   1.917  -2.560   2.786
   75    HB   VAL   9           HB       VAL   9   4.557  -2.150   3.716
   76   HG11  VAL   9          1HG1      VAL   9   4.486  -0.998   5.877
   77   HG12  VAL   9          2HG1      VAL   9   4.006   0.169   4.631
   78   HG13  VAL   9          3HG1      VAL   9   2.770  -0.562   5.677
   79   HG21  VAL   9          1HG2      VAL   9   3.164  -4.069   4.143
   80   HG22  VAL   9          2HG2      VAL   9   3.900  -3.452   5.636
   81   HG23  VAL   9          3HG2      VAL   9   2.161  -3.149   5.302
   82    H    ASP  10           H        ASP  10   2.144   0.338   1.263
   83    HA   ASP  10           HA       ASP  10   0.211   1.877   2.849
   84    HB2  ASP  10           2HB      ASP  10   2.613   2.943   2.334
   85    HB3  ASP  10           1HB      ASP  10   1.976   3.027   0.707
   86    HD2  ASP  10           HD2      ASP  10   0.617   5.480   3.611
   87    H    TYR  11           H        TYR  11   1.357   0.564  -0.236
   88    HA   TYR  11           HA       TYR  11  -0.828   1.341  -1.986
   89    HB2  TYR  11           2HB      TYR  11   1.635   0.485  -2.586
   90    HB3  TYR  11           1HB      TYR  11   0.919  -1.066  -2.436
   91    HD1  TYR  11           HD1      TYR  11   0.539   2.194  -4.242
   92    HD2  TYR  11           HD2      TYR  11  -0.627  -1.931  -4.169
   93    HE1  TYR  11           HE1      TYR  11  -0.350   2.406  -6.538
   94    HE2  TYR  11           HE2      TYR  11  -1.515  -1.722  -6.464
   95    HH   TYR  11           HH       TYR  11  -1.859  -0.370  -8.193
   96    H    ILE  12           H        ILE  12  -0.371  -1.574  -0.040
   97    HA   ILE  12           HA       ILE  12  -2.646  -3.048  -1.201
   98    HB   ILE  12           HB       ILE  12  -0.634  -3.754   0.871
   99   HG12  ILE  12          2HG1      ILE  12  -0.499  -5.929  -0.444
  100   HG13  ILE  12          1HG1      ILE  12  -1.718  -5.325  -1.551
  101   HG21  ILE  12          1HG2      ILE  12  -3.256  -5.344   0.619
  102   HG22  ILE  12          2HG2      ILE  12  -2.698  -4.449   2.054
  103   HG23  ILE  12          3HG2      ILE  12  -1.808  -5.876   1.514
  104   HD11  ILE  12          1HD1      ILE  12   1.087  -4.089  -1.137
  105   HD12  ILE  12          2HD1      ILE  12   0.613  -5.171  -2.463
  106   HD13  ILE  12          3HD1      ILE  12  -0.105  -3.553  -2.354
  107    H    GLN  13           H        GLN  13  -1.919  -1.509   1.940
  108    HA   GLN  13           HA       GLN  13  -4.568  -1.401   2.940
  109    HB2  GLN  13           2HB      GLN  13  -2.433   0.638   3.507
  110    HB3  GLN  13           1HB      GLN  13  -3.882   0.400   4.405
  111    HG2  GLN  13           1HG      GLN  13  -1.653  -1.706   4.204
  112    HG3  GLN  13           2HG      GLN  13  -1.877  -0.585   5.527
  113   HE21  GLN  13          1HE2      GLN  13  -2.882  -3.607   4.235
  114   HE22  GLN  13          2HE2      GLN  13  -4.105  -3.993   5.548
  115    H    LYS  14           H        LYS  14  -3.034   0.765   0.535
  116    HA   LYS  14           HA       LYS  14  -5.168   2.755   0.557
  117    HB2  LYS  14           2HB      LYS  14  -2.940   3.299  -0.302
  118    HB3  LYS  14           1HB      LYS  14  -3.113   2.135  -1.627
  119    HG2  LYS  14           1HG      LYS  14  -4.998   3.560  -2.567
  120    HG3  LYS  14           2HG      LYS  14  -4.834   4.654  -1.198
  121    HD2  LYS  14           2HD      LYS  14  -3.721   5.689  -3.045
  122    HD3  LYS  14           1HD      LYS  14  -2.465   5.204  -1.914
  123    HE2  LYS  14           1HE      LYS  14  -1.953   3.167  -3.371
  124    HE3  LYS  14           2HE      LYS  14  -3.248   3.638  -4.481
  125    HZ2  LYS  14           1HZ      LYS  14  -0.860   5.284  -3.845
  126    HZ3  LYS  14           2HZ      LYS  14  -2.054   5.724  -4.871
  127    H    ASN  15           H        ASN  15  -4.619  -0.084  -1.544
  128    HA   ASN  15           HA       ASN  15  -6.821   0.175  -3.361
  129    HB2  ASN  15           2HB      ASN  15  -4.775  -1.390  -3.469
  130    HB3  ASN  15           1HB      ASN  15  -5.684  -2.420  -2.382
  131   HD21  ASN  15          1HD2      ASN  15  -5.575  -4.044  -3.978
  132   HD22  ASN  15          2HD2      ASN  15  -6.651  -4.014  -5.466
  133    H    GLN  16           H        GLN  16  -6.606  -1.718  -0.383
  134    HA   GLN  16           HA       GLN  16  -9.195  -2.872  -0.222
  135    HB2  GLN  16           1HB      GLN  16  -7.146  -3.707   0.788
  136    HB3  GLN  16           2HB      GLN  16  -6.818  -2.191   1.612
  137    HG2  GLN  16           2HG      GLN  16  -7.397  -3.695   3.205
  138    HG3  GLN  16           1HG      GLN  16  -8.671  -2.478   3.118
  139   HE21  GLN  16          2HE2      GLN  16 -10.788  -3.252   2.837
  140   HE22  GLN  16          1HE2      GLN  16 -11.211  -5.012   2.532
  141    H    ASN  17           H        ASN  17  -8.012   0.188   1.152
  142    HA   ASN  17           HA       ASN  17 -10.394   0.784   2.701
  143    HB2  ASN  17           1HB      ASN  17  -8.136   1.691   3.276
  144    HB3  ASN  17           2HB      ASN  17  -8.144   2.690   1.844
  145   HD21  ASN  17          1HD2      ASN  17  -9.631   2.197   5.013
  146   HD22  ASN  17          2HD2      ASN  17 -10.280   3.907   5.158
  147    H    LEU  18           H        LEU  18  -9.470   1.955  -0.591
  148    HA   LEU  18           HA       LEU  18 -11.643   3.580  -1.102
  149    HB2  LEU  18           2HB      LEU  18 -10.195   1.727  -3.060
  150    HB3  LEU  18           1HB      LEU  18 -11.134   3.123  -3.546
  151    HG   LEU  18           HG       LEU  18  -8.779   3.403  -1.605
  152   HD11  LEU  18          1HD1      LEU  18  -7.922   2.317  -3.653
  153   HD12  LEU  18          2HD1      LEU  18  -8.629   3.609  -4.664
  154   HD13  LEU  18          3HD1      LEU  18  -7.314   3.976  -3.502
  155   HD21  LEU  18          1HD2      LEU  18  -8.710   5.740  -2.288
  156   HD22  LEU  18          2HD2      LEU  18 -10.162   5.495  -3.320
  157   HD23  LEU  18          3HD2      LEU  18 -10.256   5.299  -1.544
  158    H    PHE  19           H        PHE  19 -11.873   0.047  -1.239
  159    HA   PHE  19           HA       PHE  19 -14.294  -0.179  -2.755
  160    HB2  PHE  19           1HB      PHE  19 -13.342  -2.218  -0.804
  161    HB3  PHE  19           2HB      PHE  19 -14.366  -2.414  -2.199
  162    HD1  PHE  19           HD2      PHE  19 -12.943  -1.163  -4.473
  163    HD2  PHE  19           HD1      PHE  19 -11.373  -3.469  -1.192
  164    HE1  PHE  19           HE2      PHE  19 -11.067  -1.906  -5.876
  165    HE2  PHE  19           HE1      PHE  19  -9.512  -4.207  -2.617
  166    HZ   PHE  19           HZ       PHE  19  -9.359  -3.438  -4.960
  167    H    LYS  20           H        LYS  20 -15.527   1.733  -1.352
  168    HA   LYS  20           HA       LYS  20 -16.692   0.936   1.144
  169    HB2  LYS  20           2HB      LYS  20 -16.193   3.247   0.497
  170    HB3  LYS  20           1HB      LYS  20 -17.462   3.139  -0.721
  171    HG2  LYS  20           2HG      LYS  20 -18.314   4.385   1.148
  172    HG3  LYS  20           1HG      LYS  20 -19.201   2.872   1.077
  173    HD2  LYS  20           2HD      LYS  20 -17.762   1.936   2.933
  174    HD3  LYS  20           1HD      LYS  20 -16.830   3.423   3.000
  175    HE2  LYS  20           1HE      LYS  20 -19.874   3.226   3.565
  176    HE3  LYS  20           2HE      LYS  20 -18.622   3.157   4.802
  177    HZ2  LYS  20           1HZ      LYS  20 -17.905   5.379   4.147
  178    HZ3  LYS  20           2HZ      LYS  20 -19.061   5.464   2.994
  Start of MODEL    3
    1    H1   LYS   1           H        LYS   1  17.287  -2.855  -1.543
    2    HA   LYS   1           HA       LYS   1  14.986  -2.651  -3.260
    3    HB2  LYS   1           2HB      LYS   1  13.712  -4.616  -2.375
    4    HB3  LYS   1           1HB      LYS   1  14.892  -5.000  -3.598
    5    HG2  LYS   1           1HG      LYS   1  15.607  -5.403  -0.631
    6    HG3  LYS   1           2HG      LYS   1  14.542  -6.534  -1.446
    7    HD2  LYS   1           2HD      LYS   1  16.304  -6.974  -3.192
    8    HD3  LYS   1           1HD      LYS   1  17.416  -5.889  -2.380
    9    HE2  LYS   1           1HE      LYS   1  16.216  -8.437  -1.093
   10    HE3  LYS   1           2HE      LYS   1  17.776  -8.364  -1.907
   11    HZ2  LYS   1           2HZ      LYS   1  18.049  -8.149   0.441
   12    HZ3  LYS   1           1HZ      LYS   1  18.544  -6.772  -0.286
   13    H    MET   2           H        MET   2  14.871  -0.771  -2.124
   14    HA   MET   2           HA       MET   2  13.924  -0.866   0.628
   15    HB2  MET   2           2HB      MET   2  15.724   0.241   1.801
   16    HB3  MET   2           1HB      MET   2  16.418  -1.118   0.955
   17    HG2  MET   2           1HG      MET   2  17.303   0.455  -0.844
   18    HG3  MET   2           2HG      MET   2  16.726   1.830   0.121
   19    HE1  MET   2           1HE      MET   2  20.618   1.875   0.816
   20    HE2  MET   2           2HE      MET   2  19.808   1.447  -0.720
   21    HE3  MET   2           3HE      MET   2  19.206   2.821   0.259
   22    H    ASN   3           H        ASN   3  12.357  -0.162  -0.976
   23    HA   ASN   3           HA       ASN   3  11.780   2.667  -0.596
   24    HB2  ASN   3           2HB      ASN   3  13.160   2.714  -2.807
   25    HB3  ASN   3           1HB      ASN   3  11.978   1.652  -3.536
   26   HD21  ASN   3          1HD2      ASN   3  12.460   4.904  -2.197
   27   HD22  ASN   3          2HD2      ASN   3  11.079   5.667  -3.135
   28    H    MET   4           H        MET   4  10.645  -0.302  -2.359
   29    HA   MET   4           HA       MET   4   7.875   0.373  -1.665
   30    HB2  MET   4           2HB      MET   4   7.154  -1.683  -2.739
   31    HB3  MET   4           1HB      MET   4   8.034  -0.571  -3.773
   32    HG2  MET   4           1HG      MET   4  10.055  -1.841  -3.621
   33    HG3  MET   4           2HG      MET   4   9.413  -2.864  -2.330
   34    HE1  MET   4           1HE      MET   4   9.575  -5.413  -5.411
   35    HE2  MET   4           2HE      MET   4  10.065  -5.112  -3.717
   36    HE3  MET   4           3HE      MET   4  10.738  -4.106  -5.039
   37    H    LEU   5           H        LEU   5   9.408   0.237   0.688
   38    HA   LEU   5           HA       LEU   5   8.987  -2.360   2.055
   39    HB2  LEU   5           2HB      LEU   5  10.530  -1.947   3.677
   40    HB3  LEU   5           1HB      LEU   5  11.192  -1.697   2.102
   41    HG   LEU   5           HG       LEU   5  10.508   0.887   2.615
   42   HD11  LEU   5          1HD2      LEU   5  10.941   1.513   4.973
   43   HD12  LEU   5          2HD2      LEU   5  11.223  -0.197   5.425
   44   HD13  LEU   5          3HD2      LEU   5   9.602   0.348   4.961
   45   HD21  LEU   5          1HD1      LEU   5  12.680   0.078   1.944
   46   HD22  LEU   5          2HD1      LEU   5  13.029  -0.581   3.561
   47   HD23  LEU   5          3HD1      LEU   5  12.903   1.200   3.307
   48    H    LYS   6           H        LYS   6   8.687   1.080   2.750
   49    HA   LYS   6           HA       LYS   6   6.240   0.784   4.342
   50    HB2  LYS   6           2HB      LYS   6   8.219   2.431   4.814
   51    HB3  LYS   6           1HB      LYS   6   7.701   3.368   3.427
   52    HG2  LYS   6           2HG      LYS   6   5.452   3.766   4.568
   53    HG3  LYS   6           1HG      LYS   6   5.978   2.785   5.937
   54    HD2  LYS   6           1HD      LYS   6   7.888   4.395   6.351
   55    HD3  LYS   6           2HD      LYS   6   7.362   5.396   5.007
   56    HE2  LYS   6           1HE      LYS   6   5.659   4.796   7.531
   57    HE3  LYS   6           2HE      LYS   6   6.674   6.221   7.322
   58    HZ2  LYS   6           1HZ      LYS   6   4.349   5.516   5.625
   59    HZ3  LYS   6           2HZ      LYS   6   4.380   6.666   6.787
   60    H    GLU   7           H        GLU   7   7.068   1.956   1.099
   61    HA   GLU   7           HA       GLU   7   4.358   2.950   0.447
   62    HB2  GLU   7           2HB      GLU   7   6.666   2.139  -1.451
   63    HB3  GLU   7           1HB      GLU   7   5.143   2.808  -2.015
   64    HG2  GLU   7           2HG      GLU   7   5.529   4.940  -0.775
   65    HG3  GLU   7           1HG      GLU   7   7.010   4.305  -0.068
   66    HE2  GLU   7           HE2      GLU   7   5.460   4.831  -3.082
   67    H    ASN   8           H        ASN   8   5.821  -0.325  -0.010
   68    HA   ASN   8           HA       ASN   8   3.426  -1.324  -1.343
   69    HB2  ASN   8           2HB      ASN   8   5.616  -2.659  -1.151
   70    HB3  ASN   8           1HB      ASN   8   5.233  -2.945   0.572
   71   HD21  ASN   8          2HD2      ASN   8   4.231  -3.612  -2.794
   72   HD22  ASN   8          1HD2      ASN   8   3.336  -5.162  -2.391
   73    H    VAL   9           H        VAL   9   4.293  -1.340   2.153
   74    HA   VAL   9           HA       VAL   9   1.792  -2.328   3.103
   75    HB   VAL   9           HB       VAL   9   4.443  -1.872   4.000
   76   HG11  VAL   9          1HG2      VAL   9   2.643  -0.306   5.967
   77   HG12  VAL   9          2HG2      VAL   9   3.861   0.441   4.911
   78   HG13  VAL   9          3HG2      VAL   9   4.366  -0.714   6.158
   79   HG21  VAL   9          1HG1      VAL   9   2.076  -2.899   5.612
   80   HG22  VAL   9          2HG1      VAL   9   3.082  -3.812   4.450
   81   HG23  VAL   9          3HG1      VAL   9   3.821  -3.175   5.933
   82    H    ASP  10           H        ASP  10   1.900   0.506   1.476
   83    HA   ASP  10           HA       ASP  10   0.003   2.062   3.065
   84    HB2  ASP  10           1HB      ASP  10   2.401   3.128   2.519
   85    HB3  ASP  10           2HB      ASP  10   1.722   3.240   0.909
   86    HD2  ASP  10           HD2      ASP  10   0.102   4.514   0.521
   87    H    TYR  11           H        TYR  11   1.146   0.660   0.023
   88    HA   TYR  11           HA       TYR  11  -1.019   1.406  -1.763
   89    HB2  TYR  11           2HB      TYR  11   1.425   0.539  -2.343
   90    HB3  TYR  11           1HB      TYR  11   0.728  -1.015  -2.117
   91    HD1  TYR  11           HD2      TYR  11   0.327   2.150  -4.084
   92    HD2  TYR  11           HD1      TYR  11  -0.793  -1.983  -3.816
   93    HE1  TYR  11           HE2      TYR  11  -0.569   2.243  -6.383
   94    HE2  TYR  11           HE1      TYR  11  -1.687  -1.890  -6.114
   95    HH   TYR  11           HH       TYR  11  -1.579   1.125  -8.016
   96    H    ILE  12           H        ILE  12  -0.665  -1.414   0.343
   97    HA   ILE  12           HA       ILE  12  -2.880  -2.942  -0.855
   98    HB   ILE  12           HB       ILE  12  -1.036  -3.505   1.408
   99   HG12  ILE  12          2HG1      ILE  12  -0.854  -5.791   0.231
  100   HG13  ILE  12          1HG1      ILE  12  -1.925  -5.192  -1.021
  101   HG21  ILE  12          1HG2      ILE  12  -3.638  -5.106   1.054
  102   HG22  ILE  12          2HG2      ILE  12  -2.264  -5.592   2.082
  103   HG23  ILE  12          3HG2      ILE  12  -3.174  -4.131   2.470
  104   HD11  ILE  12          1HD1      ILE  12   0.885  -4.089  -0.354
  105   HD12  ILE  12          2HD1      ILE  12   0.473  -5.160  -1.707
  106   HD13  ILE  12          3HD1      ILE  12  -0.145  -3.497  -1.690
  107    H    GLN  13           H        GLN  13  -2.367  -1.149   2.199
  108    HA   GLN  13           HA       GLN  13  -5.137  -1.096   2.945
  109    HB2  GLN  13           2HB      GLN  13  -4.581   0.639   4.530
  110    HB3  GLN  13           1HB      GLN  13  -3.490  -0.699   4.665
  111    HG2  GLN  13           2HG      GLN  13  -1.755   0.642   3.372
  112    HG3  GLN  13           1HG      GLN  13  -2.872   1.993   3.266
  113   HE21  GLN  13          2HE2      GLN  13  -2.227   3.536   4.674
  114   HE22  GLN  13          1HE2      GLN  13  -1.564   3.237   6.358
  115    H    LYS  14           H        LYS  14  -3.302   0.992   0.675
  116    HA   LYS  14           HA       LYS  14  -5.399   3.013   0.450
  117    HB2  LYS  14           1HB      LYS  14  -3.072   3.484  -0.200
  118    HB3  LYS  14           2HB      LYS  14  -3.175   2.323  -1.536
  119    HG2  LYS  14           1HG      LYS  14  -4.938   3.804  -2.618
  120    HG3  LYS  14           2HG      LYS  14  -4.849   4.893  -1.240
  121    HD2  LYS  14           1HD      LYS  14  -3.574   5.886  -3.007
  122    HD3  LYS  14           2HD      LYS  14  -2.426   5.388  -1.771
  123    HE2  LYS  14           1HE      LYS  14  -1.828   3.335  -3.155
  124    HE3  LYS  14           2HE      LYS  14  -3.026   3.798  -4.371
  125    HZ2  LYS  14           1HZ      LYS  14  -0.638   5.377  -3.590
  126    HZ3  LYS  14           2HZ      LYS  14  -0.799   4.493  -4.955
  127    H    ASN  15           H        ASN  15  -4.771   0.044  -1.423
  128    HA   ASN  15           HA       ASN  15  -6.634   0.299  -3.577
  129    HB2  ASN  15           1HB      ASN  15  -4.763  -1.516  -3.137
  130    HB3  ASN  15           2HB      ASN  15  -6.052  -2.315  -2.212
  131   HD21  ASN  15          1HD2      ASN  15  -5.911  -4.057  -3.625
  132   HD22  ASN  15          2HD2      ASN  15  -6.581  -4.011  -5.336
  133    H    GLN  16           H        GLN  16  -7.030  -1.451  -0.584
  134    HA   GLN  16           HA       GLN  16  -9.819  -2.100  -0.885
  135    HB2  GLN  16           2HB      GLN  16  -9.503  -3.401   0.994
  136    HB3  GLN  16           1HB      GLN  16  -7.939  -3.389   0.240
  137    HG2  GLN  16           2HG      GLN  16  -7.173  -1.594   1.925
  138    HG3  GLN  16           1HG      GLN  16  -8.725  -1.733   2.732
  139   HE21  GLN  16          2HE2      GLN  16  -5.650  -3.298   2.210
  140   HE22  GLN  16          1HE2      GLN  16  -5.922  -4.642   3.429
  141    H    ASN  17           H        ASN  17  -8.343   0.686   0.687
  142    HA   ASN  17           HA       ASN  17 -10.685   1.483   2.208
  143    HB2  ASN  17           1HB      ASN  17  -8.381   2.161   2.846
  144    HB3  ASN  17           2HB      ASN  17  -8.229   3.154   1.414
  145   HD21  ASN  17          2HD2      ASN  17  -9.024   5.264   1.578
  146   HD22  ASN  17          1HD2      ASN  17  -9.869   5.911   3.073
  147    H    LEU  18           H        LEU  18  -9.564   2.536  -1.078
  148    HA   LEU  18           HA       LEU  18 -11.513   4.421  -1.643
  149    HB2  LEU  18           2HB      LEU  18 -10.288   2.394  -3.573
  150    HB3  LEU  18           1HB      LEU  18 -11.046   3.896  -4.060
  151    HG   LEU  18           HG       LEU  18  -8.684   3.868  -2.098
  152   HD11  LEU  18          1HD1      LEU  18  -8.454   3.999  -5.154
  153   HD12  LEU  18          2HD1      LEU  18  -7.123   4.216  -3.973
  154   HD13  LEU  18          3HD1      LEU  18  -7.940   2.647  -4.105
  155   HD21  LEU  18          1HD2      LEU  18  -9.741   6.107  -3.861
  156   HD22  LEU  18          2HD2      LEU  18  -8.289   6.166  -2.801
  157   HD23  LEU  18          3HD2      LEU  18  -9.895   5.947  -2.086
  158    H    PHE  19           H        PHE  19 -11.819   1.102  -2.925
  159    HA   PHE  19           HA       PHE  19 -14.765   1.197  -2.896
  160    HB2  PHE  19           1HB      PHE  19 -14.531  -0.887  -4.227
  161    HB3  PHE  19           2HB      PHE  19 -13.860   0.569  -4.924
  162    HD1  PHE  19           HD2      PHE  19 -12.968  -2.787  -3.487
  163    HD2  PHE  19           HD1      PHE  19 -11.440   0.751  -5.410
  164    HE1  PHE  19           HE2      PHE  19 -10.908  -3.985  -4.076
  165    HE2  PHE  19           HE1      PHE  19  -9.400  -0.480  -6.019
  166    HZ   PHE  19           HZ       PHE  19  -9.136  -2.850  -5.363
  167    H    LYS  20           H        LYS  20 -14.099   1.213  -0.236
  168    HA   LYS  20           HA       LYS  20 -13.894  -1.402   0.938
  169    HB2  LYS  20           2HB      LYS  20 -13.150   0.831   1.919
  170    HB3  LYS  20           1HB      LYS  20 -14.847   1.072   2.313
  171    HG2  LYS  20           1HG      LYS  20 -13.823   0.285   4.303
  172    HG3  LYS  20           2HG      LYS  20 -14.767  -1.079   3.723
  173    HD2  LYS  20           1HD      LYS  20 -12.642  -2.091   2.726
  174    HD3  LYS  20           2HD      LYS  20 -11.724  -0.694   3.298
  175    HE2  LYS  20           1HE      LYS  20 -12.338  -1.278   5.699
  176    HE3  LYS  20           2HE      LYS  20 -13.244  -2.684   5.120
  177    HZ2  LYS  20           1HZ      LYS  20 -11.005  -3.242   5.815
  178    HZ3  LYS  20           2HZ      LYS  20 -10.339  -2.214   4.733
  Start of MODEL    4
    1    H1   LYS   1           H        LYS   1  16.685  -2.933   0.382
    2    HA   LYS   1           HA       LYS   1  14.970  -1.553   2.241
    3    HB2  LYS   1           2HB      LYS   1  14.754   0.602   1.004
    4    HB3  LYS   1           1HB      LYS   1  16.182   0.480   1.994
    5    HG2  LYS   1           2HG      LYS   1  16.397  -0.088  -1.023
    6    HG3  LYS   1           1HG      LYS   1  16.231   1.562  -0.447
    7    HD2  LYS   1           1HD      LYS   1  18.290   1.278   1.000
    8    HD3  LYS   1           2HD      LYS   1  18.491  -0.363   0.382
    9    HE2  LYS   1           1HE      LYS   1  18.722   0.544  -1.980
   10    HE3  LYS   1           2HE      LYS   1  18.529   2.192  -1.364
   11    HZ2  LYS   1           1HZ      LYS   1  20.700   0.307  -0.629
   12    HZ3  LYS   1           2HZ      LYS   1  20.838   1.582  -1.643
   13    H    MET   2           H        MET   2  13.847  -3.338   1.606
   14    HA   MET   2           HA       MET   2  12.437  -3.200  -0.969
   15    HB2  MET   2           2HB      MET   2  13.177  -5.274  -1.945
   16    HB3  MET   2           1HB      MET   2  14.620  -4.383  -1.531
   17    HG2  MET   2           1HG      MET   2  14.922  -5.828   0.542
   18    HG3  MET   2           2HG      MET   2  13.529  -6.805   0.032
   19    HE1  MET   2           1HE      MET   2  16.471  -8.028   0.505
   20    HE2  MET   2           2HE      MET   2  15.062  -9.006  -0.012
   21    HE3  MET   2           3HE      MET   2  16.604  -9.113  -0.910
   22    H    ASN   3           H        ASN   3  11.218  -2.581   0.951
   23    HA   ASN   3           HA       ASN   3   9.239  -4.667   1.515
   24    HB2  ASN   3           2HB      ASN   3  10.574  -3.180   3.897
   25    HB3  ASN   3           1HB      ASN   3   9.036  -3.996   4.023
   26   HD21  ASN   3          2HD2      ASN   3  12.382  -4.452   4.279
   27   HD22  ASN   3          1HD2      ASN   3  12.338  -6.278   4.454
   28    H    MET   4           H        MET   4   9.944  -1.251   2.600
   29    HA   MET   4           HA       MET   4   7.264  -0.468   1.951
   30    HB2  MET   4           1HB      MET   4   9.593   1.534   2.092
   31    HB3  MET   4           2HB      MET   4   7.901   1.816   2.460
   32    HG2  MET   4           1HG      MET   4   8.227   0.122   4.464
   33    HG3  MET   4           2HG      MET   4   9.946   0.271   4.131
   34    HE1  MET   4           1HE      MET   4   8.598   1.099   6.951
   35    HE2  MET   4           2HE      MET   4   9.461   2.628   7.292
   36    HE3  MET   4           3HE      MET   4  10.353   1.232   6.618
   37    H    LEU   5           H        LEU   5   8.687  -1.608  -0.358
   38    HA   LEU   5           HA       LEU   5   8.632   0.480  -2.488
   39    HB2  LEU   5           1HB      LEU   5   9.460  -2.470  -2.527
   40    HB3  LEU   5           2HB      LEU   5   9.448  -1.438  -3.949
   41    HG   LEU   5           HG       LEU   5  11.216  -1.141  -1.453
   42   HD11  LEU   5          1HD1      LEU   5  11.688  -3.018  -3.022
   43   HD12  LEU   5          2HD1      LEU   5  11.812  -1.869  -4.379
   44   HD13  LEU   5          3HD1      LEU   5  12.996  -1.806  -3.031
   45   HD21  LEU   5          1HD2      LEU   5  12.454   0.674  -2.691
   46   HD22  LEU   5          2HD2      LEU   5  11.182   0.691  -3.946
   47   HD23  LEU   5          3HD2      LEU   5  10.808   1.170  -2.270
   48    H    LYS   6           H        LYS   6   7.471  -2.871  -2.488
   49    HA   LYS   6           HA       LYS   6   4.942  -2.196  -3.751
   50    HB2  LYS   6           1HB      LYS   6   5.823  -4.834  -2.393
   51    HB3  LYS   6           2HB      LYS   6   4.292  -4.653  -3.235
   52    HG2  LYS   6           1HG      LYS   6   5.492  -4.089  -5.379
   53    HG3  LYS   6           2HG      LYS   6   7.046  -4.290  -4.566
   54    HD2  LYS   6           1HD      LYS   6   6.464  -6.699  -4.041
   55    HD3  LYS   6           2HD      LYS   6   4.909  -6.500  -4.857
   56    HE2  LYS   6           2HE      LYS   6   6.116  -5.976  -7.035
   57    HE3  LYS   6           1HE      LYS   6   7.674  -6.173  -6.219
   58    HZ2  LYS   6           1HZ      LYS   6   7.039  -8.465  -5.706
   59    HZ3  LYS   6           2HZ      LYS   6   5.599  -8.283  -6.457
   60    H    GLU   7           H        GLU   7   5.796  -2.633  -0.345
   61    HA   GLU   7           HA       GLU   7   2.985  -2.604   0.606
   62    HB2  GLU   7           1HB      GLU   7   5.535  -1.973   2.237
   63    HB3  GLU   7           2HB      GLU   7   3.921  -2.078   2.915
   64    HG2  GLU   7           2HG      GLU   7   3.720  -4.491   2.241
   65    HG3  GLU   7           1HG      GLU   7   5.321  -4.440   1.510
   66    HE2  GLU   7           HE2      GLU   7   3.567  -4.065   4.395
   67    H    ASN   8           H        ASN   8   5.381   0.084   0.145
   68    HA   ASN   8           HA       ASN   8   3.497   2.071   1.152
   69    HB2  ASN   8           2HB      ASN   8   5.932   2.603   0.590
   70    HB3  ASN   8           1HB      ASN   8   5.518   2.496  -1.155
   71   HD21  ASN   8          2HD2      ASN   8   5.045   4.484  -2.034
   72   HD22  ASN   8          1HD2      ASN   8   4.611   5.992  -1.084
   73    H    VAL   9           H        VAL   9   3.992   0.933  -2.227
   74    HA   VAL   9           HA       VAL   9   1.823   2.370  -3.384
   75    HB   VAL   9           HB       VAL   9   4.097   0.872  -4.148
   76   HG11  VAL   9          1HG1      VAL   9   3.450  -0.761  -5.862
   77   HG12  VAL   9          2HG1      VAL   9   1.714  -0.538  -5.526
   78   HG13  VAL   9          3HG1      VAL   9   2.768  -1.299  -4.315
   79   HG21  VAL   9          1HG2      VAL   9   3.688   1.708  -6.373
   80   HG22  VAL   9          2HG2      VAL   9   1.984   2.100  -5.960
   81   HG23  VAL   9          3HG2      VAL   9   3.335   2.932  -5.137
   82    H    ASP  10           H        ASP  10   1.301   0.082  -1.069
   83    HA   ASP  10           HA       ASP  10  -1.146  -1.142  -2.129
   84    HB2  ASP  10           2HB      ASP  10   0.841  -2.723  -1.297
   85    HB3  ASP  10           1HB      ASP  10   0.367  -2.122   0.276
   86    HD2  ASP  10           HD2      ASP  10  -2.536  -3.957   0.537
   87    H    TYR  11           H        TYR  11   0.619   0.565   0.428
   88    HA   TYR  11           HA       TYR  11  -1.531   1.081   2.310
   89    HB2  TYR  11           1HB      TYR  11   1.119   1.242   2.634
   90    HB3  TYR  11           2HB      TYR  11   0.902   2.820   2.006
   91    HD1  TYR  11           HD1      TYR  11  -0.280   0.544   4.738
   92    HD2  TYR  11           HD2      TYR  11  -0.131   4.610   3.381
   93    HE1  TYR  11           HE1      TYR  11  -0.969   1.317   6.980
   94    HE2  TYR  11           HE2      TYR  11  -0.817   5.384   5.623
   95    HH   TYR  11           HH       TYR  11  -1.393   4.788   7.684
   96    H    ILE  12           H        ILE  12  -0.394   2.973  -0.443
   97    HA   ILE  12           HA       ILE  12  -1.952   5.398   0.176
   98    HB   ILE  12           HB       ILE  12  -0.039   4.704  -1.987
   99   HG12  ILE  12          1HG1      ILE  12   0.889   7.018  -1.480
  100   HG13  ILE  12          2HG1      ILE  12  -0.361   7.247  -0.271
  101   HG21  ILE  12          1HG2      ILE  12  -1.992   7.051  -2.354
  102   HG22  ILE  12          2HG2      ILE  12  -0.537   6.752  -3.340
  103   HG23  ILE  12          3HG2      ILE  12  -1.876   5.602  -3.384
  104   HD11  ILE  12          1HD1      ILE  12   0.666   5.406   1.130
  105   HD12  ILE  12          2HD1      ILE  12   1.857   6.656   0.721
  106   HD13  ILE  12          3HD1      ILE  12   1.872   5.112  -0.154
  107    H    GLN  13           H        GLN  13  -2.103   2.831  -2.300
  108    HA   GLN  13           HA       GLN  13  -4.755   3.302  -3.179
  109    HB2  GLN  13           2HB      GLN  13  -3.419   0.610  -3.112
  110    HB3  GLN  13           1HB      GLN  13  -4.828   1.027  -4.006
  111    HG2  GLN  13           2HG      GLN  13  -2.068   2.270  -4.535
  112    HG3  GLN  13           1HG      GLN  13  -2.771   0.940  -5.426
  113   HE21  GLN  13          1HE2      GLN  13  -2.684   4.366  -5.139
  114   HE22  GLN  13          2HE2      GLN  13  -3.886   4.713  -6.481
  115    H    LYS  14           H        LYS  14  -3.680   1.531  -0.249
  116    HA   LYS  14           HA       LYS  14  -6.314   0.438   0.382
  117    HB2  LYS  14           2HB      LYS  14  -4.237  -0.514   1.306
  118    HB3  LYS  14           1HB      LYS  14  -3.939   0.959   2.247
  119    HG2  LYS  14           1HG      LYS  14  -6.038   0.460   3.592
  120    HG3  LYS  14           2HG      LYS  14  -6.337  -0.946   2.578
  121    HD2  LYS  14           1HD      LYS  14  -5.377  -1.752   4.617
  122    HD3  LYS  14           2HD      LYS  14  -4.165  -1.986   3.364
  123    HE2  LYS  14           2HE      LYS  14  -2.935   0.101   4.176
  124    HE3  LYS  14           1HE      LYS  14  -4.181   0.355   5.406
  125    HZ2  LYS  14           1HZ      LYS  14  -2.398  -2.008   5.195
  126    HZ3  LYS  14           2HZ      LYS  14  -2.249  -0.785   6.270
  127    H    ASN  15           H        ASN  15  -4.804   3.543   1.236
  128    HA   ASN  15           HA       ASN  15  -6.695   4.472   3.191
  129    HB2  ASN  15           1HB      ASN  15  -4.328   5.432   2.559
  130    HB3  ASN  15           2HB      ASN  15  -5.239   6.283   1.288
  131   HD21  ASN  15          1HD2      ASN  15  -4.468   8.219   2.264
  132   HD22  ASN  15          2HD2      ASN  15  -5.254   8.888   3.782
  133    H    GLN  16           H        GLN  16  -6.442   5.329  -0.196
  134    HA   GLN  16           HA       GLN  16  -8.935   6.796  -0.326
  135    HB2  GLN  16           2HB      GLN  16  -8.142   7.524  -2.379
  136    HB3  GLN  16           1HB      GLN  16  -6.713   7.304  -1.416
  137    HG2  GLN  16           2HG      GLN  16  -6.311   5.038  -2.600
  138    HG3  GLN  16           1HG      GLN  16  -7.682   5.386  -3.637
  139   HE21  GLN  16          1HE2      GLN  16  -4.384   6.315  -2.886
  140   HE22  GLN  16          2HE2      GLN  16  -4.144   7.318  -4.404
  141    H    ASN  17           H        ASN  17  -8.100   3.587  -1.572
  142    HA   ASN  17           HA       ASN  17 -10.789   3.244  -2.792
  143    HB2  ASN  17           1HB      ASN  17  -8.489   1.228  -2.786
  144    HB3  ASN  17           2HB      ASN  17 -10.006   1.021  -3.614
  145   HD21  ASN  17          1HD2      ASN  17  -6.880   2.106  -4.059
  146   HD22  ASN  17          2HD2      ASN  17  -7.165   2.997  -5.638
  147    H    LEU  18           H        LEU  18  -9.494   2.366   0.328
  148    HA   LEU  18           HA       LEU  18  -9.799   0.627   1.880
  149    HB2  LEU  18           1HB      LEU  18 -12.469   1.884   1.210
  150    HB3  LEU  18           2HB      LEU  18 -12.078   1.108   2.722
  151    HG   LEU  18           HG       LEU  18 -10.169   3.324   1.756
  152   HD11  LEU  18          1HD2      LEU  18 -12.870   3.977   2.977
  153   HD12  LEU  18          2HD2      LEU  18 -11.503   5.105   2.669
  154   HD13  LEU  18          3HD2      LEU  18 -12.315   4.310   1.306
  155   HD21  LEU  18          1HD1      LEU  18  -9.571   2.047   3.780
  156   HD22  LEU  18          2HD1      LEU  18  -9.848   3.765   4.123
  157   HD23  LEU  18          3HD1      LEU  18 -11.091   2.554   4.569
  158    H    PHE  19           H        PHE  19  -9.265  -1.223   0.089
  159    HA   PHE  19           HA       PHE  19 -11.277  -2.954  -0.800
  160    HB2  PHE  19           1HB      PHE  19  -8.522  -3.858  -0.122
  161    HB3  PHE  19           2HB      PHE  19  -9.639  -4.491  -1.300
  162    HD1  PHE  19           HD1      PHE  19 -10.214  -3.042  -3.398
  163    HD2  PHE  19           HD2      PHE  19  -6.971  -2.065  -0.742
  164    HE1  PHE  19           HE1      PHE  19  -9.126  -1.742  -5.185
  165    HE2  PHE  19           HE2      PHE  19  -5.899  -0.780  -2.538
  166    HZ   PHE  19           HZ       PHE  19  -6.963  -0.621  -4.763
  167    H    LYS  20           H        LYS  20 -12.709  -2.977   1.448
  168    HA   LYS  20           HA       LYS  20 -11.840  -4.733   3.527
  169    HB2  LYS  20           1HB      LYS  20 -13.395  -2.853   3.784
  170    HB3  LYS  20           2HB      LYS  20 -14.609  -3.797   2.915
  171    HG2  LYS  20           1HG      LYS  20 -14.535  -5.553   4.746
  172    HG3  LYS  20           2HG      LYS  20 -13.290  -4.620   5.579
  173    HD2  LYS  20           1HD      LYS  20 -14.931  -2.671   5.809
  174    HD3  LYS  20           2HD      LYS  20 -16.143  -3.620   4.963
  175    HE2  LYS  20           1HE      LYS  20 -16.679  -3.790   7.294
  176    HE3  LYS  20           2HE      LYS  20 -16.068  -5.374   6.822
  177    HZ2  LYS  20           1HZ      LYS  20 -13.935  -4.784   7.807
  178    HZ3  LYS  20           2HZ      LYS  20 -15.140  -4.675   8.905
  Start of MODEL    5
    1    H1   LYS   1           H        LYS   1  16.340  -2.540   0.983
    2    HA   LYS   1           HA       LYS   1  14.586  -0.346   1.553
    3    HB2  LYS   1           2HB      LYS   1  14.832   0.886  -0.682
    4    HB3  LYS   1           1HB      LYS   1  15.995   1.231   0.565
    5    HG2  LYS   1           2HG      LYS   1  17.186   1.253  -1.465
    6    HG3  LYS   1           1HG      LYS   1  17.744  -0.150  -0.574
    7    HD2  LYS   1           2HD      LYS   1  16.383  -1.663  -2.038
    8    HD3  LYS   1           1HD      LYS   1  15.700  -0.267  -2.885
    9    HE2  LYS   1           2HE      LYS   1  18.028   0.372  -3.690
   10    HE3  LYS   1           1HE      LYS   1  18.707  -1.021  -2.835
   11    HZ2  LYS   1           1HZ      LYS   1  17.375  -2.475  -4.213
   12    HZ3  LYS   1           2HZ      LYS   1  18.334  -1.524  -5.134
   13    H    MET   2           H        MET   2  14.023  -2.802   1.674
   14    HA   MET   2           HA       MET   2  12.348  -3.472  -0.712
   15    HB2  MET   2           1HB      MET   2  14.469  -5.216   0.754
   16    HB3  MET   2           2HB      MET   2  13.218  -5.942  -0.244
   17    HG2  MET   2           2HG      MET   2  15.373  -4.004  -1.239
   18    HG3  MET   2           1HG      MET   2  15.353  -5.760  -1.443
   19    HE1  MET   2           1HE      MET   2  15.668  -5.309  -4.125
   20    HE2  MET   2           2HE      MET   2  14.541  -4.303  -5.083
   21    HE3  MET   2           3HE      MET   2  15.586  -3.541  -3.848
   22    H    ASN   3           H        ASN   3  11.242  -2.250   1.202
   23    HA   ASN   3           HA       ASN   3   9.421  -4.247   2.468
   24    HB2  ASN   3           2HB      ASN   3  10.511  -1.763   3.984
   25    HB3  ASN   3           1HB      ASN   3   9.160  -2.726   4.537
   26   HD21  ASN   3          2HD2      ASN   3  12.540  -2.457   4.645
   27   HD22  ASN   3          1HD2      ASN   3  12.855  -4.050   5.500
   28    H    MET   4           H        MET   4   9.621  -0.651   1.969
   29    HA   MET   4           HA       MET   4   6.839  -0.501   1.328
   30    HB2  MET   4           2HB      MET   4   8.910   1.535   0.334
   31    HB3  MET   4           1HB      MET   4   7.216   1.800   0.706
   32    HG2  MET   4           2HG      MET   4   7.841   1.235   3.210
   33    HG3  MET   4           1HG      MET   4   9.514   1.359   2.680
   34    HE1  MET   4           1HE      MET   4   9.927   3.377   4.423
   35    HE2  MET   4           2HE      MET   4   8.898   4.838   4.495
   36    HE3  MET   4           3HE      MET   4   8.220   3.248   4.952
   37    H    LEU   5           H        LEU   5   7.851  -2.582  -0.329
   38    HA   LEU   5           HA       LEU   5   7.952  -1.638  -3.140
   39    HB2  LEU   5           1HB      LEU   5   8.915  -3.521  -3.941
   40    HB3  LEU   5           2HB      LEU   5   9.786  -2.912  -2.575
   41    HG   LEU   5           HG       LEU   5   8.323  -4.704  -1.216
   42   HD11  LEU   5          1HD1      LEU   5   7.016  -5.526  -3.295
   43   HD12  LEU   5          2HD1      LEU   5   8.544  -6.092  -3.981
   44   HD13  LEU   5          3HD1      LEU   5   7.916  -6.809  -2.466
   45   HD21  LEU   5          1HD2      LEU   5  10.779  -5.349  -2.952
   46   HD22  LEU   5          2HD2      LEU   5  10.762  -4.572  -1.354
   47   HD23  LEU   5          3HD2      LEU   5  10.268  -6.277  -1.492
   48    H    LYS   6           H        LYS   6   6.476  -4.227  -1.254
   49    HA   LYS   6           HA       LYS   6   3.929  -4.124  -2.725
   50    HB2  LYS   6           1HB      LYS   6   5.107  -6.303  -1.947
   51    HB3  LYS   6           2HB      LYS   6   4.716  -5.872  -0.290
   52    HG2  LYS   6           2HG      LYS   6   2.235  -5.952  -0.882
   53    HG3  LYS   6           1HG      LYS   6   2.653  -6.348  -2.551
   54    HD2  LYS   6           2HD      LYS   6   3.804  -8.466  -1.751
   55    HD3  LYS   6           1HD      LYS   6   3.370  -8.065  -0.085
   56    HE2  LYS   6           2HE      LYS   6   0.901  -8.158  -0.708
   57    HE3  LYS   6           1HE      LYS   6   1.341  -8.564  -2.374
   58    HZ2  LYS   6           1HZ      LYS   6   2.040 -10.178   0.017
   59    HZ3  LYS   6           2HZ      LYS   6   2.460 -10.551  -1.518
   60    H    GLU   7           H        GLU   7   5.127  -3.151   0.469
   61    HA   GLU   7           HA       GLU   7   2.482  -2.410   1.560
   62    HB2  GLU   7           2HB      GLU   7   5.254  -1.360   2.446
   63    HB3  GLU   7           1HB      GLU   7   3.752  -1.041   3.294
   64    HG2  GLU   7           2HG      GLU   7   3.450  -3.487   3.787
   65    HG3  GLU   7           1HG      GLU   7   4.918  -3.870   2.893
   66    HE2  GLU   7           HE2      GLU   7   3.611  -2.337   5.594
   67    H    ASN   8           H        ASN   8   4.856  -0.454  -0.341
   68    HA   ASN   8           HA       ASN   8   3.227   1.960  -0.100
   69    HB2  ASN   8           2HB      ASN   8   5.602   1.927  -1.100
   70    HB3  ASN   8           1HB      ASN   8   4.918   1.158  -2.560
   71   HD21  ASN   8          2HD2      ASN   8   4.904   4.132  -0.562
   72   HD22  ASN   8          1HD2      ASN   8   4.441   5.246  -1.944
   73    H    VAL   9           H        VAL   9   3.237  -0.582  -2.647
   74    HA   VAL   9           HA       VAL   9   0.966   0.369  -4.079
   75    HB   VAL   9           HB       VAL   9   3.091  -1.487  -4.343
   76   HG11  VAL   9          1HG2      VAL   9   1.685  -3.409  -3.420
   77   HG12  VAL   9          2HG2      VAL   9   0.513  -3.151  -4.729
   78   HG13  VAL   9          3HG2      VAL   9   2.186  -3.634  -5.105
   79   HG21  VAL   9          1HG1      VAL   9   0.797  -0.987  -6.279
   80   HG22  VAL   9          2HG1      VAL   9   2.261   0.010  -6.045
   81   HG23  VAL   9          3HG1      VAL   9   2.423  -1.648  -6.657
   82    H    ASP  10           H        ASP  10   0.651  -0.560  -0.942
   83    HA   ASP  10           HA       ASP  10  -1.915  -1.949  -1.092
   84    HB2  ASP  10           2HB      ASP  10   0.139  -3.173   0.114
   85    HB3  ASP  10           1HB      ASP  10  -0.154  -1.950   1.332
   86    HD2  ASP  10           HD2      ASP  10  -1.492  -4.515  -0.406
   87    H    TYR  11           H        TYR  11   0.230   0.556   0.194
   88    HA   TYR  11           HA       TYR  11  -1.595   1.990   1.936
   89    HB2  TYR  11           1HB      TYR  11   1.058   2.071   1.828
   90    HB3  TYR  11           2HB      TYR  11   0.788   3.224   0.586
   91    HD1  TYR  11           HD2      TYR  11   0.014   2.484   4.174
   92    HD2  TYR  11           HD1      TYR  11  -0.004   5.519   1.142
   93    HE1  TYR  11           HE2      TYR  11  -0.304   4.213   5.908
   94    HE2  TYR  11           HE1      TYR  11  -0.320   7.249   2.876
   95    HH   TYR  11           HH       TYR  11  -0.567   7.664   5.045
   96    H    ILE  12           H        ILE  12  -0.968   2.391  -1.526
   97    HA   ILE  12           HA       ILE  12  -2.356   4.977  -1.757
   98    HB   ILE  12           HB       ILE  12  -1.008   3.240  -3.761
   99   HG12  ILE  12          1HG1      ILE  12   0.059   5.486  -4.458
  100   HG13  ILE  12          2HG1      ILE  12  -0.791   6.256  -3.134
  101   HG21  ILE  12          1HG2      ILE  12  -1.750   4.668  -5.689
  102   HG22  ILE  12          2HG2      ILE  12  -3.096   3.772  -4.979
  103   HG23  ILE  12          3HG2      ILE  12  -2.906   5.505  -4.618
  104   HD11  ILE  12          1HD1      ILE  12   1.372   4.062  -2.875
  105   HD12  ILE  12          2HD1      ILE  12   1.602   5.800  -2.604
  106   HD13  ILE  12          3HD1      ILE  12   0.580   4.872  -1.491
  107    H    GLN  13           H        GLN  13  -3.045   1.597  -2.724
  108    HA   GLN  13           HA       GLN  13  -5.819   2.057  -3.302
  109    HB2  GLN  13           2HB      GLN  13  -6.134  -0.330  -3.284
  110    HB3  GLN  13           1HB      GLN  13  -4.761   0.095  -4.246
  111    HG2  GLN  13           2HG      GLN  13  -3.264  -0.592  -2.284
  112    HG3  GLN  13           1HG      GLN  13  -4.692  -1.082  -1.385
  113   HE21  GLN  13          1HE2      GLN  13  -4.377  -3.272  -1.292
  114   HE22  GLN  13          2HE2      GLN  13  -4.139  -4.356  -2.753
  115    H    LYS  14           H        LYS  14  -4.161   1.497  -0.174
  116    HA   LYS  14           HA       LYS  14  -6.626   1.018   1.322
  117    HB2  LYS  14           1HB      LYS  14  -4.453   0.263   2.159
  118    HB3  LYS  14           2HB      LYS  14  -3.887   1.936   2.326
  119    HG2  LYS  14           2HG      LYS  14  -5.610   2.315   4.124
  120    HG3  LYS  14           1HG      LYS  14  -6.247   0.693   3.866
  121    HD2  LYS  14           1HD      LYS  14  -4.886   0.608   5.834
  122    HD3  LYS  14           2HD      LYS  14  -4.032  -0.297   4.591
  123    HE2  LYS  14           1HE      LYS  14  -2.491   1.696   4.201
  124    HE3  LYS  14           2HE      LYS  14  -3.385   2.629   5.409
  125    HZ2  LYS  14           1HZ      LYS  14  -1.426   1.657   6.350
  126    HZ3  LYS  14           2HZ      LYS  14  -2.744   1.017   7.076
  127    H    ASN  15           H        ASN  15  -4.807   4.021   0.663
  128    HA   ASN  15           HA       ASN  15  -6.140   5.896   2.364
  129    HB2  ASN  15           1HB      ASN  15  -4.033   6.238   0.862
  130    HB3  ASN  15           2HB      ASN  15  -5.226   6.541  -0.424
  131   HD21  ASN  15          1HD2      ASN  15  -4.237   8.614  -0.616
  132   HD22  ASN  15          2HD2      ASN  15  -4.641   9.960   0.565
  133    H    GLN  16           H        GLN  16  -6.756   5.225  -0.999
  134    HA   GLN  16           HA       GLN  16  -9.256   6.694  -1.210
  135    HB2  GLN  16           2HB      GLN  16  -8.944   6.376  -3.510
  136    HB3  GLN  16           1HB      GLN  16  -7.337   6.513  -2.861
  137    HG2  GLN  16           1HG      GLN  16  -7.181   3.917  -2.915
  138    HG3  GLN  16           2HG      GLN  16  -8.709   3.887  -3.767
  139   HE21  GLN  16          1HE2      GLN  16  -8.725   4.529  -5.970
  140   HE22  GLN  16          2HE2      GLN  16  -7.175   4.837  -6.901
  141    H    ASN  17           H        ASN  17  -8.675   3.367  -0.365
  142    HA   ASN  17           HA       ASN  17 -11.510   2.709  -0.257
  143    HB2  ASN  17           2HB      ASN  17  -9.815   1.081  -2.254
  144    HB3  ASN  17           1HB      ASN  17 -11.311   0.508  -1.557
  145   HD21  ASN  17          1HD2      ASN  17 -10.185   1.808  -4.300
  146   HD22  ASN  17          2HD2      ASN  17 -11.723   2.621  -4.883
  147    H    LEU  18           H        LEU  18 -10.120   2.850   2.027
  148    HA   LEU  18           HA       LEU  18  -8.560   1.269   3.159
  149    HB2  LEU  18           1HB      LEU  18 -11.390   1.657   4.252
  150    HB3  LEU  18           2HB      LEU  18 -10.030   1.216   5.252
  151    HG   LEU  18           HG       LEU  18  -9.864   3.768   3.545
  152   HD11  LEU  18          1HD1      LEU  18 -10.798   5.100   5.383
  153   HD12  LEU  18          2HD1      LEU  18 -11.995   3.957   4.744
  154   HD13  LEU  18          3HD1      LEU  18 -11.191   3.612   6.301
  155   HD21  LEU  18          1HD2      LEU  18  -8.534   3.057   6.216
  156   HD22  LEU  18          2HD2      LEU  18  -7.768   2.962   4.611
  157   HD23  LEU  18          3HD2      LEU  18  -8.283   4.537   5.239
  158    H    PHE  19           H        PHE  19 -11.641  -0.217   2.304
  159    HA   PHE  19           HA       PHE  19 -11.289  -2.771   3.544
  160    HB2  PHE  19           1HB      PHE  19 -13.113  -3.496   1.981
  161    HB3  PHE  19           2HB      PHE  19 -13.490  -2.138   3.008
  162    HD1  PHE  19           HD1      PHE  19 -13.727   0.208   1.982
  163    HD2  PHE  19           HD2      PHE  19 -13.022  -3.237  -0.498
  164    HE1  PHE  19           HE1      PHE  19 -14.515   1.449   0.014
  165    HE2  PHE  19           HE2      PHE  19 -13.813  -1.976  -2.459
  166    HZ   PHE  19           HZ       PHE  19 -14.568   0.364  -2.205
  167    H    LYS  20           H        LYS  20 -10.655  -1.903   0.139
  168    HA   LYS  20           HA       LYS  20  -8.966  -4.354  -0.199
  169    HB2  LYS  20           2HB      LYS  20 -10.950  -4.042  -1.662
  170    HB3  LYS  20           1HB      LYS  20 -10.138  -2.649  -2.361
  171    HG2  LYS  20           1HG      LYS  20  -9.035  -5.532  -2.371
  172    HG3  LYS  20           2HG      LYS  20 -10.060  -4.900  -3.636
  173    HD2  LYS  20           2HD      LYS  20  -7.238  -3.853  -2.974
  174    HD3  LYS  20           1HD      LYS  20  -7.659  -4.969  -4.258
  175    HE2  LYS  20           1HE      LYS  20  -9.119  -3.199  -5.356
  176    HE3  LYS  20           2HE      LYS  20  -8.669  -2.048  -4.089
  177    HZ2  LYS  20           1HZ      LYS  20  -6.803  -3.360  -5.982
  178    HZ3  LYS  20           2HZ      LYS  20  -7.316  -1.809  -6.054
  Start of MODEL    6
    1    H1   LYS   1           H        LYS   1  16.149  -3.590   0.833
    2    HA   LYS   1           HA       LYS   1  14.355  -2.190   2.594
    3    HB2  LYS   1           2HB      LYS   1  14.230  -0.045   1.317
    4    HB3  LYS   1           1HB      LYS   1  15.581  -0.154   2.408
    5    HG2  LYS   1           1HG      LYS   1  16.003  -0.752  -0.584
    6    HG3  LYS   1           2HG      LYS   1  15.817   0.900  -0.024
    7    HD2  LYS   1           1HD      LYS   1  17.787   0.595   1.562
    8    HD3  LYS   1           2HD      LYS   1  17.978  -1.048   0.981
    9    HE2  LYS   1           1HE      LYS   1  19.621   0.241  -0.178
   10    HE3  LYS   1           2HE      LYS   1  18.401  -0.177  -1.379
   11    HZ2  LYS   1           1HZ      LYS   1  19.099   2.127  -1.516
   12    HZ3  LYS   1           2HZ      LYS   1  18.657   2.431   0.028
   13    H    MET   2           H        MET   2  13.323  -4.049   1.875
   14    HA   MET   2           HA       MET   2  12.050  -3.841  -0.790
   15    HB2  MET   2           1HB      MET   2  12.772  -6.012  -1.587
   16    HB3  MET   2           2HB      MET   2  14.201  -5.095  -1.180
   17    HG2  MET   2           1HG      MET   2  13.069  -7.275   0.693
   18    HG3  MET   2           2HG      MET   2  14.281  -7.559  -0.566
   19    HE1  MET   2           1HE      MET   2  14.665  -8.139   2.637
   20    HE2  MET   2           2HE      MET   2  16.364  -7.612   2.827
   21    HE3  MET   2           3HE      MET   2  15.881  -8.561   1.389
   22    H    ASN   3           H        ASN   3  10.752  -3.151   1.142
   23    HA   ASN   3           HA       ASN   3   8.597  -5.131   1.430
   24    HB2  ASN   3           2HB      ASN   3   9.835  -3.816   3.952
   25    HB3  ASN   3           1HB      ASN   3   8.210  -4.454   3.944
   26   HD21  ASN   3          2HD2      ASN   3   7.903  -6.757   3.758
   27   HD22  ASN   3          1HD2      ASN   3   9.278  -7.898   4.176
   28    H    MET   4           H        MET   4   9.342  -1.798   2.712
   29    HA   MET   4           HA       MET   4   6.806  -0.844   1.804
   30    HB2  MET   4           1HB      MET   4   9.222   1.006   2.255
   31    HB3  MET   4           2HB      MET   4   7.521   1.387   2.452
   32    HG2  MET   4           1HG      MET   4   7.519  -0.370   4.422
   33    HG3  MET   4           2HG      MET   4   9.272  -0.336   4.279
   34    HE1  MET   4           1HE      MET   4   7.666   0.523   6.958
   35    HE2  MET   4           2HE      MET   4   8.592   1.973   7.443
   36    HE3  MET   4           3HE      MET   4   9.453   0.530   6.830
   37    H    LEU   5           H        LEU   5   8.368  -2.004  -0.397
   38    HA   LEU   5           HA       LEU   5   8.674   0.142  -2.442
   39    HB2  LEU   5           2HB      LEU   5   9.186  -2.881  -2.511
   40    HB3  LEU   5           1HB      LEU   5   9.373  -1.834  -3.911
   41    HG   LEU   5           HG       LEU   5  10.997  -1.762  -1.307
   42   HD11  LEU   5          1HD1      LEU   5  11.379  -3.647  -2.890
   43   HD12  LEU   5          2HD1      LEU   5  11.684  -2.495  -4.217
   44   HD13  LEU   5          3HD1      LEU   5  12.798  -2.571  -2.814
   45   HD21  LEU   5          1HD2      LEU   5  11.302   0.116  -3.746
   46   HD22  LEU   5          2HD2      LEU   5  12.490  -0.062  -2.423
   47   HD23  LEU   5          3HD2      LEU   5  10.882   0.594  -2.081
   48    H    LYS   6           H        LYS   6   7.154  -3.047  -2.730
   49    HA   LYS   6           HA       LYS   6   4.815  -1.981  -4.089
   50    HB2  LYS   6           1HB      LYS   6   5.861  -4.298  -4.482
   51    HB3  LYS   6           2HB      LYS   6   5.198  -4.829  -2.942
   52    HG2  LYS   6           1HG      LYS   6   2.855  -4.396  -3.825
   53    HG3  LYS   6           2HG      LYS   6   3.534  -3.817  -5.347
   54    HD2  LYS   6           1HD      LYS   6   4.600  -6.077  -5.732
   55    HD3  LYS   6           2HD      LYS   6   3.928  -6.678  -4.225
   56    HE2  LYS   6           2HE      LYS   6   2.237  -5.664  -6.619
   57    HE3  LYS   6           1HE      LYS   6   2.663  -7.350  -6.339
   58    HZ2  LYS   6           1HZ      LYS   6   1.083  -5.691  -4.458
   59    HZ3  LYS   6           2HZ      LYS   6   1.485  -7.258  -4.223
   60    H    GLU   7           H        GLU   7   5.398  -2.826  -0.702
   61    HA   GLU   7           HA       GLU   7   2.550  -2.634   0.102
   62    HB2  GLU   7           2HB      GLU   7   5.035  -2.354   1.922
   63    HB3  GLU   7           1HB      GLU   7   3.381  -2.414   2.497
   64    HG2  GLU   7           2HG      GLU   7   3.066  -4.728   1.628
   65    HG3  GLU   7           1HG      GLU   7   4.676  -4.727   0.920
   66    HE2  GLU   7           HE2      GLU   7   6.198  -5.365   2.028
   67    H    ASN   8           H        ASN   8   5.172  -0.121   0.025
   68    HA   ASN   8           HA       ASN   8   3.398   1.910   1.133
   69    HB2  ASN   8           1HB      ASN   8   5.889   2.303   0.739
   70    HB3  ASN   8           2HB      ASN   8   5.554   2.406  -1.022
   71   HD21  ASN   8          2HD2      ASN   8   5.340   4.509  -1.689
   72   HD22  ASN   8          1HD2      ASN   8   4.917   5.936  -0.616
   73    H    VAL   9           H        VAL   9   4.001   1.055  -2.309
   74    HA   VAL   9           HA       VAL   9   2.024   2.761  -3.437
   75    HB   VAL   9           HB       VAL   9   4.216   1.150  -4.220
   76   HG11  VAL   9          1HG2      VAL   9   1.810   0.084  -5.849
   77   HG12  VAL   9          2HG2      VAL   9   2.726  -0.875  -4.668
   78   HG13  VAL   9          3HG2      VAL   9   3.538  -0.256  -6.117
   79   HG21  VAL   9          1HG1      VAL   9   2.316   2.709  -6.015
   80   HG22  VAL   9          2HG1      VAL   9   4.005   2.216  -6.376
   81   HG23  VAL   9          3HG1      VAL   9   3.676   3.350  -5.049
   82    H    ASP  10           H        ASP  10   1.139   0.325  -1.367
   83    HA   ASP  10           HA       ASP  10  -1.289  -0.579  -2.710
   84    HB2  ASP  10           2HB      ASP  10   0.515  -2.415  -1.920
   85    HB3  ASP  10           1HB      ASP  10  -0.086  -1.966  -0.341
   86    HD2  ASP  10           HD2      ASP  10  -0.925  -3.172  -3.380
   87    H    TYR  11           H        TYR  11   0.459   0.745   0.072
   88    HA   TYR  11           HA       TYR  11  -1.715   1.178   1.936
   89    HB2  TYR  11           2HB      TYR  11   0.888   1.173   2.372
   90    HB3  TYR  11           1HB      TYR  11   0.808   2.807   1.842
   91    HD1  TYR  11           HD2      TYR  11  -0.601   0.433   4.376
   92    HD2  TYR  11           HD1      TYR  11  -0.125   4.565   3.322
   93    HE1  TYR  11           HE2      TYR  11  -1.289   1.093   6.652
   94    HE2  TYR  11           HE1      TYR  11  -0.809   5.224   5.600
   95    HH   TYR  11           HH       TYR  11  -1.674   2.778   8.048
   96    H    ILE  12           H        ILE  12  -0.550   3.249  -0.683
   97    HA   ILE  12           HA       ILE  12  -1.988   5.663   0.194
   98    HB   ILE  12           HB       ILE  12  -0.277   5.086  -2.171
   99   HG12  ILE  12          2HG1      ILE  12   0.788   7.345  -1.487
  100   HG13  ILE  12          1HG1      ILE  12  -0.279   7.373  -0.098
  101   HG21  ILE  12          1HG2      ILE  12  -2.100   7.563  -2.089
  102   HG22  ILE  12          2HG2      ILE  12  -0.757   7.308  -3.236
  103   HG23  ILE  12          3HG2      ILE  12  -2.163   6.242  -3.281
  104   HD11  ILE  12          1HD1      ILE  12   0.891   5.287   0.795
  105   HD12  ILE  12          2HD1      ILE  12   1.915   5.272  -0.672
  106   HD13  ILE  12          3HD1      ILE  12   2.023   6.616   0.481
  107    H    GLN  13           H        GLN  13  -2.409   3.272  -2.444
  108    HA   GLN  13           HA       GLN  13  -5.091   4.076  -3.064
  109    HB2  GLN  13           2HB      GLN  13  -5.324   2.010  -4.296
  110    HB3  GLN  13           1HB      GLN  13  -3.877   2.853  -4.747
  111    HG2  GLN  13           1HG      GLN  13  -2.501   1.234  -3.390
  112    HG3  GLN  13           2HG      GLN  13  -3.950   0.419  -2.846
  113   HE21  GLN  13          2HE2      GLN  13  -1.795   0.831  -5.565
  114   HE22  GLN  13          1HE2      GLN  13  -2.523  -0.526  -6.564
  115    H    LYS  14           H        LYS  14  -3.850   1.869  -0.510
  116    HA   LYS  14           HA       LYS  14  -6.477   0.788   0.161
  117    HB2  LYS  14           2HB      LYS  14  -4.327  -0.309   0.802
  118    HB3  LYS  14           1HB      LYS  14  -4.025   0.978   1.985
  119    HG2  LYS  14           1HG      LYS  14  -6.138   0.226   3.218
  120    HG3  LYS  14           2HG      LYS  14  -6.402  -0.988   1.971
  121    HD2  LYS  14           1HD      LYS  14  -5.437  -2.128   3.835
  122    HD3  LYS  14           2HD      LYS  14  -4.201  -2.096   2.583
  123    HE2  LYS  14           2HE      LYS  14  -3.055  -0.151   3.785
  124    HE3  LYS  14           1HE      LYS  14  -4.323  -0.169   5.017
  125    HZ2  LYS  14           1HZ      LYS  14  -2.414  -1.383   5.745
  126    HZ3  LYS  14           2HZ      LYS  14  -3.671  -2.417   5.594
  127    H    ASN  15           H        ASN  15  -4.842   3.756   1.235
  128    HA   ASN  15           HA       ASN  15  -6.511   4.458   3.461
  129    HB2  ASN  15           1HB      ASN  15  -4.240   5.520   2.663
  130    HB3  ASN  15           2HB      ASN  15  -5.296   6.470   1.589
  131   HD21  ASN  15          1HD2      ASN  15  -4.437   8.320   2.652
  132   HD22  ASN  15          2HD2      ASN  15  -5.050   8.829   4.306
  133    H    GLN  16           H        GLN  16  -6.657   5.609   0.157
  134    HA   GLN  16           HA       GLN  16  -9.171   7.030   0.432
  135    HB2  GLN  16           2HB      GLN  16  -8.593   7.963  -1.625
  136    HB3  GLN  16           1HB      GLN  16  -7.085   7.717  -0.799
  137    HG2  GLN  16           2HG      GLN  16  -6.734   5.559  -2.202
  138    HG3  GLN  16           1HG      GLN  16  -8.170   5.984  -3.115
  139   HE21  GLN  16          2HE2      GLN  16  -4.812   6.694  -2.648
  140   HE22  GLN  16          1HE2      GLN  16  -4.690   7.933  -3.996
  141    H    ASN  17           H        ASN  17  -8.388   3.980  -1.194
  142    HA   ASN  17           HA       ASN  17 -11.149   3.659  -2.224
  143    HB2  ASN  17           2HB      ASN  17  -8.824   1.686  -2.485
  144    HB3  ASN  17           1HB      ASN  17 -10.385   1.487  -3.228
  145   HD21  ASN  17          2HD2      ASN  17 -11.050   3.104  -4.869
  146   HD22  ASN  17          1HD2      ASN  17  -9.730   3.892  -5.870
  147    H    LEU  18           H        LEU  18  -9.590   2.559   0.710
  148    HA   LEU  18           HA       LEU  18  -9.781   0.719   2.141
  149    HB2  LEU  18           1HB      LEU  18 -12.488   2.063   1.846
  150    HB3  LEU  18           2HB      LEU  18 -11.968   1.181   3.258
  151    HG   LEU  18           HG       LEU  18 -10.112   3.428   2.264
  152   HD11  LEU  18          1HD2      LEU  18 -12.672   4.033   3.775
  153   HD12  LEU  18          2HD2      LEU  18 -12.264   4.476   2.088
  154   HD13  LEU  18          3HD2      LEU  18 -11.314   5.159   3.422
  155   HD21  LEU  18          1HD1      LEU  18 -10.777   2.469   5.090
  156   HD22  LEU  18          2HD1      LEU  18  -9.557   3.693   4.614
  157   HD23  LEU  18          3HD1      LEU  18  -9.350   2.001   4.123
  158    H    PHE  19           H        PHE  19  -9.605  -0.760  -0.103
  159    HA   PHE  19           HA       PHE  19 -11.782  -2.611  -0.386
  160    HB2  PHE  19           2HB      PHE  19 -10.050  -3.840  -1.829
  161    HB3  PHE  19           1HB      PHE  19 -10.477  -2.214  -2.288
  162    HD1  PHE  19           HD1      PHE  19  -7.785  -4.082  -0.318
  163    HD2  PHE  19           HD2      PHE  19  -8.714  -0.654  -2.746
  164    HE1  PHE  19           HE1      PHE  19  -5.398  -3.492  -0.414
  165    HE2  PHE  19           HE2      PHE  19  -6.330  -0.088  -2.842
  166    HZ   PHE  19           HZ       PHE  19  -4.663  -1.501  -1.674
  167    H    LYS  20           H        LYS  20 -10.958  -5.196  -0.375
  168    HA   LYS  20           HA       LYS  20 -10.800  -5.867   2.457
  169    HB2  LYS  20           2HB      LYS  20 -12.307  -6.947   0.790
  170    HB3  LYS  20           1HB      LYS  20 -10.891  -7.768   0.150
  171    HG2  LYS  20           2HG      LYS  20 -11.884  -7.999   3.068
  172    HG3  LYS  20           1HG      LYS  20 -12.440  -9.034   1.764
  173    HD2  LYS  20           2HD      LYS  20 -10.052  -9.840   1.386
  174    HD3  LYS  20           1HD      LYS  20  -9.541  -8.894   2.788
  175    HE2  LYS  20           1HE      LYS  20 -11.137 -10.205   4.267
  176    HE3  LYS  20           2HE      LYS  20 -11.641 -11.165   2.867
  177    HZ2  LYS  20           1HZ      LYS  20  -9.375 -11.940   2.626
  178    HZ3  LYS  20           2HZ      LYS  20  -9.957 -12.295   4.112
  Start of MODEL    7
    1    H1   LYS   1           H        LYS   1  16.470  -2.543   0.896
    2    HA   LYS   1           HA       LYS   1  14.416  -1.746   2.745
    3    HB2  LYS   1           1HB      LYS   1  13.881   0.485   1.755
    4    HB3  LYS   1           2HB      LYS   1  15.232   0.483   2.855
    5    HG2  LYS   1           2HG      LYS   1  15.765   0.376  -0.175
    6    HG3  LYS   1           1HG      LYS   1  15.257   1.877   0.579
    7    HD2  LYS   1           2HD      LYS   1  17.225   1.758   2.171
    8    HD3  LYS   1           1HD      LYS   1  17.768   0.279   1.375
    9    HE2  LYS   1           2HE      LYS   1  17.994   1.532  -0.823
   10    HE3  LYS   1           1HE      LYS   1  17.457   3.019  -0.029
   11    HZ2  LYS   1           1HZ      LYS   1  19.853   2.863  -0.163
   12    HZ3  LYS   1           2HZ      LYS   1  19.881   1.456   0.670
   13    H    MET   2           H        MET   2  13.716  -3.644   1.772
   14    HA   MET   2           HA       MET   2  12.517  -3.321  -0.915
   15    HB2  MET   2           1HB      MET   2  13.628  -5.221  -1.921
   16    HB3  MET   2           2HB      MET   2  14.857  -4.136  -1.326
   17    HG2  MET   2           2HG      MET   2  14.064  -6.703   0.197
   18    HG3  MET   2           1HG      MET   2  15.352  -6.603  -1.013
   19    HE1  MET   2           1HE      MET   2  15.774  -7.560   2.064
   20    HE2  MET   2           2HE      MET   2  17.080  -7.537   0.837
   21    HE3  MET   2           3HE      MET   2  17.328  -6.749   2.423
   22    H    ASN   3           H        ASN   3  11.028  -3.160   1.049
   23    HA   ASN   3           HA       ASN   3   9.256  -5.513   0.940
   24    HB2  ASN   3           2HB      ASN   3  10.080  -4.335   3.694
   25    HB3  ASN   3           1HB      ASN   3   8.674  -5.348   3.471
   26   HD21  ASN   3          1HD2      ASN   3   8.991  -7.609   2.946
   27   HD22  ASN   3          2HD2      ASN   3  10.591  -8.415   3.343
   28    H    MET   4           H        MET   4   9.423  -2.225   2.501
   29    HA   MET   4           HA       MET   4   6.715  -1.657   1.740
   30    HB2  MET   4           2HB      MET   4   8.811   0.519   2.272
   31    HB3  MET   4           1HB      MET   4   7.077   0.590   2.527
   32    HG2  MET   4           1HG      MET   4   7.441  -1.280   4.365
   33    HG3  MET   4           2HG      MET   4   9.154  -0.926   4.187
   34    HE1  MET   4           1HE      MET   4   9.286  -0.213   6.783
   35    HE2  MET   4           2HE      MET   4   8.205   1.002   7.527
   36    HE3  MET   4           3HE      MET   4   7.536  -0.557   6.960
   37    H    LEU   5           H        LEU   5   7.937  -2.543  -0.651
   38    HA   LEU   5           HA       LEU   5   8.437  -0.245  -2.458
   39    HB2  LEU   5           1HB      LEU   5   9.516  -1.476  -4.032
   40    HB3  LEU   5           2HB      LEU   5  10.190  -1.731  -2.461
   41    HG   LEU   5           HG       LEU   5   8.543  -3.876  -2.460
   42   HD11  LEU   5          1HD1      LEU   5   9.236  -3.603  -5.468
   43   HD12  LEU   5          2HD1      LEU   5   7.605  -3.390  -4.813
   44   HD13  LEU   5          3HD1      LEU   5   8.395  -4.972  -4.680
   45   HD21  LEU   5          1HD2      LEU   5  10.957  -3.865  -2.122
   46   HD22  LEU   5          2HD2      LEU   5  10.537  -5.200  -3.222
   47   HD23  LEU   5          3HD2      LEU   5  11.271  -3.683  -3.863
   48    H    LYS   6           H        LYS   6   6.727  -3.330  -2.479
   49    HA   LYS   6           HA       LYS   6   4.447  -2.299  -4.018
   50    HB2  LYS   6           1HB      LYS   6   5.575  -4.674  -4.207
   51    HB3  LYS   6           2HB      LYS   6   4.762  -5.106  -2.732
   52    HG2  LYS   6           2HG      LYS   6   3.430  -4.243  -5.391
   53    HG3  LYS   6           1HG      LYS   6   3.704  -5.897  -4.898
   54    HD2  LYS   6           2HD      LYS   6   1.732  -3.929  -3.601
   55    HD3  LYS   6           1HD      LYS   6   1.356  -5.277  -4.649
   56    HE2  LYS   6           1HE      LYS   6   2.250  -6.911  -2.914
   57    HE3  LYS   6           2HE      LYS   6   2.605  -5.556  -1.832
   58    HZ2  LYS   6           1HZ      LYS   6   0.270  -4.990  -1.820
   59    HZ3  LYS   6           2HZ      LYS   6   0.500  -6.526  -1.309
   60    H    GLU   7           H        GLU   7   5.055  -3.303  -0.656
   61    HA   GLU   7           HA       GLU   7   2.296  -2.932   0.275
   62    HB2  GLU   7           1HB      GLU   7   4.897  -2.764   1.937
   63    HB3  GLU   7           2HB      GLU   7   3.301  -2.723   2.645
   64    HG2  GLU   7           2HG      GLU   7   4.445  -5.111   1.055
   65    HG3  GLU   7           1HG      GLU   7   4.438  -4.955   2.800
   66    HE2  GLU   7           HE2      GLU   7   2.747  -5.758   0.113
   67    H    ASN   8           H        ASN   8   4.953  -0.488   0.056
   68    HA   ASN   8           HA       ASN   8   3.302   1.591   1.276
   69    HB2  ASN   8           2HB      ASN   8   5.804   1.874   0.784
   70    HB3  ASN   8           1HB      ASN   8   5.404   2.004  -0.959
   71   HD21  ASN   8          1HD2      ASN   8   5.250   4.117  -1.613
   72   HD22  ASN   8          2HD2      ASN   8   4.944   5.557  -0.518
   73    H    VAL   9           H        VAL   9   3.752   0.745  -2.192
   74    HA   VAL   9           HA       VAL   9   1.803   2.541  -3.239
   75    HB   VAL   9           HB       VAL   9   3.892   0.831  -4.113
   76   HG11  VAL   9          1HG2      VAL   9   3.073  -0.489  -6.021
   77   HG12  VAL   9          2HG2      VAL   9   1.377  -0.067  -5.678
   78   HG13  VAL   9          3HG2      VAL   9   2.286  -1.103  -4.557
   79   HG21  VAL   9          1HG1      VAL   9   3.452   3.076  -4.882
   80   HG22  VAL   9          2HG1      VAL   9   2.029   2.532  -5.816
   81   HG23  VAL   9          3HG1      VAL   9   3.675   1.954  -6.240
   82    H    ASP  10           H        ASP  10   0.985   0.045  -1.205
   83    HA   ASP  10           HA       ASP  10  -1.544  -0.784  -2.428
   84    HB2  ASP  10           1HB      ASP  10   0.260  -2.653  -1.736
   85    HB3  ASP  10           2HB      ASP  10  -0.210  -2.172  -0.121
   86    HD2  ASP  10           HD2      ASP  10  -1.363  -3.306  -3.100
   87    H    TYR  11           H        TYR  11   0.317   0.535   0.282
   88    HA   TYR  11           HA       TYR  11  -1.819   1.008   2.203
   89    HB2  TYR  11           1HB      TYR  11   0.797   0.925   2.606
   90    HB3  TYR  11           2HB      TYR  11   0.756   2.554   2.072
   91    HD1  TYR  11           HD2      TYR  11  -0.746   0.245   4.623
   92    HD2  TYR  11           HD1      TYR  11  -0.085   4.347   3.554
   93    HE1  TYR  11           HE2      TYR  11  -1.417   0.945   6.893
   94    HE2  TYR  11           HE1      TYR  11  -0.752   5.047   5.825
   95    HH   TYR  11           HH       TYR  11  -1.460   4.388   7.825
   96    H    ILE  12           H        ILE  12  -0.525   3.045  -0.376
   97    HA   ILE  12           HA       ILE  12  -1.927   5.508   0.441
   98    HB   ILE  12           HB       ILE  12  -0.080   4.897  -1.808
   99   HG12  ILE  12          2HG1      ILE  12   0.999   7.109  -1.058
  100   HG13  ILE  12          1HG1      ILE  12  -0.170   7.197   0.246
  101   HG21  ILE  12          1HG2      ILE  12  -1.866   6.086  -3.040
  102   HG22  ILE  12          2HG2      ILE  12  -0.448   7.129  -2.897
  103   HG23  ILE  12          3HG2      ILE  12  -1.861   7.406  -1.844
  104   HD11  ILE  12          1HD1      ILE  12   0.851   5.099   1.265
  105   HD12  ILE  12          2HD1      ILE  12   2.061   6.369   1.001
  106   HD13  ILE  12          3HD1      ILE  12   1.975   4.997  -0.121
  107    H    GLN  13           H        GLN  13  -2.213   3.141  -2.220
  108    HA   GLN  13           HA       GLN  13  -4.817   3.851  -3.091
  109    HB2  GLN  13           1HB      GLN  13  -3.650   1.080  -3.219
  110    HB3  GLN  13           2HB      GLN  13  -5.050   1.651  -4.046
  111    HG2  GLN  13           1HG      GLN  13  -3.708   3.380  -5.304
  112    HG3  GLN  13           2HG      GLN  13  -2.245   2.776  -4.551
  113   HE21  GLN  13          1HE2      GLN  13  -4.595   2.197  -7.030
  114   HE22  GLN  13          2HE2      GLN  13  -3.786   0.705  -7.728
  115    H    LYS  14           H        LYS  14  -3.890   1.787  -0.301
  116    HA   LYS  14           HA       LYS  14  -6.596   0.843   0.242
  117    HB2  LYS  14           2HB      LYS  14  -4.567  -0.300   1.097
  118    HB3  LYS  14           1HB      LYS  14  -4.245   1.053   2.198
  119    HG2  LYS  14           2HG      LYS  14  -6.422   0.506   3.399
  120    HG3  LYS  14           1HG      LYS  14  -6.737  -0.763   2.220
  121    HD2  LYS  14           1HD      LYS  14  -5.905  -1.839   4.188
  122    HD3  LYS  14           2HD      LYS  14  -4.652  -1.989   2.963
  123    HE2  LYS  14           2HE      LYS  14  -3.370  -0.066   4.058
  124    HE3  LYS  14           1HE      LYS  14  -4.654   0.101   5.262
  125    HZ2  LYS  14           1HZ      LYS  14  -2.856  -1.213   6.102
  126    HZ3  LYS  14           2HZ      LYS  14  -4.196  -2.144   6.004
  127    H    ASN  15           H        ASN  15  -4.942   3.810   1.272
  128    HA   ASN  15           HA       ASN  15  -6.752   4.700   3.314
  129    HB2  ASN  15           1HB      ASN  15  -4.390   5.642   2.637
  130    HB3  ASN  15           2HB      ASN  15  -5.327   6.561   1.433
  131   HD21  ASN  15          1HD2      ASN  15  -4.485   8.442   2.456
  132   HD22  ASN  15          2HD2      ASN  15  -5.206   9.065   4.026
  133    H    GLN  16           H        GLN  16  -6.598   5.654  -0.052
  134    HA   GLN  16           HA       GLN  16  -9.069   7.171  -0.070
  135    HB2  GLN  16           2HB      GLN  16  -8.297   7.940  -2.133
  136    HB3  GLN  16           1HB      GLN  16  -6.868   7.699  -1.176
  137    HG2  GLN  16           1HG      GLN  16  -6.501   5.436  -2.399
  138    HG3  GLN  16           2HG      GLN  16  -7.841   5.850  -3.453
  139   HE21  GLN  16          2HE2      GLN  16  -4.498   6.399  -2.816
  140   HE22  GLN  16          1HE2      GLN  16  -4.221   7.564  -4.206
  141    H    ASN  17           H        ASN  17  -8.280   4.001  -1.443
  142    HA   ASN  17           HA       ASN  17 -10.986   3.695  -2.629
  143    HB2  ASN  17           1HB      ASN  17  -8.676   1.684  -2.676
  144    HB3  ASN  17           2HB      ASN  17 -10.202   1.473  -3.492
  145   HD21  ASN  17          2HD2      ASN  17  -7.117   2.378  -4.087
  146   HD22  ASN  17          1HD2      ASN  17  -7.417   3.383  -5.592
  147    H    LEU  18           H        LEU  18  -9.652   2.758   0.448
  148    HA   LEU  18           HA       LEU  18  -9.943   1.007   1.968
  149    HB2  LEU  18           1HB      LEU  18 -12.625   2.310   1.390
  150    HB3  LEU  18           2HB      LEU  18 -12.212   1.517   2.888
  151    HG   LEU  18           HG       LEU  18 -10.290   3.712   1.905
  152   HD11  LEU  18          1HD1      LEU  18 -12.957   4.391   3.183
  153   HD12  LEU  18          2HD1      LEU  18 -12.428   4.731   1.505
  154   HD13  LEU  18          3HD1      LEU  18 -11.579   5.502   2.860
  155   HD21  LEU  18          1HD2      LEU  18  -9.914   4.122   4.268
  156   HD22  LEU  18          2HD2      LEU  18  -9.668   2.405   3.900
  157   HD23  LEU  18          3HD2      LEU  18 -11.164   2.923   4.727
  158    H    PHE  19           H        PHE  19  -9.599  -0.601  -0.174
  159    HA   PHE  19           HA       PHE  19 -11.725  -2.524  -0.413
  160    HB2  PHE  19           1HB      PHE  19  -9.918  -3.799  -1.708
  161    HB3  PHE  19           2HB      PHE  19 -10.368  -2.217  -2.288
  162    HD1  PHE  19           HD2      PHE  19  -7.697  -3.844  -0.081
  163    HD2  PHE  19           HD1      PHE  19  -8.626  -0.681  -2.847
  164    HE1  PHE  19           HE2      PHE  19  -5.321  -3.214  -0.174
  165    HE2  PHE  19           HE1      PHE  19  -6.250  -0.079  -2.939
  166    HZ   PHE  19           HZ       PHE  19  -4.589  -1.338  -1.608
  167    H    LYS  20           H        LYS  20 -10.850  -5.078  -0.171
  168    HA   LYS  20           HA       LYS  20 -10.732  -5.520   2.709
  169    HB2  LYS  20           1HB      LYS  20 -12.212  -6.780   1.217
  170    HB3  LYS  20           2HB      LYS  20 -10.782  -7.532   0.504
  171    HG2  LYS  20           2HG      LYS  20 -10.195  -8.488   2.790
  172    HG3  LYS  20           1HG      LYS  20 -11.652  -7.776   3.460
  173    HD2  LYS  20           2HD      LYS  20 -11.605  -9.898   1.195
  174    HD3  LYS  20           1HD      LYS  20 -11.722 -10.251   2.901
  175    HE2  LYS  20           2HE      LYS  20 -13.947 -10.433   2.202
  176    HE3  LYS  20           1HE      LYS  20 -13.911  -8.871   3.011
  177    HZ2  LYS  20           1HZ      LYS  20 -15.105  -8.818   0.920
  178    HZ3  LYS  20           2HZ      LYS  20 -13.806  -9.341   0.077
  Start of MODEL    8
    1    H1   LYS   1           H        LYS   1  17.279  -2.361  -0.838
    2    HA   LYS   1           HA       LYS   1  15.229  -2.054  -2.838
    3    HB2  LYS   1           2HB      LYS   1  14.043  -4.219  -2.435
    4    HB3  LYS   1           1HB      LYS   1  15.392  -4.327  -3.527
    5    HG2  LYS   1           2HG      LYS   1  15.763  -5.139  -0.580
    6    HG3  LYS   1           1HG      LYS   1  14.913  -6.194  -1.695
    7    HD2  LYS   1           2HD      LYS   1  16.956  -6.215  -3.230
    8    HD3  LYS   1           1HD      LYS   1  17.801  -5.201  -2.077
    9    HE2  LYS   1           2HE      LYS   1  18.570  -7.424  -1.663
   10    HE3  LYS   1           1HE      LYS   1  17.548  -7.007  -0.290
   11    HZ2  LYS   1           1HZ      LYS   1  17.088  -9.213  -1.074
   12    HZ3  LYS   1           2HZ      LYS   1  15.759  -8.288  -1.303
   13    H    MET   2           H        MET   2  14.930  -0.375  -1.453
   14    HA   MET   2           HA       MET   2  13.514  -0.931   1.061
   15    HB2  MET   2           2HB      MET   2  15.024   0.114   2.621
   16    HB3  MET   2           1HB      MET   2  15.967  -1.046   1.720
   17    HG2  MET   2           1HG      MET   2  16.933   0.830   0.302
   18    HG3  MET   2           2HG      MET   2  16.060   2.007   1.305
   19    HE1  MET   2           1HE      MET   2  19.780   2.326   2.622
   20    HE2  MET   2           2HE      MET   2  19.251   2.034   0.939
   21    HE3  MET   2           3HE      MET   2  18.369   3.207   1.966
   22    H    ASN   3           H        ASN   3  12.212  -0.203  -0.760
   23    HA   ASN   3           HA       ASN   3  11.296   2.520  -0.214
   24    HB2  ASN   3           2HB      ASN   3  11.988   1.760  -3.148
   25    HB3  ASN   3           1HB      ASN   3  10.924   3.080  -2.726
   26   HD21  ASN   3          1HD2      ASN   3  14.160   2.285  -3.284
   27   HD22  ASN   3          2HD2      ASN   3  14.878   3.873  -2.712
   28    H    MET   4           H        MET   4  10.577  -0.105  -2.648
   29    HA   MET   4           HA       MET   4   7.793  -0.003  -1.966
   30    HB2  MET   4           1HB      MET   4   9.102  -2.466  -3.257
   31    HB3  MET   4           2HB      MET   4   7.454  -1.894  -3.443
   32    HG2  MET   4           2HG      MET   4   8.501   0.231  -4.618
   33    HG3  MET   4           1HG      MET   4   9.998  -0.690  -4.643
   34    HE1  MET   4           1HE      MET   4  10.060  -0.580  -7.332
   35    HE2  MET   4           2HE      MET   4   8.534   0.358  -7.317
   36    HE3  MET   4           3HE      MET   4   8.692  -1.079  -8.370
   37    H    LEU   5           H        LEU   5   9.465  -0.567   0.376
   38    HA   LEU   5           HA       LEU   5   8.553  -3.189   1.462
   39    HB2  LEU   5           2HB      LEU   5  10.400  -1.016   2.584
   40    HB3  LEU   5           1HB      LEU   5   9.947  -2.463   3.475
   41    HG   LEU   5           HG       LEU   5  11.588  -2.316   0.883
   42   HD11  LEU   5          1HD1      LEU   5  12.268  -3.110   3.777
   43   HD12  LEU   5          2HD1      LEU   5  13.412  -3.044   2.396
   44   HD13  LEU   5          3HD1      LEU   5  12.652  -1.550   3.003
   45   HD21  LEU   5          1HD2      LEU   5  10.763  -4.865   2.427
   46   HD22  LEU   5          2HD2      LEU   5  12.013  -4.787   1.152
   47   HD23  LEU   5          3HD2      LEU   5  10.322  -4.446   0.751
   48    H    LYS   6           H        LYS   6   8.675  -0.015   3.036
   49    HA   LYS   6           HA       LYS   6   6.004  -0.282   4.141
   50    HB2  LYS   6           2HB      LYS   6   7.946   0.997   5.222
   51    HB3  LYS   6           1HB      LYS   6   7.745   2.271   4.025
   52    HG2  LYS   6           1HG      LYS   6   5.401   2.701   4.897
   53    HG3  LYS   6           2HG      LYS   6   5.585   1.378   6.051
   54    HD2  LYS   6           2HD      LYS   6   7.533   2.613   7.140
   55    HD3  LYS   6           1HD      LYS   6   7.359   3.901   5.959
   56    HE2  LYS   6           2HE      LYS   6   6.304   4.690   7.964
   57    HE3  LYS   6           1HE      LYS   6   5.002   4.377   6.820
   58    HZ2  LYS   6           1HZ      LYS   6   5.844   2.601   9.050
   59    HZ3  LYS   6           2HZ      LYS   6   4.514   3.550   9.028
   60    H    GLU   7           H        GLU   7   7.175   1.322   1.211
   61    HA   GLU   7           HA       GLU   7   4.638   2.754   0.665
   62    HB2  GLU   7           1HB      GLU   7   6.854   2.008  -1.358
   63    HB3  GLU   7           2HB      GLU   7   5.458   2.999  -1.735
   64    HG2  GLU   7           1HG      GLU   7   6.153   4.747  -0.088
   65    HG3  GLU   7           2HG      GLU   7   7.544   3.784   0.398
   66    HE2  GLU   7           HE2      GLU   7   9.555   4.862  -2.133
   67    H    ASN   8           H        ASN   8   5.797  -0.525  -0.391
   68    HA   ASN   8           HA       ASN   8   3.360  -1.000  -1.931
   69    HB2  ASN   8           2HB      ASN   8   5.399  -2.563  -1.953
   70    HB3  ASN   8           1HB      ASN   8   4.929  -3.126  -0.312
   71   HD21  ASN   8          2HD2      ASN   8   3.691  -4.974  -0.375
   72   HD22  ASN   8          1HD2      ASN   8   2.804  -5.611  -1.849
   73    H    VAL   9           H        VAL   9   4.056  -1.789   1.511
   74    HA   VAL   9           HA       VAL   9   1.457  -2.735   2.172
   75    HB   VAL   9           HB       VAL   9   4.067  -2.613   3.252
   76   HG11  VAL   9          1HG1      VAL   9   3.589  -0.438   4.500
   77   HG12  VAL   9          2HG1      VAL   9   3.933  -1.805   5.574
   78   HG13  VAL   9          3HG1      VAL   9   2.257  -1.241   5.357
   79   HG21  VAL   9          1HG2      VAL   9   3.258  -4.155   4.927
   80   HG22  VAL   9          2HG2      VAL   9   1.554  -3.712   4.572
   81   HG23  VAL   9          3HG2      VAL   9   2.568  -4.498   3.327
   82    H    ASP  10           H        ASP  10   2.001   0.413   1.237
   83    HA   ASP  10           HA       ASP  10   0.130   1.797   3.024
   84    HB2  ASP  10           1HB      ASP  10   2.585   2.786   2.679
   85    HB3  ASP  10           2HB      ASP  10   1.988   3.130   1.072
   86    HD2  ASP  10           HD2      ASP  10   0.001   5.796   1.960
   87    H    TYR  11           H        TYR  11   1.218   0.908  -0.228
   88    HA   TYR  11           HA       TYR  11  -0.930   2.053  -1.819
   89    HB2  TYR  11           1HB      TYR  11   1.503   1.181  -2.562
   90    HB3  TYR  11           2HB      TYR  11   0.701  -0.325  -2.675
   91    HD1  TYR  11           HD1      TYR  11   0.520   3.209  -3.898
   92    HD2  TYR  11           HD2      TYR  11  -0.940  -0.777  -4.497
   93    HE1  TYR  11           HE1      TYR  11  -0.388   3.874  -6.098
   94    HE2  TYR  11           HE2      TYR  11  -1.850  -0.115  -6.695
   95    HH   TYR  11           HH       TYR  11  -2.136   1.539  -8.151
   96    H    ILE  12           H        ILE  12  -0.591  -1.139  -0.352
   97    HA   ILE  12           HA       ILE  12  -2.921  -2.340  -1.703
   98    HB   ILE  12           HB       ILE  12  -0.888  -3.407   0.178
   99   HG12  ILE  12          2HG1      ILE  12  -0.877  -5.371  -1.424
  100   HG13  ILE  12          1HG1      ILE  12  -2.148  -4.612  -2.366
  101   HG21  ILE  12          1HG2      ILE  12  -2.908  -4.191   1.362
  102   HG22  ILE  12          2HG2      ILE  12  -3.585  -4.850  -0.148
  103   HG23  ILE  12          3HG2      ILE  12  -2.118  -5.559   0.576
  104   HD11  ILE  12          1HD1      ILE  12   0.119  -4.370  -3.402
  105   HD12  ILE  12          2HD1      ILE  12   0.702  -3.478  -1.981
  106   HD13  ILE  12          3HD1      ILE  12  -0.554  -2.769  -3.033
  107    H    GLN  13           H        GLN  13  -2.130  -1.362   1.641
  108    HA   GLN  13           HA       GLN  13  -4.768  -1.289   2.663
  109    HB2  GLN  13           1HB      GLN  13  -2.508   0.487   3.555
  110    HB3  GLN  13           2HB      GLN  13  -4.023   0.295   4.349
  111    HG2  GLN  13           1HG      GLN  13  -3.658  -2.134   4.751
  112    HG3  GLN  13           2HG      GLN  13  -2.117  -2.065   3.914
  113   HE21  GLN  13          1HE2      GLN  13  -0.594  -2.298   5.494
  114   HE22  GLN  13          2HE2      GLN  13  -0.575  -1.392   7.090
  115    H    LYS  14           H        LYS  14  -3.156   1.179   0.621
  116    HA   LYS  14           HA       LYS  14  -5.241   3.200   0.979
  117    HB2  LYS  14           1HB      LYS  14  -2.998   3.840   0.261
  118    HB3  LYS  14           2HB      LYS  14  -3.153   2.906  -1.239
  119    HG2  LYS  14           2HG      LYS  14  -4.989   4.502  -1.981
  120    HG3  LYS  14           1HG      LYS  14  -4.838   5.363  -0.455
  121    HD2  LYS  14           1HD      LYS  14  -3.664   6.643  -2.105
  122    HD3  LYS  14           2HD      LYS  14  -2.446   5.972  -1.027
  123    HE2  LYS  14           1HE      LYS  14  -1.910   4.174  -2.754
  124    HE3  LYS  14           2HE      LYS  14  -3.180   4.804  -3.811
  125    HZ2  LYS  14           1HZ      LYS  14  -0.760   6.275  -2.925
  126    HZ3  LYS  14           2HZ      LYS  14  -1.002   5.624  -4.404
  127    H    ASN  15           H        ASN  15  -4.749   0.709  -1.523
  128    HA   ASN  15           HA       ASN  15  -6.808   1.341  -3.400
  129    HB2  ASN  15           2HB      ASN  15  -4.869  -0.438  -3.538
  130    HB3  ASN  15           1HB      ASN  15  -6.032  -1.473  -2.682
  131   HD21  ASN  15          1HD2      ASN  15  -5.984  -2.878  -4.440
  132   HD22  ASN  15          2HD2      ASN  15  -6.835  -2.512  -6.027
  133    H    GLN  16           H        GLN  16  -6.895  -1.017  -0.830
  134    HA   GLN  16           HA       GLN  16  -9.670  -1.738  -1.052
  135    HB2  GLN  16           2HB      GLN  16  -9.161  -3.381   0.459
  136    HB3  GLN  16           1HB      GLN  16  -7.642  -3.117  -0.341
  137    HG2  GLN  16           2HG      GLN  16  -6.854  -1.699   1.648
  138    HG3  GLN  16           1HG      GLN  16  -8.363  -2.044   2.472
  139   HE21  GLN  16          1HE2      GLN  16  -5.245  -3.308   1.697
  140   HE22  GLN  16          2HE2      GLN  16  -5.462  -4.907   2.571
  141    H    ASN  17           H        ASN  17  -8.186   0.723   0.975
  142    HA   ASN  17           HA       ASN  17 -10.467   1.072   2.743
  143    HB2  ASN  17           1HB      ASN  17  -8.148   1.666   3.414
  144    HB3  ASN  17           2HB      ASN  17  -8.096   2.962   2.241
  145   HD21  ASN  17          2HD2      ASN  17  -8.880   4.951   2.945
  146   HD22  ASN  17          1HD2      ASN  17  -9.691   5.210   4.570
  147    H    LEU  18           H        LEU  18  -9.539   2.878  -0.263
  148    HA   LEU  18           HA       LEU  18 -11.564   4.754  -0.301
  149    HB2  LEU  18           2HB      LEU  18 -10.361   3.288  -2.692
  150    HB3  LEU  18           1HB      LEU  18 -11.190   4.828  -2.787
  151    HG   LEU  18           HG       LEU  18  -8.745   4.448  -0.968
  152   HD11  LEU  18          1HD2      LEU  18  -7.284   5.304  -2.758
  153   HD12  LEU  18          2HD2      LEU  18  -8.657   5.310  -3.910
  154   HD13  LEU  18          3HD2      LEU  18  -8.046   3.773  -3.232
  155   HD21  LEU  18          1HD1      LEU  18  -9.969   6.986  -2.111
  156   HD22  LEU  18          2HD1      LEU  18  -8.469   6.867  -1.126
  157   HD23  LEU  18          3HD1      LEU  18 -10.027   6.408  -0.419
  158    H    PHE  19           H        PHE  19 -11.853   1.765  -2.247
  159    HA   PHE  19           HA       PHE  19 -14.745   1.983  -2.414
  160    HB2  PHE  19           2HB      PHE  19 -14.541  -0.064  -3.826
  161    HB3  PHE  19           1HB      PHE  19 -13.607   1.308  -4.355
  162    HD1  PHE  19           HD2      PHE  19 -13.095  -1.868  -2.241
  163    HD2  PHE  19           HD1      PHE  19 -11.443   0.821  -5.173
  164    HE1  PHE  19           HE2      PHE  19 -11.224  -3.409  -2.615
  165    HE2  PHE  19           HE1      PHE  19  -9.599  -0.753  -5.554
  166    HZ   PHE  19           HZ       PHE  19  -9.473  -2.862  -4.271
  167    H    LYS  20           H        LYS  20 -15.934  -0.456  -2.207
  168    HA   LYS  20           HA       LYS  20 -16.130  -0.888   0.668
  169    HB2  LYS  20           1HB      LYS  20 -18.075  -0.754  -0.834
  170    HB3  LYS  20           2HB      LYS  20 -17.553  -2.274  -1.567
  171    HG2  LYS  20           1HG      LYS  20 -17.858  -3.436   0.673
  172    HG3  LYS  20           2HG      LYS  20 -18.347  -1.898   1.390
  173    HD2  LYS  20           1HD      LYS  20 -20.308  -1.783  -0.223
  174    HD3  LYS  20           2HD      LYS  20 -19.812  -3.328  -0.925
  175    HE2  LYS  20           2HE      LYS  20 -20.139  -4.457   1.335
  176    HE3  LYS  20           1HE      LYS  20 -20.641  -2.909   2.032
  177    HZ2  LYS  20           1HZ      LYS  20 -22.532  -4.207   1.397
  178    HZ3  LYS  20           2HZ      LYS  20 -22.485  -2.852   0.483
  Start of MODEL    9
    1    H1   LYS   1           H        LYS   1  17.293  -2.388  -1.863
    2    HA   LYS   1           HA       LYS   1  15.072  -1.406  -3.406
    3    HB2  LYS   1           1HB      LYS   1  13.768  -3.642  -3.455
    4    HB3  LYS   1           2HB      LYS   1  14.884  -3.251  -4.734
    5    HG2  LYS   1           2HG      LYS   1  15.152  -5.548  -4.424
    6    HG3  LYS   1           1HG      LYS   1  16.611  -4.808  -3.819
    7    HD2  LYS   1           1HD      LYS   1  16.041  -6.661  -2.409
    8    HD3  LYS   1           2HD      LYS   1  15.879  -5.202  -1.457
    9    HE2  LYS   1           2HE      LYS   1  13.324  -5.307  -1.807
   10    HE3  LYS   1           1HE      LYS   1  13.539  -6.781  -2.762
   11    HZ2  LYS   1           1HZ      LYS   1  14.490  -7.850  -0.825
   12    HZ3  LYS   1           2HZ      LYS   1  12.988  -7.292  -0.502
   13    H    MET   2           H        MET   2  15.041  -0.185  -1.578
   14    HA   MET   2           HA       MET   2  13.861  -1.372   0.814
   15    HB2  MET   2           1HB      MET   2  15.624  -0.974   2.427
   16    HB3  MET   2           2HB      MET   2  16.312  -1.903   1.119
   17    HG2  MET   2           1HG      MET   2  17.385   0.209   0.183
   18    HG3  MET   2           2HG      MET   2  16.804   1.098   1.607
   19    HE1  MET   2           1HE      MET   2  20.659   0.557   2.374
   20    HE2  MET   2           2HE      MET   2  19.919   0.842   0.771
   21    HE3  MET   2           3HE      MET   2  19.347   1.760   2.200
   22    H    ASN   3           H        ASN   3  12.462   0.037  -0.440
   23    HA   ASN   3           HA       ASN   3  11.923   2.472   1.060
   24    HB2  ASN   3           1HB      ASN   3  13.485   3.388  -0.783
   25    HB3  ASN   3           2HB      ASN   3  12.402   2.768  -2.008
   26   HD21  ASN   3          2HD2      ASN   3  10.868   4.209  -2.714
   27   HD22  ASN   3          1HD2      ASN   3  10.434   5.776  -1.864
   28    H    MET   4           H        MET   4  10.811   0.882  -2.032
   29    HA   MET   4           HA       MET   4   8.064   1.071  -1.205
   30    HB2  MET   4           1HB      MET   4   9.088  -0.991  -3.232
   31    HB3  MET   4           2HB      MET   4   7.505  -0.239  -3.148
   32    HG2  MET   4           2HG      MET   4   8.748   2.036  -3.681
   33    HG3  MET   4           1HG      MET   4  10.137   1.044  -4.065
   34    HE1  MET   4           1HE      MET   4  10.501  -0.135  -6.342
   35    HE2  MET   4           2HE      MET   4   9.177  -0.831  -7.323
   36    HE3  MET   4           3HE      MET   4   9.483  -1.449  -5.673
   37    H    LEU   5           H        LEU   5   9.381  -0.114   0.996
   38    HA   LEU   5           HA       LEU   5   8.783  -3.016   1.123
   39    HB2  LEU   5           1HB      LEU   5  10.169  -3.401   2.886
   40    HB3  LEU   5           2HB      LEU   5  10.986  -2.569   1.611
   41    HG   LEU   5           HG       LEU   5  10.325  -0.385   3.092
   42   HD11  LEU   5          1HD2      LEU   5  10.738  -2.565   5.252
   43   HD12  LEU   5          2HD2      LEU   5   9.182  -1.780   4.929
   44   HD13  LEU   5          3HD2      LEU   5  10.541  -0.805   5.523
   45   HD21  LEU   5          1HD1      LEU   5  12.649  -0.533   4.030
   46   HD22  LEU   5          2HD1      LEU   5  12.702  -2.271   3.549
   47   HD23  LEU   5          3HD1      LEU   5  12.532  -0.997   2.316
   48    H    LYS   6           H        LYS   6   8.497  -0.161   3.170
   49    HA   LYS   6           HA       LYS   6   5.902  -0.947   4.289
   50    HB2  LYS   6           2HB      LYS   6   7.845   0.227   5.578
   51    HB3  LYS   6           1HB      LYS   6   7.503   1.686   4.667
   52    HG2  LYS   6           1HG      LYS   6   5.155   1.733   5.665
   53    HG3  LYS   6           2HG      LYS   6   5.503   0.240   6.541
   54    HD2  LYS   6           1HD      LYS   6   7.387   1.407   7.775
   55    HD3  LYS   6           2HD      LYS   6   7.035   2.899   6.896
   56    HE2  LYS   6           1HE      LYS   6   4.697   2.941   7.901
   57    HE3  LYS   6           2HE      LYS   6   5.048   1.446   8.780
   58    HZ2  LYS   6           1HZ      LYS   6   6.544   3.992   9.085
   59    HZ3  LYS   6           2HZ      LYS   6   6.870   2.611   9.896
   60    H    GLU   7           H        GLU   7   7.054   1.417   1.911
   61    HA   GLU   7           HA       GLU   7   4.447   2.757   1.543
   62    HB2  GLU   7           2HB      GLU   7   6.909   2.660  -0.327
   63    HB3  GLU   7           1HB      GLU   7   5.461   3.579  -0.704
   64    HG2  GLU   7           2HG      GLU   7   5.732   5.011   1.312
   65    HG3  GLU   7           1HG      GLU   7   7.104   4.057   1.862
   66    HE2  GLU   7           HE2      GLU   7   5.967   5.794  -0.875
   67    H    ASN   8           H        ASN   8   5.860  -0.119  -0.137
   68    HA   ASN   8           HA       ASN   8   3.570  -0.336  -1.942
   69    HB2  ASN   8           2HB      ASN   8   5.732  -1.727  -2.175
   70    HB3  ASN   8           1HB      ASN   8   5.196  -2.690  -0.761
   71   HD21  ASN   8          1HD2      ASN   8   4.441  -1.827  -4.157
   72   HD22  ASN   8          2HD2      ASN   8   3.527  -3.378  -4.512
   73    H    VAL   9           H        VAL   9   4.137  -1.873   1.266
   74    HA   VAL   9           HA       VAL   9   1.578  -3.102   1.501
   75    HB   VAL   9           HB       VAL   9   4.117  -3.101   2.753
   76   HG11  VAL   9          1HG1      VAL   9   3.799  -2.912   5.186
   77   HG12  VAL   9          2HG1      VAL   9   2.101  -2.407   4.997
   78   HG13  VAL   9          3HG1      VAL   9   3.416  -1.341   4.461
   79   HG21  VAL   9          1HG2      VAL   9   3.340  -5.060   3.931
   80   HG22  VAL   9          2HG2      VAL   9   2.758  -5.029   2.254
   81   HG23  VAL   9          3HG2      VAL   9   1.627  -4.642   3.583
   82    H    ASP  10           H        ASP  10   1.962   0.198   1.379
   83    HA   ASP  10           HA       ASP  10  -0.084   1.016   3.317
   84    HB2  ASP  10           2HB      ASP  10   2.328   2.166   3.388
   85    HB3  ASP  10           1HB      ASP  10   1.793   2.874   1.881
   86    HD2  ASP  10           HD2      ASP  10   0.200   4.246   1.851
   87    H    TYR  11           H        TYR  11   1.212   0.947   0.022
   88    HA   TYR  11           HA       TYR  11  -0.894   2.382  -1.388
   89    HB2  TYR  11           2HB      TYR  11   1.600   1.813  -2.164
   90    HB3  TYR  11           1HB      TYR  11   0.902   0.326  -2.653
   91    HD1  TYR  11           HD2      TYR  11   0.555   4.030  -3.078
   92    HD2  TYR  11           HD1      TYR  11  -0.576   0.204  -4.645
   93    HE1  TYR  11           HE2      TYR  11  -0.239   5.116  -5.152
   94    HE2  TYR  11           HE1      TYR  11  -1.370   1.286  -6.719
   95    HH   TYR  11           HH       TYR  11  -1.649   3.202  -7.810
   96    H    ILE  12           H        ILE  12  -0.487  -1.058  -0.688
   97    HA   ILE  12           HA       ILE  12  -2.708  -1.968  -2.403
   98    HB   ILE  12           HB       ILE  12  -0.757  -3.423  -0.697
   99   HG12  ILE  12          2HG1      ILE  12  -0.588  -4.936  -2.747
  100   HG13  ILE  12          1HG1      ILE  12  -1.759  -3.923  -3.571
  101   HG21  ILE  12          1HG2      ILE  12  -1.945  -5.623  -0.959
  102   HG22  ILE  12          2HG2      ILE  12  -3.370  -4.770  -1.608
  103   HG23  ILE  12          3HG2      ILE  12  -2.843  -4.506   0.072
  104   HD11  ILE  12          1HD1      ILE  12   1.042  -3.021  -2.621
  105   HD12  ILE  12          2HD1      ILE  12   0.597  -3.471  -4.280
  106   HD13  ILE  12          3HD1      ILE  12  -0.098  -2.009  -3.552
  107    H    GLN  13           H        GLN  13  -2.091  -1.772   1.113
  108    HA   GLN  13           HA       GLN  13  -4.770  -2.025   1.993
  109    HB2  GLN  13           1HB      GLN  13  -2.620  -0.452   3.392
  110    HB3  GLN  13           2HB      GLN  13  -4.159  -0.868   4.039
  111    HG2  GLN  13           2HG      GLN  13  -3.720  -3.314   3.860
  112    HG3  GLN  13           1HG      GLN  13  -2.145  -3.001   3.153
  113   HE21  GLN  13          2HE2      GLN  13  -0.696  -3.580   4.716
  114   HE22  GLN  13          1HE2      GLN  13  -0.793  -3.096   6.483
  115    H    LYS  14           H        LYS  14  -3.188   0.894   0.644
  116    HA   LYS  14           HA       LYS  14  -5.358   2.716   1.362
  117    HB2  LYS  14           1HB      LYS  14  -3.123   3.572   0.883
  118    HB3  LYS  14           2HB      LYS  14  -3.200   2.992  -0.791
  119    HG2  LYS  14           2HG      LYS  14  -5.083   4.657  -1.217
  120    HG3  LYS  14           1HG      LYS  14  -4.989   5.161   0.466
  121    HD2  LYS  14           2HD      LYS  14  -3.821   6.809  -0.816
  122    HD3  LYS  14           1HD      LYS  14  -2.601   5.937   0.103
  123    HE2  LYS  14           1HE      LYS  14  -2.005   4.590  -1.986
  124    HE3  LYS  14           2HE      LYS  14  -3.264   5.440  -2.892
  125    HZ2  LYS  14           1HZ      LYS  14  -1.082   6.396  -3.220
  126    HZ3  LYS  14           2HZ      LYS  14  -0.888   6.687  -1.624
  127    H    ASN  15           H        ASN  15  -4.693   0.885  -1.626
  128    HA   ASN  15           HA       ASN  15  -6.732   1.840  -3.383
  129    HB2  ASN  15           2HB      ASN  15  -4.724   0.221  -3.860
  130    HB3  ASN  15           1HB      ASN  15  -5.840  -1.029  -3.263
  131   HD21  ASN  15          1HD2      ASN  15  -5.684  -2.024  -5.283
  132   HD22  ASN  15          2HD2      ASN  15  -6.554  -1.381  -6.769
  133    H    GLN  16           H        GLN  16  -6.782  -1.024  -1.403
  134    HA   GLN  16           HA       GLN  16  -9.502  -1.819  -1.872
  135    HB2  GLN  16           2HB      GLN  16  -8.924  -3.711  -0.682
  136    HB3  GLN  16           1HB      GLN  16  -7.424  -3.204  -1.395
  137    HG2  GLN  16           2HG      GLN  16  -6.777  -2.117   0.854
  138    HG3  GLN  16           1HG      GLN  16  -8.222  -2.800   1.572
  139   HE21  GLN  16          1HE2      GLN  16  -8.236  -5.044   2.033
  140   HE22  GLN  16          2HE2      GLN  16  -6.735  -6.085   1.858
  141    H    ASN  17           H        ASN  17  -8.204   0.211   0.695
  142    HA   ASN  17           HA       ASN  17 -10.555   0.098   2.399
  143    HB2  ASN  17           1HB      ASN  17  -8.288   0.636   3.270
  144    HB3  ASN  17           2HB      ASN  17  -8.265   2.149   2.393
  145   HD21  ASN  17          1HD2      ASN  17  -9.140   3.911   3.475
  146   HD22  ASN  17          2HD2      ASN  17 -10.021   3.794   5.080
  147    H    LEU  18           H        LEU  18  -9.624   2.512  -0.139
  148    HA   LEU  18           HA       LEU  18 -11.699   4.304   0.107
  149    HB2  LEU  18           1HB      LEU  18 -10.453   3.305  -2.496
  150    HB3  LEU  18           2HB      LEU  18 -11.313   4.821  -2.327
  151    HG   LEU  18           HG       LEU  18  -8.875   4.185  -0.575
  152   HD11  LEU  18          1HD2      LEU  18  -8.772   5.525  -3.332
  153   HD12  LEU  18          2HD2      LEU  18  -7.411   5.347  -2.179
  154   HD13  LEU  18          3HD2      LEU  18  -8.142   3.907  -2.912
  155   HD21  LEU  18          1HD1      LEU  18  -8.645   6.592  -0.314
  156   HD22  LEU  18          2HD1      LEU  18 -10.120   6.861  -1.305
  157   HD23  LEU  18          3HD1      LEU  18 -10.214   6.008   0.264
  158    H    PHE  19           H        PHE  19 -11.904   1.678  -2.319
  159    HA   PHE  19           HA       PHE  19 -14.819   1.800  -2.431
  160    HB2  PHE  19           2HB      PHE  19 -14.525   0.105  -4.228
  161    HB3  PHE  19           1HB      PHE  19 -13.703   1.626  -4.460
  162    HD1  PHE  19           HD2      PHE  19 -12.932  -1.916  -3.177
  163    HD2  PHE  19           HD1      PHE  19 -11.492   1.549  -5.295
  164    HE1  PHE  19           HE2      PHE  19 -10.927  -3.150  -3.855
  165    HE2  PHE  19           HE1      PHE  19  -9.508   0.281  -5.986
  166    HZ   PHE  19           HZ       PHE  19  -9.211  -2.063  -5.262
  167    H    LYS  20           H        LYS  20 -13.804   0.808   0.198
  168    HA   LYS  20           HA       LYS  20 -14.448  -1.999   0.422
  169    HB2  LYS  20           2HB      LYS  20 -12.866  -0.801   1.875
  170    HB3  LYS  20           1HB      LYS  20 -14.242   0.024   2.611
  171    HG2  LYS  20           1HG      LYS  20 -15.135  -2.206   3.418
  172    HG3  LYS  20           2HG      LYS  20 -13.788  -3.027   2.626
  173    HD2  LYS  20           2HD      LYS  20 -12.155  -1.766   4.101
  174    HD3  LYS  20           1HD      LYS  20 -13.506  -0.941   4.889
  175    HE2  LYS  20           1HE      LYS  20 -14.405  -3.182   5.695
  176    HE3  LYS  20           2HE      LYS  20 -13.054  -4.008   4.904
  177    HZ2  LYS  20           1HZ      LYS  20 -12.647  -3.624   7.241
  178    HZ3  LYS  20           2HZ      LYS  20 -12.833  -2.007   7.085
  Start of MODEL   10
    1    H1   LYS   1           H        LYS   1  17.437  -1.177  -1.138
    2    HA   LYS   1           HA       LYS   1  15.445   0.195  -2.702
    3    HB2  LYS   1           1HB      LYS   1  14.469  -1.811  -3.833
    4    HB3  LYS   1           2HB      LYS   1  15.867  -1.146  -4.625
    5    HG2  LYS   1           1HG      LYS   1  16.189  -3.591  -2.781
    6    HG3  LYS   1           2HG      LYS   1  15.506  -3.769  -4.389
    7    HD2  LYS   1           1HD      LYS   1  17.581  -2.741  -5.407
    8    HD3  LYS   1           2HD      LYS   1  18.296  -2.600  -3.800
    9    HE2  LYS   1           2HE      LYS   1  18.154  -5.119  -3.502
   10    HE3  LYS   1           1HE      LYS   1  17.444  -5.267  -5.117
   11    HZ2  LYS   1           1HZ      LYS   1  20.133  -4.176  -4.496
   12    HZ3  LYS   1           2HZ      LYS   1  19.818  -5.654  -5.118
   13    H    MET   2           H        MET   2  14.944   0.632  -0.604
   14    HA   MET   2           HA       MET   2  13.472  -1.429   0.884
   15    HB2  MET   2           1HB      MET   2  14.817  -1.529   2.884
   16    HB3  MET   2           2HB      MET   2  15.894  -1.836   1.544
   17    HG2  MET   2           1HG      MET   2  16.753   0.555   1.683
   18    HG3  MET   2           2HG      MET   2  15.748   0.806   3.125
   19    HE1  MET   2           1HE      MET   2  19.384   0.380   4.640
   20    HE2  MET   2           2HE      MET   2  17.938   1.429   4.551
   21    HE3  MET   2           3HE      MET   2  18.952   1.171   3.096
   22    H    ASN   3           H        ASN   3  12.193   0.235  -0.195
   23    HA   ASN   3           HA       ASN   3  11.039   1.987   1.845
   24    HB2  ASN   3           1HB      ASN   3  11.874   3.255  -0.866
   25    HB3  ASN   3           2HB      ASN   3  10.726   3.982   0.236
   26   HD21  ASN   3          1HD2      ASN   3  14.021   3.792  -0.520
   27   HD22  ASN   3          2HD2      ASN   3  14.634   4.694   0.956
   28    H    MET   4           H        MET   4  10.641   1.391  -1.741
   29    HA   MET   4           HA       MET   4   7.828   0.984  -1.391
   30    HB2  MET   4           2HB      MET   4   9.394  -0.187  -3.765
   31    HB3  MET   4           1HB      MET   4   7.719   0.337  -3.728
   32    HG2  MET   4           1HG      MET   4   8.661   2.771  -3.314
   33    HG3  MET   4           2HG      MET   4  10.226   2.092  -3.738
   34    HE1  MET   4           1HE      MET   4   8.796   4.482  -5.392
   35    HE2  MET   4           2HE      MET   4  10.405   3.813  -5.810
   36    HE3  MET   4           3HE      MET   4   9.145   3.971  -7.070
   37    H    LEU   5           H        LEU   5   9.434  -0.846   0.259
   38    HA   LEU   5           HA       LEU   5   8.595  -3.609  -0.492
   39    HB2  LEU   5           1HB      LEU   5  10.337  -2.533   1.791
   40    HB3  LEU   5           2HB      LEU   5   9.920  -4.229   1.596
   41    HG   LEU   5           HG       LEU   5  11.614  -2.502  -0.301
   42   HD11  LEU   5          1HD2      LEU   5  13.434  -3.952   0.525
   43   HD12  LEU   5          2HD2      LEU   5  12.272  -4.884   1.528
   44   HD13  LEU   5          3HD2      LEU   5  12.596  -3.169   1.891
   45   HD21  LEU   5          1HD1      LEU   5  10.433  -4.138  -1.752
   46   HD22  LEU   5          2HD1      LEU   5  12.129  -4.617  -1.575
   47   HD23  LEU   5          3HD1      LEU   5  10.861  -5.481  -0.660
   48    H    LYS   6           H        LYS   6   8.585  -1.951   2.645
   49    HA   LYS   6           HA       LYS   6   5.898  -2.845   3.308
   50    HB2  LYS   6           1HB      LYS   6   7.657  -0.723   4.705
   51    HB3  LYS   6           2HB      LYS   6   6.121  -1.252   5.352
   52    HG2  LYS   6           2HG      LYS   6   8.555  -3.098   4.929
   53    HG3  LYS   6           1HG      LYS   6   8.115  -2.308   6.434
   54    HD2  LYS   6           1HD      LYS   6   5.884  -3.566   6.439
   55    HD3  LYS   6           2HD      LYS   6   6.371  -4.379   4.961
   56    HE2  LYS   6           1HE      LYS   6   6.804  -5.932   6.726
   57    HE3  LYS   6           2HE      LYS   6   8.383  -5.384   6.172
   58    HZ2  LYS   6           1HZ      LYS   6   8.469  -3.882   8.070
   59    HZ3  LYS   6           2HZ      LYS   6   8.270  -5.431   8.554
   60    H    GLU   7           H        GLU   7   7.055   0.174   1.875
   61    HA   GLU   7           HA       GLU   7   4.448   1.565   2.178
   62    HB2  GLU   7           1HB      GLU   7   6.717   2.258   0.202
   63    HB3  GLU   7           2HB      GLU   7   5.283   3.226   0.432
   64    HG2  GLU   7           1HG      GLU   7   7.397   2.703   2.620
   65    HG3  GLU   7           2HG      GLU   7   7.297   4.131   1.611
   66    HE2  GLU   7           HE2      GLU   7   4.929   3.682   4.822
   67    H    ASN   8           H        ASN   8   5.794  -0.450  -0.522
   68    HA   ASN   8           HA       ASN   8   3.429  -0.008  -2.172
   69    HB2  ASN   8           2HB      ASN   8   5.512  -1.226  -3.007
   70    HB3  ASN   8           1HB      ASN   8   5.051  -2.638  -1.994
   71   HD21  ASN   8          2HD2      ASN   8   3.962  -4.168  -3.173
   72   HD22  ASN   8          1HD2      ASN   8   3.083  -3.874  -4.756
   73    H    VAL   9           H        VAL   9   4.065  -2.624   0.215
   74    HA   VAL   9           HA       VAL   9   1.488  -3.821   0.115
   75    HB   VAL   9           HB       VAL   9   4.073  -4.304   1.152
   76   HG11  VAL   9          1HG1      VAL   9   3.508  -3.253   3.406
   77   HG12  VAL   9          2HG1      VAL   9   3.888  -4.982   3.504
   78   HG13  VAL   9          3HG1      VAL   9   2.196  -4.434   3.607
   79   HG21  VAL   9          1HG2      VAL   9   1.577  -6.006   1.519
   80   HG22  VAL   9          2HG2      VAL   9   3.289  -6.542   1.602
   81   HG23  VAL   9          3HG2      VAL   9   2.631  -5.910   0.078
   82    H    ASP  10           H        ASP  10   1.867  -0.690   1.138
   83    HA   ASP  10           HA       ASP  10  -0.079  -0.639   3.324
   84    HB2  ASP  10           1HB      ASP  10   2.355   0.380   3.739
   85    HB3  ASP  10           2HB      ASP  10   1.795   1.605   2.623
   86    HD2  ASP  10           HD2      ASP  10   0.179   2.870   3.143
   87    H    TYR  11           H        TYR  11   1.185   0.579   0.240
   88    HA   TYR  11           HA       TYR  11  -0.917   2.420  -0.517
   89    HB2  TYR  11           2HB      TYR  11   1.544   2.117  -1.520
   90    HB3  TYR  11           1HB      TYR  11   0.780   0.939  -2.509
   91    HD1  TYR  11           HD1      TYR  11   0.612   4.548  -1.527
   92    HD2  TYR  11           HD2      TYR  11  -0.760   1.619  -4.347
   93    HE1  TYR  11           HE1      TYR  11  -0.209   6.350  -3.000
   94    HE2  TYR  11           HE2      TYR  11  -1.586   3.422  -5.816
   95    HH   TYR  11           HH       TYR  11  -1.832   5.615  -6.087
   96    H    ILE  12           H        ILE  12  -0.665  -1.059  -1.054
   97    HA   ILE  12           HA       ILE  12  -2.888  -1.214  -2.988
   98    HB   ILE  12           HB       ILE  12  -1.042  -3.255  -1.873
   99   HG12  ILE  12          1HG1      ILE  12  -0.942  -4.019  -4.306
  100   HG13  ILE  12          2HG1      ILE  12  -2.069  -2.746  -4.737
  101   HG21  ILE  12          1HG2      ILE  12  -3.718  -4.104  -3.133
  102   HG22  ILE  12          2HG2      ILE  12  -2.338  -5.189  -2.819
  103   HG23  ILE  12          3HG2      ILE  12  -3.180  -4.428  -1.467
  104   HD11  ILE  12          1HD1      ILE  12  -0.322  -1.011  -4.112
  105   HD12  ILE  12          2HD1      ILE  12   0.292  -2.171  -5.307
  106   HD13  ILE  12          3HD1      ILE  12   0.778  -2.326  -3.607
  107    H    GLN  13           H        GLN  13  -2.345  -2.233   0.394
  108    HA   GLN  13           HA       GLN  13  -5.045  -2.625   1.145
  109    HB2  GLN  13           1HB      GLN  13  -2.878  -1.639   2.982
  110    HB3  GLN  13           2HB      GLN  13  -4.419  -2.264   3.442
  111    HG2  GLN  13           1HG      GLN  13  -3.912  -4.504   2.390
  112    HG3  GLN  13           2HG      GLN  13  -2.306  -3.936   1.978
  113   HE21  GLN  13          1HE2      GLN  13  -4.235  -5.276   4.476
  114   HE22  GLN  13          2HE2      GLN  13  -2.948  -5.242   5.783
  115    H    LYS  14           H        LYS  14  -3.268   0.474   0.884
  116    HA   LYS  14           HA       LYS  14  -5.362   2.090   2.124
  117    HB2  LYS  14           1HB      LYS  14  -2.977   2.759   1.949
  118    HB3  LYS  14           2HB      LYS  14  -3.144   3.017   0.210
  119    HG2  LYS  14           2HG      LYS  14  -4.682   4.528   2.423
  120    HG3  LYS  14           1HG      LYS  14  -3.134   5.040   1.793
  121    HD2  LYS  14           1HD      LYS  14  -5.768   4.943   0.230
  122    HD3  LYS  14           2HD      LYS  14  -4.988   6.370   0.846
  123    HE2  LYS  14           1HE      LYS  14  -3.828   4.567  -1.391
  124    HE3  LYS  14           2HE      LYS  14  -4.716   6.064  -1.638
  125    HZ2  LYS  14           1HZ      LYS  14  -2.146   5.866  -0.174
  126    HZ3  LYS  14           2HZ      LYS  14  -2.987   7.247  -0.415
  127    H    ASN  15           H        ASN  15  -4.649   1.381  -1.298
  128    HA   ASN  15           HA       ASN  15  -6.564   2.997  -2.667
  129    HB2  ASN  15           2HB      ASN  15  -4.636   1.583  -3.667
  130    HB3  ASN  15           1HB      ASN  15  -5.775   0.222  -3.509
  131   HD21  ASN  15          1HD2      ASN  15  -5.564  -0.036  -5.774
  132   HD22  ASN  15          2HD2      ASN  15  -6.466   1.054  -6.946
  133    H    GLN  16           H        GLN  16  -6.817  -0.373  -1.812
  134    HA   GLN  16           HA       GLN  16  -9.542  -0.816  -2.592
  135    HB2  GLN  16           1HB      GLN  16  -9.093  -3.013  -2.129
  136    HB3  GLN  16           2HB      GLN  16  -7.520  -2.388  -2.506
  137    HG2  GLN  16           2HG      GLN  16  -7.033  -2.198   0.016
  138    HG3  GLN  16           1HG      GLN  16  -8.567  -2.975   0.352
  139   HE21  GLN  16          1HE2      GLN  16  -8.736  -5.232  -0.012
  140   HE22  GLN  16          2HE2      GLN  16  -7.276  -6.263  -0.429
  141    H    ASN  17           H        ASN  17  -8.287   0.218   0.521
  142    HA   ASN  17           HA       ASN  17 -10.702  -0.297   2.042
  143    HB2  ASN  17           1HB      ASN  17  -8.434  -0.124   3.072
  144    HB3  ASN  17           2HB      ASN  17  -8.360   1.584   2.700
  145   HD21  ASN  17          2HD2      ASN  17  -9.236   2.958   4.248
  146   HD22  ASN  17          1HD2      ASN  17 -10.149   2.379   5.731
  147    H    LEU  18           H        LEU  18  -9.626   2.694   0.304
  148    HA   LEU  18           HA       LEU  18 -11.545   4.493   1.091
  149    HB2  LEU  18           1HB      LEU  18 -10.513   4.142  -1.754
  150    HB3  LEU  18           2HB      LEU  18 -11.226   5.614  -1.128
  151    HG   LEU  18           HG       LEU  18  -8.765   4.351   0.193
  152   HD11  LEU  18          1HD2      LEU  18  -7.322   5.845  -1.173
  153   HD12  LEU  18          2HD2      LEU  18  -8.748   6.365  -2.120
  154   HD13  LEU  18          3HD2      LEU  18  -8.196   4.667  -2.171
  155   HD21  LEU  18          1HD1      LEU  18  -8.299   6.579   1.071
  156   HD22  LEU  18          2HD1      LEU  18  -9.802   7.211   0.316
  157   HD23  LEU  18          3HD1      LEU  18  -9.876   5.972   1.604
  158    H    PHE  19           H        PHE  19 -12.040   2.653  -1.938
  159    HA   PHE  19           HA       PHE  19 -14.877   3.122  -2.032
  160    HB2  PHE  19           1HB      PHE  19 -14.836   1.646  -4.018
  161    HB3  PHE  19           2HB      PHE  19 -13.804   3.054  -4.071
  162    HD1  PHE  19           HD2      PHE  19 -13.810  -0.687  -3.945
  163    HD2  PHE  19           HD1      PHE  19 -11.345   2.824  -4.284
  164    HE1  PHE  19           HE2      PHE  19 -11.967  -2.054  -4.833
  165    HE2  PHE  19           HE1      PHE  19  -9.530   1.447  -5.206
  166    HZ   PHE  19           HZ       PHE  19  -9.832  -0.989  -5.482
  167    H    LYS  20           H        LYS  20 -13.233  -0.021  -1.592
  168    HA   LYS  20           HA       LYS  20 -15.688  -1.245  -0.513
  169    HB2  LYS  20           1HB      LYS  20 -14.137  -2.370  -2.117
  170    HB3  LYS  20           2HB      LYS  20 -13.011  -2.554  -0.776
  171    HG2  LYS  20           1HG      LYS  20 -15.884  -3.687  -0.832
  172    HG3  LYS  20           2HG      LYS  20 -14.476  -4.553  -1.422
  173    HD2  LYS  20           2HD      LYS  20 -13.434  -4.435   0.904
  174    HD3  LYS  20           1HD      LYS  20 -14.922  -3.688   1.499
  175    HE2  LYS  20           1HE      LYS  20 -16.250  -5.727   0.773
  176    HE3  LYS  20           2HE      LYS  20 -14.762  -6.485   0.186
  177    HZ2  LYS  20           1HZ      LYS  20 -15.344  -7.207   2.404
  178    HZ3  LYS  20           2HZ      LYS  20 -15.311  -5.681   2.989
  Start of MODEL   11
    1    H1   LYS   1           H        LYS   1  16.329  -3.310   0.201
    2    HA   LYS   1           HA       LYS   1  14.868  -1.151   1.425
    3    HB2  LYS   1           2HB      LYS   1  14.621   0.249  -0.749
    4    HB3  LYS   1           1HB      LYS   1  15.973   0.520   0.320
    5    HG2  LYS   1           1HG      LYS   1  16.815   0.768  -1.851
    6    HG3  LYS   1           2HG      LYS   1  17.533  -0.693  -1.204
    7    HD2  LYS   1           2HD      LYS   1  15.997  -2.103  -2.567
    8    HD3  LYS   1           1HD      LYS   1  15.146  -0.686  -3.173
    9    HE2  LYS   1           2HE      LYS   1  18.148  -1.299  -3.666
   10    HE3  LYS   1           1HE      LYS   1  16.846  -1.734  -4.769
   11    HZ2  LYS   1           1HZ      LYS   1  16.312   0.589  -5.048
   12    HZ3  LYS   1           2HZ      LYS   1  17.870   0.296  -5.449
   13    H    MET   2           H        MET   2  13.803  -3.147   1.711
   14    HA   MET   2           HA       MET   2  11.977  -3.858  -0.514
   15    HB2  MET   2           2HB      MET   2  12.552  -6.197  -0.552
   16    HB3  MET   2           1HB      MET   2  14.034  -5.305  -0.780
   17    HG2  MET   2           1HG      MET   2  13.271  -6.584   1.927
   18    HG3  MET   2           2HG      MET   2  14.252  -7.355   0.673
   19    HE1  MET   2           1HE      MET   2  16.202  -7.703   2.486
   20    HE2  MET   2           2HE      MET   2  16.922  -6.358   3.419
   21    HE3  MET   2           3HE      MET   2  15.231  -6.851   3.728
   22    H    ASN   3           H        ASN   3  11.123  -2.377   1.217
   23    HA   ASN   3           HA       ASN   3   9.131  -3.961   2.700
   24    HB2  ASN   3           2HB      ASN   3   9.223  -2.757   4.822
   25    HB3  ASN   3           1HB      ASN   3  10.721  -3.583   4.518
   26   HD21  ASN   3          1HD2      ASN   3   9.374  -0.601   5.375
   27   HD22  ASN   3          2HD2      ASN   3  10.918   0.384   5.269
   28    H    MET   4           H        MET   4   9.934  -0.450   2.137
   29    HA   MET   4           HA       MET   4   7.179   0.110   1.569
   30    HB2  MET   4           2HB      MET   4   9.483   1.877   0.567
   31    HB3  MET   4           1HB      MET   4   7.852   2.363   0.993
   32    HG2  MET   4           1HG      MET   4   8.463   1.640   3.463
   33    HG3  MET   4           2HG      MET   4  10.121   1.563   2.882
   34    HE1  MET   4           1HE      MET   4  10.023   5.024   4.825
   35    HE2  MET   4           2HE      MET   4   9.139   3.529   5.251
   36    HE3  MET   4           3HE      MET   4  10.835   3.437   4.682
   37    H    LEU   5           H        LEU   5   8.267  -1.971  -0.186
   38    HA   LEU   5           HA       LEU   5   7.913  -0.992  -2.979
   39    HB2  LEU   5           2HB      LEU   5   8.796  -3.698  -1.841
   40    HB3  LEU   5           1HB      LEU   5   8.585  -3.380  -3.556
   41    HG   LEU   5           HG       LEU   5  10.642  -2.103  -1.665
   42   HD11  LEU   5          1HD1      LEU   5  10.949  -4.487  -2.335
   43   HD12  LEU   5          2HD1      LEU   5  10.891  -4.019  -4.054
   44   HD13  LEU   5          3HD1      LEU   5  12.226  -3.437  -3.004
   45   HD21  LEU   5          1HD2      LEU   5  10.260  -1.506  -4.676
   46   HD22  LEU   5          2HD2      LEU   5  10.084  -0.347  -3.334
   47   HD23  LEU   5          3HD2      LEU   5  11.677  -1.029  -3.699
   48    H    LYS   6           H        LYS   6   6.825  -3.966  -1.373
   49    HA   LYS   6           HA       LYS   6   4.163  -3.846  -2.516
   50    HB2  LYS   6           2HB      LYS   6   5.158  -5.582  -0.157
   51    HB3  LYS   6           1HB      LYS   6   3.573  -5.753  -0.899
   52    HG2  LYS   6           1HG      LYS   6   4.629  -6.309  -3.119
   53    HG3  LYS   6           2HG      LYS   6   6.232  -6.159  -2.398
   54    HD2  LYS   6           1HD      LYS   6   5.651  -8.030  -0.754
   55    HD3  LYS   6           2HD      LYS   6   4.067  -8.162  -1.500
   56    HE2  LYS   6           1HE      LYS   6   5.379  -9.943  -2.422
   57    HE3  LYS   6           2HE      LYS   6   5.169  -8.777  -3.725
   58    HZ2  LYS   6           1HZ      LYS   6   7.403  -7.953  -3.275
   59    HZ3  LYS   6           2HZ      LYS   6   7.422  -9.553  -3.614
   60    H    GLU   7           H        GLU   7   5.395  -2.684   0.590
   61    HA   GLU   7           HA       GLU   7   2.708  -2.074   1.705
   62    HB2  GLU   7           1HB      GLU   7   5.434  -0.883   2.555
   63    HB3  GLU   7           2HB      GLU   7   3.916  -0.566   3.374
   64    HG2  GLU   7           1HG      GLU   7   3.659  -3.000   3.963
   65    HG3  GLU   7           2HG      GLU   7   5.165  -3.376   3.132
   66    HE2  GLU   7           HE2      GLU   7   5.144  -1.620   6.769
   67    H    ASN   8           H        ASN   8   5.037  -0.050  -0.204
   68    HA   ASN   8           HA       ASN   8   3.293   2.280  -0.093
   69    HB2  ASN   8           1HB      ASN   8   5.624   2.361  -1.099
   70    HB3  ASN   8           2HB      ASN   8   5.026   1.422  -2.509
   71   HD21  ASN   8          2HD2      ASN   8   4.559   2.756  -4.214
   72   HD22  ASN   8          1HD2      ASN   8   4.159   4.543  -4.101
   73    H    VAL   9           H        VAL   9   3.379  -0.333  -2.563
   74    HA   VAL   9           HA       VAL   9   1.081   0.488  -4.018
   75    HB   VAL   9           HB       VAL   9   3.247  -1.323  -4.209
   76   HG11  VAL   9          1HG2      VAL   9   2.391  -3.530  -4.862
   77   HG12  VAL   9          2HG2      VAL   9   0.709  -3.070  -4.494
   78   HG13  VAL   9          3HG2      VAL   9   1.898  -3.234  -3.185
   79   HG21  VAL   9          1HG1      VAL   9   2.570  -1.616  -6.509
   80   HG22  VAL   9          2HG1      VAL   9   2.369   0.066  -5.977
   81   HG23  VAL   9          3HG1      VAL   9   0.929  -0.978  -6.153
   82    H    ASP  10           H        ASP  10   0.792  -0.387  -0.838
   83    HA   ASP  10           HA       ASP  10  -1.720  -1.872  -0.958
   84    HB2  ASP  10           2HB      ASP  10   0.360  -2.962   0.329
   85    HB3  ASP  10           1HB      ASP  10   0.023  -1.684   1.476
   86    HD2  ASP  10           HD2      ASP  10  -1.222  -4.386  -0.114
   87    H    TYR  11           H        TYR  11   0.324   0.749   0.267
   88    HA   TYR  11           HA       TYR  11  -1.552   2.212   1.912
   89    HB2  TYR  11           2HB      TYR  11   1.090   2.386   1.806
   90    HB3  TYR  11           1HB      TYR  11   0.788   3.447   0.489
   91    HD1  TYR  11           HD2      TYR  11  -0.007   2.935   4.114
   92    HD2  TYR  11           HD1      TYR  11  -0.055   5.743   0.872
   93    HE1  TYR  11           HE2      TYR  11  -0.405   4.774   5.714
   94    HE2  TYR  11           HE1      TYR  11  -0.449   7.582   2.470
   95    HH   TYR  11           HH       TYR  11  -0.749   8.145   4.597
   96    H    ILE  12           H        ILE  12  -0.931   2.456  -1.564
   97    HA   ILE  12           HA       ILE  12  -2.410   4.974  -1.932
   98    HB   ILE  12           HB       ILE  12  -0.982   3.182  -3.828
   99   HG12  ILE  12          1HG1      ILE  12  -0.011   5.426  -4.659
  100   HG13  ILE  12          2HG1      ILE  12  -0.913   6.239  -3.396
  101   HG21  ILE  12          1HG2      ILE  12  -2.972   5.294  -4.848
  102   HG22  ILE  12          2HG2      ILE  12  -3.076   3.534  -5.097
  103   HG23  ILE  12          3HG2      ILE  12  -1.766   4.445  -5.851
  104   HD11  ILE  12          1HD1      ILE  12   1.487   5.937  -2.807
  105   HD12  ILE  12          2HD1      ILE  12   0.499   5.023  -1.653
  106   HD13  ILE  12          3HD1      ILE  12   1.351   4.177  -2.978
  107    H    GLN  13           H        GLN  13  -2.996   1.534  -2.744
  108    HA   GLN  13           HA       GLN  13  -5.784   1.904  -3.326
  109    HB2  GLN  13           1HB      GLN  13  -6.065  -0.458  -3.242
  110    HB3  GLN  13           2HB      GLN  13  -4.663  -0.081  -4.186
  111    HG2  GLN  13           1HG      GLN  13  -3.213  -0.722  -2.189
  112    HG3  GLN  13           2HG      GLN  13  -4.644  -1.145  -1.268
  113   HE21  GLN  13          2HE2      GLN  13  -5.904  -3.005  -1.991
  114   HE22  GLN  13          1HE2      GLN  13  -5.107  -4.289  -3.030
  115    H    LYS  14           H        LYS  14  -4.103   1.529  -0.188
  116    HA   LYS  14           HA       LYS  14  -6.540   1.032   1.346
  117    HB2  LYS  14           1HB      LYS  14  -4.337   0.397   2.196
  118    HB3  LYS  14           2HB      LYS  14  -3.825   2.093   2.274
  119    HG2  LYS  14           1HG      LYS  14  -5.512   2.514   4.081
  120    HG3  LYS  14           2HG      LYS  14  -6.137   0.877   3.905
  121    HD2  LYS  14           1HD      LYS  14  -4.745   0.898   5.856
  122    HD3  LYS  14           2HD      LYS  14  -3.913  -0.067   4.643
  123    HE2  LYS  14           2HE      LYS  14  -2.384   1.910   4.128
  124    HE3  LYS  14           1HE      LYS  14  -3.251   2.892   5.317
  125    HZ2  LYS  14           1HZ      LYS  14  -2.595   1.275   7.016
  126    HZ3  LYS  14           2HZ      LYS  14  -1.792   0.375   5.912
  127    H    ASN  15           H        ASN  15  -4.811   4.066   0.579
  128    HA   ASN  15           HA       ASN  15  -6.238   5.954   2.191
  129    HB2  ASN  15           1HB      ASN  15  -4.098   6.308   0.742
  130    HB3  ASN  15           2HB      ASN  15  -5.259   6.531  -0.590
  131   HD21  ASN  15          1HD2      ASN  15  -4.337   8.624  -0.829
  132   HD22  ASN  15          2HD2      ASN  15  -4.808   9.998   0.294
  133    H    GLN  16           H        GLN  16  -6.743   5.167  -1.170
  134    HA   GLN  16           HA       GLN  16  -9.255   6.583  -1.494
  135    HB2  GLN  16           2HB      GLN  16  -8.889   6.202  -3.761
  136    HB3  GLN  16           1HB      GLN  16  -7.289   6.328  -3.097
  137    HG2  GLN  16           2HG      GLN  16  -7.176   3.732  -3.076
  138    HG3  GLN  16           1HG      GLN  16  -8.698   3.700  -3.938
  139   HE21  GLN  16          2HE2      GLN  16  -8.703   4.315  -6.155
  140   HE22  GLN  16          1HE2      GLN  16  -7.143   4.559  -7.089
  141    H    ASN  17           H        ASN  17  -8.669   3.276  -0.534
  142    HA   ASN  17           HA       ASN  17 -11.512   2.655  -0.422
  143    HB2  ASN  17           1HB      ASN  17  -9.840   0.896  -2.320
  144    HB3  ASN  17           2HB      ASN  17 -11.371   0.417  -1.627
  145   HD21  ASN  17          2HD2      ASN  17 -10.143   1.522  -4.404
  146   HD22  ASN  17          1HD2      ASN  17 -11.634   2.363  -5.063
  147    H    LEU  18           H        LEU  18 -10.127   2.861   1.869
  148    HA   LEU  18           HA       LEU  18  -8.644   1.237   3.061
  149    HB2  LEU  18           1HB      LEU  18 -11.450   1.830   4.137
  150    HB3  LEU  18           2HB      LEU  18 -10.115   1.353   5.155
  151    HG   LEU  18           HG       LEU  18  -9.808   3.822   3.349
  152   HD11  LEU  18          1HD2      LEU  18 -11.149   3.856   6.104
  153   HD12  LEU  18          2HD2      LEU  18 -10.676   5.280   5.125
  154   HD13  LEU  18          3HD2      LEU  18 -11.933   4.176   4.531
  155   HD21  LEU  18          1HD1      LEU  18  -8.537   3.157   6.060
  156   HD22  LEU  18          2HD1      LEU  18  -7.770   2.933   4.469
  157   HD23  LEU  18          3HD1      LEU  18  -8.190   4.568   5.011
  158    H    PHE  19           H        PHE  19 -11.849  -0.034   2.306
  159    HA   PHE  19           HA       PHE  19 -11.661  -2.591   3.590
  160    HB2  PHE  19           1HB      PHE  19 -13.614  -3.182   2.144
  161    HB3  PHE  19           2HB      PHE  19 -13.833  -1.753   3.117
  162    HD1  PHE  19           HD2      PHE  19 -13.883   0.558   1.977
  163    HD2  PHE  19           HD1      PHE  19 -13.599  -3.054  -0.345
  164    HE1  PHE  19           HE2      PHE  19 -14.571   1.784  -0.036
  165    HE2  PHE  19           HE1      PHE  19 -14.293  -1.808  -2.350
  166    HZ   PHE  19           HZ       PHE  19 -14.784   0.609  -2.199
  167    H    LYS  20           H        LYS  20 -11.020  -1.748   0.191
  168    HA   LYS  20           HA       LYS  20 -10.111  -4.411  -0.577
  169    HB2  LYS  20           1HB      LYS  20 -11.263  -2.872  -2.105
  170    HB3  LYS  20           2HB      LYS  20  -9.852  -1.812  -2.040
  171    HG2  LYS  20           1HG      LYS  20  -8.442  -3.642  -3.086
  172    HG3  LYS  20           2HG      LYS  20  -9.853  -4.704  -3.110
  173    HD2  LYS  20           2HD      LYS  20 -11.054  -3.064  -4.627
  174    HD3  LYS  20           1HD      LYS  20  -9.644  -1.999  -4.592
  175    HE2  LYS  20           1HE      LYS  20  -8.231  -3.837  -5.647
  176    HE3  LYS  20           2HE      LYS  20  -9.647  -4.898  -5.687
  177    HZ2  LYS  20           1HZ      LYS  20 -10.755  -3.252  -7.097
  178    HZ3  LYS  20           2HZ      LYS  20  -9.445  -2.275  -7.062
  Start of MODEL   12
    1    H1   LYS   1           H        LYS   1  17.472  -1.067  -0.725
    2    HA   LYS   1           HA       LYS   1  15.673   1.152  -0.494
    3    HB2  LYS   1           2HB      LYS   1  15.130   1.494  -2.898
    4    HB3  LYS   1           1HB      LYS   1  16.642   2.216  -2.432
    5    HG2  LYS   1           2HG      LYS   1  16.662  -0.554  -3.767
    6    HG3  LYS   1           1HG      LYS   1  16.335   0.874  -4.735
    7    HD2  LYS   1           2HD      LYS   1  18.513   1.903  -4.010
    8    HD3  LYS   1           1HD      LYS   1  18.901   0.484  -3.057
    9    HE2  LYS   1           1HE      LYS   1  18.453   0.456  -6.122
   10    HE3  LYS   1           2HE      LYS   1  20.024   0.597  -5.339
   11    HZ2  LYS   1           1HZ      LYS   1  19.541  -1.662  -5.985
   12    HZ3  LYS   1           2HZ      LYS   1  18.186  -1.713  -5.072
   13    H    MET   2           H        MET   2  15.381  -0.957   0.710
   14    HA   MET   2           HA       MET   2  13.353  -2.651  -0.693
   15    HB2  MET   2           1HB      MET   2  15.927  -3.514   0.826
   16    HB3  MET   2           2HB      MET   2  14.592  -4.632   0.593
   17    HG2  MET   2           2HG      MET   2  16.202  -3.324  -1.661
   18    HG3  MET   2           1HG      MET   2  16.392  -4.971  -1.050
   19    HE1  MET   2           1HE      MET   2  15.765  -4.077  -4.159
   20    HE2  MET   2           2HE      MET   2  16.056  -5.776  -3.669
   21    HE3  MET   2           3HE      MET   2  14.607  -5.356  -4.630
   22    H    ASN   3           H        ASN   3  12.517  -0.720   0.692
   23    HA   ASN   3           HA       ASN   3  11.245  -1.951   3.095
   24    HB2  ASN   3           1HB      ASN   3  12.284   0.976   3.049
   25    HB3  ASN   3           2HB      ASN   3  11.204   0.343   4.271
   26   HD21  ASN   3          2HD2      ASN   3  14.490   0.647   3.395
   27   HD22  ASN   3          1HD2      ASN   3  15.165  -0.336   4.789
   28    H    MET   4           H        MET   4  10.884   0.990   0.986
   29    HA   MET   4           HA       MET   4   8.028   0.761   1.041
   30    HB2  MET   4           2HB      MET   4   9.560   2.162  -1.215
   31    HB3  MET   4           1HB      MET   4   7.955   2.517  -0.601
   32    HG2  MET   4           1HG      MET   4   9.153   3.188   1.662
   33    HG3  MET   4           2HG      MET   4  10.646   3.109   0.736
   34    HE1  MET   4           1HE      MET   4  11.089   5.718   1.294
   35    HE2  MET   4           2HE      MET   4   9.543   5.790   2.197
   36    HE3  MET   4           3HE      MET   4   9.905   7.013   0.944
   37    H    LEU   5           H        LEU   5   8.897  -1.830   0.334
   38    HA   LEU   5           HA       LEU   5   8.393  -2.315  -2.551
   39    HB2  LEU   5           1HB      LEU   5   9.393  -4.349  -2.598
   40    HB3  LEU   5           2HB      LEU   5  10.433  -3.147  -1.915
   41    HG   LEU   5           HG       LEU   5   9.501  -4.095   0.420
   42   HD11  LEU   5          1HD2      LEU   5   9.130  -6.550   0.413
   43   HD12  LEU   5          2HD2      LEU   5   9.348  -6.630  -1.361
   44   HD13  LEU   5          3HD2      LEU   5   7.926  -5.835  -0.674
   45   HD21  LEU   5          1HD1      LEU   5  11.836  -4.002  -0.347
   46   HD22  LEU   5          2HD1      LEU   5  11.627  -5.464  -1.334
   47   HD23  LEU   5          3HD1      LEU   5  11.541  -5.559   0.465
   48    H    LYS   6           H        LYS   6   7.601  -3.736   0.579
   49    HA   LYS   6           HA       LYS   6   4.859  -4.444  -0.198
   50    HB2  LYS   6           1HB      LYS   6   6.413  -5.897   1.295
   51    HB3  LYS   6           2HB      LYS   6   6.295  -4.681   2.539
   52    HG2  LYS   6           2HG      LYS   6   4.836  -6.538   3.090
   53    HG3  LYS   6           1HG      LYS   6   3.866  -5.110   2.816
   54    HD2  LYS   6           2HD      LYS   6   2.714  -6.991   1.899
   55    HD3  LYS   6           1HD      LYS   6   3.159  -5.974   0.555
   56    HE2  LYS   6           2HE      LYS   6   4.778  -8.493   1.382
   57    HE3  LYS   6           1HE      LYS   6   3.390  -8.559   0.301
   58    HZ2  LYS   6           1HZ      LYS   6   5.869  -7.028  -0.215
   59    HZ3  LYS   6           2HZ      LYS   6   5.449  -8.448  -0.908
   60    H    GLU   7           H        GLU   7   6.390  -1.948   1.797
   61    HA   GLU   7           HA       GLU   7   3.872  -0.848   2.880
   62    HB2  GLU   7           2HB      GLU   7   6.572   0.625   2.545
   63    HB3  GLU   7           1HB      GLU   7   5.202   1.238   3.451
   64    HG2  GLU   7           2HG      GLU   7   5.381  -0.640   5.104
   65    HG3  GLU   7           1HG      GLU   7   6.704  -1.356   4.190
   66    HE2  GLU   7           HE2      GLU   7   7.295   1.861   6.551
   67    H    ASN   8           H        ASN   8   5.702  -0.022  -0.129
   68    HA   ASN   8           HA       ASN   8   3.852   2.127  -0.833
   69    HB2  ASN   8           2HB      ASN   8   6.056   1.673  -2.072
   70    HB3  ASN   8           1HB      ASN   8   5.293   0.226  -2.808
   71   HD21  ASN   8          2HD2      ASN   8   4.494   0.659  -4.829
   72   HD22  ASN   8          1HD2      ASN   8   4.067   2.321  -5.480
   73    H    VAL   9           H        VAL   9   3.792  -1.353  -1.746
   74    HA   VAL   9           HA       VAL   9   1.292  -1.296  -3.113
   75    HB   VAL   9           HB       VAL   9   3.512  -3.009  -2.693
   76   HG11  VAL   9          1HG1      VAL   9   2.688  -5.249  -2.124
   77   HG12  VAL   9          2HG1      VAL   9   2.367  -4.185  -0.742
   78   HG13  VAL   9          3HG1      VAL   9   1.037  -4.648  -1.825
   79   HG21  VAL   9          1HG2      VAL   9   2.397  -2.598  -4.788
   80   HG22  VAL   9          2HG2      VAL   9   2.599  -4.337  -4.492
   81   HG23  VAL   9          3HG2      VAL   9   0.986  -3.575  -4.291
   82    H    ASP  10           H        ASP  10   1.571  -0.665   0.148
   83    HA   ASP  10           HA       ASP  10  -0.866  -1.974   1.126
   84    HB2  ASP  10           1HB      ASP  10   1.432  -2.309   2.449
   85    HB3  ASP  10           2HB      ASP  10   1.203  -0.620   2.837
   86    HD2  ASP  10           HD2      ASP  10  -1.287  -1.092   5.161
   87    H    TYR  11           H        TYR  11   1.073   0.929   0.550
   88    HA   TYR  11           HA       TYR  11  -0.717   2.975   1.598
   89    HB2  TYR  11           2HB      TYR  11   1.877   3.138   1.062
   90    HB3  TYR  11           1HB      TYR  11   1.347   3.419  -0.546
   91    HD1  TYR  11           HD1      TYR  11   1.000   4.713   2.945
   92    HD2  TYR  11           HD2      TYR  11   0.287   5.574  -1.193
   93    HE1  TYR  11           HE1      TYR  11   0.608   7.088   3.508
   94    HE2  TYR  11           HE2      TYR  11  -0.107   7.947  -0.634
   95    HH   TYR  11           HH       TYR  11   0.087   9.103   2.736
   96    H    ILE  12           H        ILE  12  -0.389   1.589  -1.646
   97    HA   ILE  12           HA       ILE  12  -2.241   3.495  -2.921
   98    HB   ILE  12           HB       ILE  12  -0.639   1.226  -4.003
   99   HG12  ILE  12          1HG1      ILE  12  -0.041   2.973  -5.809
  100   HG13  ILE  12          2HG1      ILE  12  -0.962   4.158  -4.904
  101   HG21  ILE  12          1HG2      ILE  12  -2.828   0.771  -5.063
  102   HG22  ILE  12          2HG2      ILE  12  -2.955   2.464  -5.603
  103   HG23  ILE  12          3HG2      ILE  12  -1.697   1.389  -6.271
  104   HD11  ILE  12          1HD1      ILE  12   1.564   2.679  -3.898
  105   HD12  ILE  12          2HD1      ILE  12   1.508   4.336  -4.533
  106   HD13  ILE  12          3HD1      ILE  12   0.705   3.961  -2.997
  107    H    GLN  13           H        GLN  13  -2.302   0.005  -2.108
  108    HA   GLN  13           HA       GLN  13  -5.099  -0.370  -2.377
  109    HB2  GLN  13           1HB      GLN  13  -3.327  -1.835  -0.431
  110    HB3  GLN  13           2HB      GLN  13  -4.955  -2.237  -0.823
  111    HG2  GLN  13           1HG      GLN  13  -4.382  -2.585  -3.254
  112    HG3  GLN  13           2HG      GLN  13  -2.700  -2.251  -2.901
  113   HE21  GLN  13          2HE2      GLN  13  -5.202  -4.638  -2.739
  114   HE22  GLN  13          1HE2      GLN  13  -4.158  -5.979  -2.047
  115    H    LYS  14           H        LYS  14  -3.345   1.178   0.335
  116    HA   LYS  14           HA       LYS  14  -5.575   1.238   2.187
  117    HB2  LYS  14           1HB      LYS  14  -3.362   1.567   3.024
  118    HB3  LYS  14           2HB      LYS  14  -3.120   3.022   2.043
  119    HG2  LYS  14           2HG      LYS  14  -4.863   4.221   3.411
  120    HG3  LYS  14           1HG      LYS  14  -5.179   2.748   4.312
  121    HD2  LYS  14           2HD      LYS  14  -3.801   4.117   5.699
  122    HD3  LYS  14           1HD      LYS  14  -2.801   2.762   5.189
  123    HE2  LYS  14           2HE      LYS  14  -1.681   4.249   3.447
  124    HE3  LYS  14           1HE      LYS  14  -2.727   5.595   3.917
  125    HZ2  LYS  14           1HZ      LYS  14  -0.574   5.691   4.980
  126    HZ3  LYS  14           2HZ      LYS  14  -0.766   4.221   5.669
  127    H    ASN  15           H        ASN  15  -4.372   3.727  -0.011
  128    HA   ASN  15           HA       ASN  15  -6.166   5.897   0.360
  129    HB2  ASN  15           2HB      ASN  15  -3.899   5.709  -0.888
  130    HB3  ASN  15           1HB      ASN  15  -4.857   5.084  -2.218
  131   HD21  ASN  15          1HD2      ASN  15  -4.049   6.850  -3.453
  132   HD22  ASN  15          2HD2      ASN  15  -4.732   8.543  -3.257
  133    H    GLN  16           H        GLN  16  -6.342   3.279  -1.991
  134    HA   GLN  16           HA       GLN  16  -8.486   4.051  -3.669
  135    HB2  GLN  16           1HB      GLN  16  -6.746   2.482  -4.196
  136    HB3  GLN  16           2HB      GLN  16  -7.007   1.513  -2.757
  137    HG2  GLN  16           1HG      GLN  16  -7.689   0.254  -4.536
  138    HG3  GLN  16           2HG      GLN  16  -9.105   0.662  -3.569
  139   HE21  GLN  16          1HE2      GLN  16  -7.506   1.180  -6.680
  140   HE22  GLN  16          2HE2      GLN  16  -8.969   1.899  -7.522
  141    H    ASN  17           H        ASN  17  -8.601   2.198  -0.667
  142    HA   ASN  17           HA       ASN  17 -10.619   2.821   0.808
  143    HB2  ASN  17           1HB      ASN  17 -12.299   3.350  -0.858
  144    HB3  ASN  17           2HB      ASN  17 -12.366   1.691  -1.422
  145   HD21  ASN  17          1HD2      ASN  17 -13.953   0.472  -0.441
  146   HD22  ASN  17          2HD2      ASN  17 -14.830   0.940   1.101
  147    H    LEU  18           H        LEU  18  -8.995   1.025   1.872
  148    HA   LEU  18           HA       LEU  18  -9.019  -1.552   1.432
  149    HB2  LEU  18           1HB      LEU  18  -9.417  -0.303   4.212
  150    HB3  LEU  18           2HB      LEU  18  -8.794  -1.923   3.979
  151    HG   LEU  18           HG       LEU  18  -7.447   0.483   2.668
  152   HD11  LEU  18          1HD2      LEU  18  -5.859   0.566   4.580
  153   HD12  LEU  18          2HD2      LEU  18  -6.878  -0.603   5.474
  154   HD13  LEU  18          3HD2      LEU  18  -7.518   1.008   5.036
  155   HD21  LEU  18          1HD1      LEU  18  -6.774  -1.675   1.712
  156   HD22  LEU  18          2HD1      LEU  18  -5.426  -1.003   2.643
  157   HD23  LEU  18          3HD1      LEU  18  -6.405  -2.333   3.330
  158    H    PHE  19           H        PHE  19 -11.844  -0.186   3.073
  159    HA   PHE  19           HA       PHE  19 -13.148  -2.588   3.830
  160    HB2  PHE  19           2HB      PHE  19 -14.593  -0.033   3.204
  161    HB3  PHE  19           1HB      PHE  19 -15.038  -1.266   4.355
  162    HD1  PHE  19           HD2      PHE  19 -13.368  -1.680   6.396
  163    HD2  PHE  19           HD1      PHE  19 -13.360   1.907   4.020
  164    HE1  PHE  19           HE2      PHE  19 -12.282  -0.452   8.235
  165    HE2  PHE  19           HE1      PHE  19 -12.278   3.116   5.866
  166    HZ   PHE  19           HZ       PHE  19 -11.736   1.944   7.974
  167    H    LYS  20           H        LYS  20 -15.707  -2.893   2.979
  168    HA   LYS  20           HA       LYS  20 -15.460  -4.028   0.314
  169    HB2  LYS  20           2HB      LYS  20 -16.622  -5.147   2.174
  170    HB3  LYS  20           1HB      LYS  20 -17.873  -3.905   2.068
  171    HG2  LYS  20           1HG      LYS  20 -18.383  -4.654  -0.308
  172    HG3  LYS  20           2HG      LYS  20 -17.112  -5.871  -0.185
  173    HD2  LYS  20           2HD      LYS  20 -18.342  -6.952   1.747
  174    HD3  LYS  20           1HD      LYS  20 -19.626  -5.760   1.622
  175    HE2  LYS  20           1HE      LYS  20 -18.840  -7.744  -0.629
  176    HE3  LYS  20           2HE      LYS  20 -20.122  -8.020   0.547
  177    HZ2  LYS  20           1HZ      LYS  20 -20.072  -5.768  -1.380
  178    HZ3  LYS  20           2HZ      LYS  20 -21.250  -6.035  -0.278
  Start of MODEL   13
    1    H1   LYS   1           H        LYS   1  16.530  -3.899   0.789
    2    HA   LYS   1           HA       LYS   1  14.590  -2.034   1.932
    3    HB2  LYS   1           1HB      LYS   1  14.137  -0.749  -0.075
    4    HB3  LYS   1           2HB      LYS   1  15.680  -0.324   0.590
    5    HG2  LYS   1           1HG      LYS   1  15.482  -2.290  -1.781
    6    HG3  LYS   1           2HG      LYS   1  15.338  -0.555  -2.010
    7    HD2  LYS   1           2HD      LYS   1  17.612  -0.198  -0.971
    8    HD3  LYS   1           1HD      LYS   1  17.801  -1.943  -0.785
    9    HE2  LYS   1           2HE      LYS   1  17.590  -2.244  -3.299
   10    HE3  LYS   1           1HE      LYS   1  17.408  -0.494  -3.491
   11    HZ2  LYS   1           1HZ      LYS   1  19.598  -0.195  -2.536
   12    HZ3  LYS   1           2HZ      LYS   1  19.664  -1.160  -3.855
   13    H    MET   2           H        MET   2  13.342  -2.478  -0.772
   14    HA   MET   2           HA       MET   2  11.848  -3.955  -1.733
   15    HB2  MET   2           1HB      MET   2  14.381  -5.261  -1.681
   16    HB3  MET   2           2HB      MET   2  13.330  -6.488  -1.041
   17    HG2  MET   2           1HG      MET   2  11.713  -5.848  -3.062
   18    HG3  MET   2           2HG      MET   2  13.051  -4.840  -3.630
   19    HE1  MET   2           1HE      MET   2  12.601  -8.611  -2.128
   20    HE2  MET   2           2HE      MET   2  11.507  -8.406  -3.532
   21    HE3  MET   2           3HE      MET   2  12.908  -9.512  -3.642
   22    H    ASN   3           H        ASN   3  10.754  -3.089   0.233
   23    HA   ASN   3           HA       ASN   3   8.796  -5.058   0.958
   24    HB2  ASN   3           1HB      ASN   3   8.814  -5.018   3.443
   25    HB3  ASN   3           2HB      ASN   3  10.188  -5.844   2.774
   26   HD21  ASN   3          1HD2      ASN   3   9.314  -3.659   5.112
   27   HD22  ASN   3          2HD2      ASN   3  10.980  -2.963   5.442
   28    H    MET   4           H        MET   4   9.632  -1.952   2.659
   29    HA   MET   4           HA       MET   4   7.022  -0.951   2.070
   30    HB2  MET   4           1HB      MET   4   9.398   0.894   2.708
   31    HB3  MET   4           2HB      MET   4   7.699   1.158   3.059
   32    HG2  MET   4           1HG      MET   4   7.880  -0.916   4.687
   33    HG3  MET   4           2HG      MET   4   9.619  -0.769   4.456
   34    HE1  MET   4           1HE      MET   4   9.081   0.909   8.008
   35    HE2  MET   4           2HE      MET   4   9.958  -0.351   7.090
   36    HE3  MET   4           3HE      MET   4   8.188  -0.486   7.333
   37    H    LEU   5           H        LEU   5   8.494  -1.644  -0.374
   38    HA   LEU   5           HA       LEU   5   8.556   0.863  -2.006
   39    HB2  LEU   5           1HB      LEU   5   9.403  -1.980  -2.734
   40    HB3  LEU   5           2HB      LEU   5   9.506  -0.600  -3.814
   41    HG   LEU   5           HG       LEU   5  11.040  -0.988  -1.167
   42   HD11  LEU   5          1HD1      LEU   5  12.042  -0.922  -4.058
   43   HD12  LEU   5          2HD1      LEU   5  12.964  -1.348  -2.569
   44   HD13  LEU   5          3HD1      LEU   5  11.655  -2.405  -3.159
   45   HD21  LEU   5          1HD2      LEU   5  11.265   1.400  -3.123
   46   HD22  LEU   5          2HD2      LEU   5  10.703   1.467  -1.433
   47   HD23  LEU   5          3HD2      LEU   5  12.389   1.052  -1.781
   48    H    LYS   6           H        LYS   6   7.409  -2.409  -2.768
   49    HA   LYS   6           HA       LYS   6   4.959  -1.458  -4.003
   50    HB2  LYS   6           2HB      LYS   6   5.698  -4.333  -3.132
   51    HB3  LYS   6           1HB      LYS   6   4.240  -3.935  -4.029
   52    HG2  LYS   6           2HG      LYS   6   5.614  -3.011  -5.930
   53    HG3  LYS   6           1HG      LYS   6   7.096  -3.423  -5.064
   54    HD2  LYS   6           2HD      LYS   6   6.422  -5.865  -5.065
   55    HD3  LYS   6           1HD      LYS   6   4.940  -5.455  -5.936
   56    HE2  LYS   6           2HE      LYS   6   6.325  -4.561  -7.875
   57    HE3  LYS   6           1HE      LYS   6   7.809  -4.972  -7.003
   58    HZ2  LYS   6           1HZ      LYS   6   7.170  -6.671  -8.580
   59    HZ3  LYS   6           2HZ      LYS   6   5.716  -6.890  -7.866
   60    H    GLU   7           H        GLU   7   5.613  -2.527  -0.696
   61    HA   GLU   7           HA       GLU   7   2.749  -2.620   0.088
   62    HB2  GLU   7           2HB      GLU   7   5.208  -2.360   1.945
   63    HB3  GLU   7           1HB      GLU   7   3.555  -2.538   2.503
   64    HG2  GLU   7           2HG      GLU   7   3.356  -4.781   1.382
   65    HG3  GLU   7           1HG      GLU   7   5.008  -4.654   0.789
   66    HE2  GLU   7           HE2      GLU   7   6.605  -4.874   2.096
   67    H    ASN   8           H        ASN   8   5.215   0.041   0.267
   68    HA   ASN   8           HA       ASN   8   3.329   1.877   1.516
   69    HB2  ASN   8           1HB      ASN   8   5.792   2.431   1.181
   70    HB3  ASN   8           2HB      ASN   8   5.482   2.627  -0.578
   71   HD21  ASN   8          1HD2      ASN   8   5.196   4.759  -1.113
   72   HD22  ASN   8          2HD2      ASN   8   4.697   6.097   0.040
   73    H    VAL   9           H        VAL   9   3.981   1.363  -1.984
   74    HA   VAL   9           HA       VAL   9   1.923   3.057  -2.974
   75    HB   VAL   9           HB       VAL   9   4.180   1.614  -3.883
   76   HG11  VAL   9          1HG1      VAL   9   1.822   0.576  -5.594
   77   HG12  VAL   9          2HG1      VAL   9   2.789  -0.431  -4.495
   78   HG13  VAL   9          3HG1      VAL   9   3.563   0.341  -5.891
   79   HG21  VAL   9          1HG2      VAL   9   2.216   3.235  -5.547
   80   HG22  VAL   9          2HG2      VAL   9   3.548   3.849  -4.527
   81   HG23  VAL   9          3HG2      VAL   9   3.924   2.845  -5.942
   82    H    ASP  10           H        ASP  10   1.218   0.354  -1.163
   83    HA   ASP  10           HA       ASP  10  -1.175  -0.569  -2.573
   84    HB2  ASP  10           1HB      ASP  10   0.700  -2.352  -1.915
   85    HB3  ASP  10           2HB      ASP  10   0.163  -1.994  -0.291
   86    HD2  ASP  10           HD2      ASP  10  -0.845  -3.038  -3.354
   87    H    TYR  11           H        TYR  11   0.458   0.613   0.345
   88    HA   TYR  11           HA       TYR  11  -1.769   0.841   2.178
   89    HB2  TYR  11           2HB      TYR  11   0.833   0.917   2.669
   90    HB3  TYR  11           1HB      TYR  11   0.687   2.575   2.246
   91    HD1  TYR  11           HD1      TYR  11  -0.709  -0.005   4.583
   92    HD2  TYR  11           HD2      TYR  11  -0.334   4.196   3.803
   93    HE1  TYR  11           HE1      TYR  11  -1.475   0.490   6.880
   94    HE2  TYR  11           HE2      TYR  11  -1.100   4.691   6.098
   95    HH   TYR  11           HH       TYR  11  -1.956   2.072   8.363
   96    H    ILE  12           H        ILE  12  -0.559   3.175  -0.186
   97    HA   ILE  12           HA       ILE  12  -2.169   5.445   0.790
   98    HB   ILE  12           HB       ILE  12  -0.226   5.179  -1.447
   99   HG12  ILE  12          2HG1      ILE  12   0.659   7.391  -0.468
  100   HG13  ILE  12          1HG1      ILE  12  -0.535   7.261   0.808
  101   HG21  ILE  12          1HG2      ILE  12  -2.192   7.542  -1.305
  102   HG22  ILE  12          2HG2      ILE  12  -0.741   7.467  -2.340
  103   HG23  ILE  12          3HG2      ILE  12  -2.073   6.342  -2.615
  104   HD11  ILE  12          1HD1      ILE  12   0.633   5.161   1.649
  105   HD12  ILE  12          2HD1      ILE  12   1.744   6.539   1.534
  106   HD13  ILE  12          3HD1      ILE  12   1.782   5.279   0.285
  107    H    GLN  13           H        GLN  13  -2.190   3.317  -2.078
  108    HA   GLN  13           HA       GLN  13  -4.810   3.905  -2.986
  109    HB2  GLN  13           1HB      GLN  13  -3.443   1.242  -3.289
  110    HB3  GLN  13           2HB      GLN  13  -4.837   1.798  -4.142
  111    HG2  GLN  13           1HG      GLN  13  -3.539   3.703  -5.176
  112    HG3  GLN  13           2HG      GLN  13  -2.083   3.123  -4.393
  113   HE21  GLN  13          2HE2      GLN  13  -4.178   2.692  -7.089
  114   HE22  GLN  13          1HE2      GLN  13  -3.272   1.283  -7.836
  115    H    LYS  14           H        LYS  14  -3.819   1.669  -0.352
  116    HA   LYS  14           HA       LYS  14  -6.478   0.505  -0.018
  117    HB2  LYS  14           2HB      LYS  14  -4.343  -0.557   0.763
  118    HB3  LYS  14           1HB      LYS  14  -4.259   0.604   2.099
  119    HG2  LYS  14           1HG      LYS  14  -6.476  -0.335   2.933
  120    HG3  LYS  14           2HG      LYS  14  -6.514  -1.460   1.579
  121    HD2  LYS  14           2HD      LYS  14  -4.313  -1.365   3.748
  122    HD3  LYS  14           1HD      LYS  14  -5.716  -2.423   3.798
  123    HE2  LYS  14           1HE      LYS  14  -4.979  -3.603   1.703
  124    HE3  LYS  14           2HE      LYS  14  -3.580  -2.531   1.559
  125    HZ2  LYS  14           1HZ      LYS  14  -2.811  -3.335   3.714
  126    HZ3  LYS  14           2HZ      LYS  14  -4.097  -4.335   3.851
  127    H    ASN  15           H        ASN  15  -5.022   3.408   1.409
  128    HA   ASN  15           HA       ASN  15  -6.955   3.959   3.458
  129    HB2  ASN  15           1HB      ASN  15  -4.620   5.083   3.006
  130    HB3  ASN  15           2HB      ASN  15  -5.551   6.091   1.871
  131   HD21  ASN  15          1HD2      ASN  15  -4.849   7.878   3.142
  132   HD22  ASN  15          2HD2      ASN  15  -5.664   8.281   4.736
  133    H    GLN  16           H        GLN  16  -6.720   5.303   0.232
  134    HA   GLN  16           HA       GLN  16  -9.252   6.708   0.272
  135    HB2  GLN  16           2HB      GLN  16  -8.423   7.725  -1.669
  136    HB3  GLN  16           1HB      GLN  16  -7.043   7.451  -0.651
  137    HG2  GLN  16           1HG      GLN  16  -6.522   5.328  -2.075
  138    HG3  GLN  16           2HG      GLN  16  -7.777   5.836  -3.187
  139   HE21  GLN  16          1HE2      GLN  16  -7.363   7.690  -4.509
  140   HE22  GLN  16          2HE2      GLN  16  -5.677   8.402  -4.650
  141    H    ASN  17           H        ASN  17  -8.274   3.743  -1.408
  142    HA   ASN  17           HA       ASN  17 -10.914   3.477  -2.731
  143    HB2  ASN  17           2HB      ASN  17  -8.711   2.943  -3.918
  144    HB3  ASN  17           1HB      ASN  17  -8.559   1.528  -2.905
  145   HD21  ASN  17          1HD2      ASN  17 -10.366   2.978  -5.544
  146   HD22  ASN  17          2HD2      ASN  17 -11.155   1.415  -6.092
  147    H    LEU  18           H        LEU  18  -9.574   2.177   0.240
  148    HA   LEU  18           HA       LEU  18  -9.862   0.274   1.538
  149    HB2  LEU  18           2HB      LEU  18 -12.587   1.526   1.062
  150    HB3  LEU  18           1HB      LEU  18 -12.156   0.584   2.465
  151    HG   LEU  18           HG       LEU  18 -10.303   2.944   1.784
  152   HD11  LEU  18          1HD1      LEU  18 -11.685   4.582   2.869
  153   HD12  LEU  18          2HD1      LEU  18 -12.454   3.932   1.407
  154   HD13  LEU  18          3HD1      LEU  18 -13.035   3.401   3.016
  155   HD21  LEU  18          1HD2      LEU  18  -9.705   1.449   3.645
  156   HD22  LEU  18          2HD2      LEU  18 -11.239   1.840   4.474
  157   HD23  LEU  18          3HD2      LEU  18 -10.009   3.113   4.180
  158    H    PHE  19           H        PHE  19  -9.396  -1.041  -0.774
  159    HA   PHE  19           HA       PHE  19 -11.395  -2.950  -1.440
  160    HB2  PHE  19           2HB      PHE  19  -9.442  -4.157  -2.530
  161    HB3  PHE  19           1HB      PHE  19  -9.835  -2.545  -3.076
  162    HD1  PHE  19           HD1      PHE  19  -7.334  -4.470  -0.989
  163    HD2  PHE  19           HD2      PHE  19  -8.162  -0.770  -3.020
  164    HE1  PHE  19           HE1      PHE  19  -4.959  -3.834  -0.820
  165    HE2  PHE  19           HE2      PHE  19  -5.788  -0.172  -2.876
  166    HZ   PHE  19           HZ       PHE  19  -4.183  -1.685  -1.763
  167    H    LYS  20           H        LYS  20  -8.708  -3.355   0.868
  168    HA   LYS  20           HA       LYS  20  -9.399  -6.112   1.497
  169    HB2  LYS  20           2HB      LYS  20  -7.105  -5.216   1.593
  170    HB3  LYS  20           1HB      LYS  20  -7.584  -4.283   3.014
  171    HG2  LYS  20           1HG      LYS  20  -8.085  -6.447   4.248
  172    HG3  LYS  20           2HG      LYS  20  -7.644  -7.360   2.803
  173    HD2  LYS  20           1HD      LYS  20  -5.282  -6.390   2.939
  174    HD3  LYS  20           2HD      LYS  20  -5.760  -5.486   4.368
  175    HE2  LYS  20           1HE      LYS  20  -4.560  -7.401   5.167
  176    HE3  LYS  20           2HE      LYS  20  -6.247  -7.677   5.591
  177    HZ2  LYS  20           1HZ      LYS  20  -5.252  -9.645   4.684
  178    HZ3  LYS  20           2HZ      LYS  20  -6.434  -9.144   3.672
  Start of MODEL   14
    1    H1   LYS   1           H        LYS   1  17.254  -2.039   1.560
    2    HA   LYS   1           HA       LYS   1  15.000  -1.877   3.352
    3    HB2  LYS   1           2HB      LYS   1  14.625   0.679   2.941
    4    HB3  LYS   1           1HB      LYS   1  15.564   0.120   4.296
    5    HG2  LYS   1           2HG      LYS   1  16.644   2.048   3.535
    6    HG3  LYS   1           1HG      LYS   1  17.711   0.711   3.157
    7    HD2  LYS   1           2HD      LYS   1  17.070   0.813   0.758
    8    HD3  LYS   1           1HD      LYS   1  15.863   2.056   1.069
    9    HE2  LYS   1           2HE      LYS   1  18.911   2.393   1.542
   10    HE3  LYS   1           1HE      LYS   1  18.072   2.867   0.068
   11    HZ2  LYS   1           1HZ      LYS   1  18.346   4.735   1.505
   12    HZ3  LYS   1           2HZ      LYS   1  16.751   4.425   1.327
   13    H    MET   2           H        MET   2  14.317  -3.276   1.791
   14    HA   MET   2           HA       MET   2  13.428  -2.121  -0.747
   15    HB2  MET   2           2HB      MET   2  14.738  -3.381  -2.316
   16    HB3  MET   2           1HB      MET   2  15.851  -2.668  -1.192
   17    HG2  MET   2           2HG      MET   2  16.831  -4.724  -1.350
   18    HG3  MET   2           1HG      MET   2  15.773  -5.088   0.021
   19    HE1  MET   2           1HE      MET   2  15.623  -8.441  -2.059
   20    HE2  MET   2           2HE      MET   2  17.038  -7.391  -1.750
   21    HE3  MET   2           3HE      MET   2  15.856  -7.711  -0.442
   22    H    ASN   3           H        ASN   3  11.743  -2.607   0.833
   23    HA   ASN   3           HA       ASN   3  10.184  -4.917  -0.100
   24    HB2  ASN   3           1HB      ASN   3  10.634  -4.548   2.953
   25    HB3  ASN   3           2HB      ASN   3   9.335  -5.512   2.290
   26   HD21  ASN   3          1HD2      ASN   3   9.873  -7.507   1.178
   27   HD22  ASN   3          2HD2      ASN   3  11.473  -8.331   1.531
   28    H    MET   4           H        MET   4  10.140  -2.047   2.116
   29    HA   MET   4           HA       MET   4   7.333  -1.568   1.438
   30    HB2  MET   4           1HB      MET   4   7.404   0.447   2.805
   31    HB3  MET   4           2HB      MET   4   7.804  -1.042   3.641
   32    HG2  MET   4           2HG      MET   4  10.165  -0.584   3.559
   33    HG3  MET   4           1HG      MET   4   9.936   0.769   2.453
   34    HE1  MET   4           1HE      MET   4   8.327  -0.426   6.019
   35    HE2  MET   4           2HE      MET   4  10.111  -0.378   6.170
   36    HE3  MET   4           3HE      MET   4   9.104   0.800   7.062
   37    H    LEU   5           H        LEU   5   8.858  -1.653  -0.932
   38    HA   LEU   5           HA       LEU   5   9.355   1.098  -1.922
   39    HB2  LEU   5           2HB      LEU   5  10.712   0.439  -3.621
   40    HB3  LEU   5           1HB      LEU   5  11.220  -0.238  -2.114
   41    HG   LEU   5           HG       LEU   5   9.773  -2.362  -2.951
   42   HD11  LEU   5          1HD1      LEU   5   9.970  -2.758  -5.392
   43   HD12  LEU   5          2HD1      LEU   5  10.777  -1.178  -5.634
   44   HD13  LEU   5          3HD1      LEU   5   9.070  -1.246  -5.169
   45   HD21  LEU   5          1HD2      LEU   5  11.945  -3.303  -3.791
   46   HD22  LEU   5          2HD2      LEU   5  12.123  -2.336  -2.307
   47   HD23  LEU   5          3HD2      LEU   5  12.615  -1.630  -3.863
   48    H    LYS   6           H        LYS   6   7.952  -1.927  -3.075
   49    HA   LYS   6           HA       LYS   6   5.753  -0.613  -4.509
   50    HB2  LYS   6           2HB      LYS   6   7.046  -2.705  -5.334
   51    HB3  LYS   6           1HB      LYS   6   6.279  -3.635  -4.059
   52    HG2  LYS   6           2HG      LYS   6   4.002  -3.119  -5.086
   53    HG3  LYS   6           1HG      LYS   6   4.792  -2.155  -6.335
   54    HD2  LYS   6           2HD      LYS   6   6.062  -4.234  -7.111
   55    HD3  LYS   6           1HD      LYS   6   5.271  -5.164  -5.848
   56    HE2  LYS   6           1HE      LYS   6   4.082  -5.654  -7.872
   57    HE3  LYS   6           2HE      LYS   6   2.996  -4.661  -6.902
   58    HZ2  LYS   6           1HZ      LYS   6   3.691  -2.740  -8.252
   59    HZ3  LYS   6           2HZ      LYS   6   4.692  -3.678  -9.140
   60    H    GLU   7           H        GLU   7   6.124  -2.422  -1.480
   61    HA   GLU   7           HA       GLU   7   3.233  -2.587  -0.878
   62    HB2  GLU   7           1HB      GLU   7   5.583  -2.700   1.133
   63    HB3  GLU   7           2HB      GLU   7   3.912  -3.058   1.527
   64    HG2  GLU   7           2HG      GLU   7   3.912  -5.032  -0.026
   65    HG3  GLU   7           1HG      GLU   7   5.568  -4.680  -0.511
   66    HE2  GLU   7           HE2      GLU   7   3.533  -5.651   1.988
   67    H    ASN   8           H        ASN   8   5.660  -0.037  -0.050
   68    HA   ASN   8           HA       ASN   8   3.711   1.509   1.471
   69    HB2  ASN   8           2HB      ASN   8   6.208   2.073   1.384
   70    HB3  ASN   8           1HB      ASN   8   5.981   2.658  -0.294
   71   HD21  ASN   8          2HD2      ASN   8   5.702   4.856  -0.369
   72   HD22  ASN   8          1HD2      ASN   8   5.154   5.913   1.027
   73    H    VAL   9           H        VAL   9   4.586   1.715  -2.013
   74    HA   VAL   9           HA       VAL   9   2.567   3.575  -2.765
   75    HB   VAL   9           HB       VAL   9   4.912   2.360  -3.800
   76   HG11  VAL   9          1HG2      VAL   9   4.455   1.578  -6.081
   77   HG12  VAL   9          2HG2      VAL   9   2.695   1.753  -5.870
   78   HG13  VAL   9          3HG2      VAL   9   3.587   0.514  -4.960
   79   HG21  VAL   9          1HG1      VAL   9   4.299   4.689  -3.971
   80   HG22  VAL   9          2HG1      VAL   9   4.786   4.026  -5.544
   81   HG23  VAL   9          3HG1      VAL   9   3.050   4.322  -5.196
   82    H    ASP  10           H        ASP  10   1.730   0.627  -1.542
   83    HA   ASP  10           HA       ASP  10  -0.544   0.007  -3.269
   84    HB2  ASP  10           2HB      ASP  10   1.351  -1.855  -2.906
   85    HB3  ASP  10           1HB      ASP  10   0.646  -1.924  -1.306
   86    HD2  ASP  10           HD2      ASP  10  -2.244  -3.558  -2.223
   87    H    TYR  11           H        TYR  11   0.928   0.555  -0.094
   88    HA   TYR  11           HA       TYR  11  -1.395   0.345   1.630
   89    HB2  TYR  11           2HB      TYR  11   1.183   0.298   2.254
   90    HB3  TYR  11           1HB      TYR  11   1.034   2.009   2.232
   91    HD1  TYR  11           HD2      TYR  11  -0.413  -1.068   3.810
   92    HD2  TYR  11           HD1      TYR  11  -0.106   3.202   4.077
   93    HE1  TYR  11           HE2      TYR  11  -1.311  -1.148   6.108
   94    HE2  TYR  11           HE1      TYR  11  -0.999   3.123   6.378
   95    HH   TYR  11           HH       TYR  11  -1.774   1.833   8.012
   96    H    ILE  12           H        ILE  12  -0.120   3.136  -0.128
   97    HA   ILE  12           HA       ILE  12  -1.746   5.137   1.298
   98    HB   ILE  12           HB       ILE  12   0.214   5.348  -0.930
   99   HG12  ILE  12          2HG1      ILE  12   1.112   7.295   0.521
  100   HG13  ILE  12          1HG1      ILE  12  -0.100   6.899   1.724
  101   HG21  ILE  12          1HG2      ILE  12  -1.715   7.657  -0.291
  102   HG22  ILE  12          2HG2      ILE  12  -0.254   7.786  -1.308
  103   HG23  ILE  12          3HG2      ILE  12  -1.599   6.768  -1.830
  104   HD11  ILE  12          1HD1      ILE  12   2.228   5.080   0.816
  105   HD12  ILE  12          2HD1      ILE  12   1.051   4.653   2.094
  106   HD13  ILE  12          3HD1      ILE  12   2.154   6.024   2.316
  107    H    GLN  13           H        GLN  13  -1.795   3.639  -1.952
  108    HA   GLN  13           HA       GLN  13  -4.426   4.595  -2.600
  109    HB2  GLN  13           1HB      GLN  13  -4.470   3.000  -4.407
  110    HB3  GLN  13           2HB      GLN  13  -2.982   3.893  -4.417
  111    HG2  GLN  13           2HG      GLN  13  -1.820   1.886  -3.379
  112    HG3  GLN  13           1HG      GLN  13  -3.327   0.987  -3.390
  113   HE21  GLN  13          1HE2      GLN  13  -3.838  -0.114  -5.259
  114   HE22  GLN  13          2HE2      GLN  13  -2.886   0.020  -6.822
  115    H    LYS  14           H        LYS  14  -3.372   1.732  -0.698
  116    HA   LYS  14           HA       LYS  14  -5.991   0.454  -0.641
  117    HB2  LYS  14           2HB      LYS  14  -3.905  -0.755  -0.121
  118    HB3  LYS  14           1HB      LYS  14  -3.715   0.175   1.377
  119    HG2  LYS  14           2HG      LYS  14  -5.869  -0.890   2.231
  120    HG3  LYS  14           1HG      LYS  14  -6.044  -1.726   0.693
  121    HD2  LYS  14           2HD      LYS  14  -5.164  -3.321   2.244
  122    HD3  LYS  14           1HD      LYS  14  -3.869  -2.962   1.110
  123    HE2  LYS  14           2HE      LYS  14  -2.803  -1.409   2.835
  124    HE3  LYS  14           1HE      LYS  14  -4.130  -1.743   3.956
  125    HZ2  LYS  14           1HZ      LYS  14  -2.215  -3.739   2.880
  126    HZ3  LYS  14           2HZ      LYS  14  -2.194  -3.102   4.386
  127    H    ASN  15           H        ASN  15  -4.655   3.021   1.345
  128    HA   ASN  15           HA       ASN  15  -5.943   3.118   3.809
  129    HB2  ASN  15           1HB      ASN  15  -4.225   4.725   2.629
  130    HB3  ASN  15           2HB      ASN  15  -5.692   5.513   2.010
  131   HD21  ASN  15          1HD2      ASN  15  -4.939   7.402   3.087
  132   HD22  ASN  15          2HD2      ASN  15  -5.136   7.605   4.901
  133    H    GLN  16           H        GLN  16  -7.231   4.259   0.843
  134    HA   GLN  16           HA       GLN  16  -9.677   5.472   1.911
  135    HB2  GLN  16           1HB      GLN  16  -9.881   6.387  -0.216
  136    HB3  GLN  16           2HB      GLN  16  -8.166   6.258  -0.004
  137    HG2  GLN  16           2HG      GLN  16  -8.281   4.012  -1.359
  138    HG3  GLN  16           1HG      GLN  16  -9.942   4.399  -1.740
  139   HE21  GLN  16          2HE2      GLN  16 -10.344   6.127  -3.220
  140   HE22  GLN  16          1HE2      GLN  16  -8.992   6.860  -4.220
  141    H    ASN  17           H        ASN  17  -9.154   2.361   1.782
  142    HA   ASN  17           HA       ASN  17 -10.416   0.486   2.128
  143    HB2  ASN  17           2HB      ASN  17 -12.722   0.376   2.665
  144    HB3  ASN  17           1HB      ASN  17 -11.850   1.529   3.620
  145   HD21  ASN  17          1HD2      ASN  17 -12.711   3.581   3.789
  146   HD22  ASN  17          2HD2      ASN  17 -14.204   4.130   2.875
  147    H    LEU  18           H        LEU  18  -9.320   0.468  -0.352
  148    HA   LEU  18           HA       LEU  18 -11.012   0.330  -2.480
  149    HB2  LEU  18           2HB      LEU  18  -8.724  -1.599  -2.013
  150    HB3  LEU  18           1HB      LEU  18  -9.437  -1.242  -3.578
  151    HG   LEU  18           HG       LEU  18  -8.201   0.919  -1.791
  152   HD11  LEU  18          1HD2      LEU  18  -6.536  -0.832  -2.339
  153   HD12  LEU  18          2HD2      LEU  18  -6.151   0.686  -3.185
  154   HD13  LEU  18          3HD2      LEU  18  -6.905  -0.673  -4.079
  155   HD21  LEU  18          1HD1      LEU  18  -8.925   1.036  -4.767
  156   HD22  LEU  18          2HD1      LEU  18  -8.033   2.292  -3.852
  157   HD23  LEU  18          3HD1      LEU  18  -9.709   1.919  -3.427
  158    H    PHE  19           H        PHE  19 -10.339  -2.570  -0.519
  159    HA   PHE  19           HA       PHE  19 -12.261  -4.250  -1.896
  160    HB2  PHE  19           2HB      PHE  19 -11.589  -5.963  -0.247
  161    HB3  PHE  19           1HB      PHE  19 -10.221  -5.253  -1.048
  162    HD1  PHE  19           HD2      PHE  19 -11.984  -5.659   2.206
  163    HD2  PHE  19           HD1      PHE  19  -8.611  -3.795   0.287
  164    HE1  PHE  19           HE2      PHE  19 -10.969  -5.214   4.401
  165    HE2  PHE  19           HE1      PHE  19  -7.613  -3.361   2.492
  166    HZ   PHE  19           HZ       PHE  19  -8.784  -4.066   4.550
  167    H    LYS  20           H        LYS  20 -13.856  -5.683  -0.257
  168    HA   LYS  20           HA       LYS  20 -15.836  -3.770   0.750
  169    HB2  LYS  20           2HB      LYS  20 -16.444  -5.666  -0.691
  170    HB3  LYS  20           1HB      LYS  20 -15.961  -6.753   0.615
  171    HG2  LYS  20           1HG      LYS  20 -17.765  -5.761   2.094
  172    HG3  LYS  20           2HG      LYS  20 -18.205  -4.643   0.800
  173    HD2  LYS  20           1HD      LYS  20 -18.799  -6.607  -0.689
  174    HD3  LYS  20           2HD      LYS  20 -18.353  -7.724   0.606
  175    HE2  LYS  20           2HE      LYS  20 -20.160  -6.722   2.093
  176    HE3  LYS  20           1HE      LYS  20 -20.607  -5.605   0.795
  177    HZ2  LYS  20           1HZ      LYS  20 -21.113  -7.534  -0.599
  178    HZ3  LYS  20           2HZ      LYS  20 -20.700  -8.565   0.600
  Start of MODEL   15
    1    H1   LYS   1           H        LYS   1  16.182  -4.032   0.014
    2    HA   LYS   1           HA       LYS   1  14.995  -1.716   1.250
    3    HB2  LYS   1           1HB      LYS   1  14.737  -0.332  -0.817
    4    HB3  LYS   1           2HB      LYS   1  16.296  -0.210  -0.055
    5    HG2  LYS   1           2HG      LYS   1  15.926  -2.077  -2.476
    6    HG3  LYS   1           1HG      LYS   1  16.039  -0.340  -2.697
    7    HD2  LYS   1           2HD      LYS   1  18.267  -0.302  -1.530
    8    HD3  LYS   1           1HD      LYS   1  18.220  -2.042  -1.320
    9    HE2  LYS   1           1HE      LYS   1  18.186  -0.615  -4.069
   10    HE3  LYS   1           2HE      LYS   1  19.634  -1.227  -3.272
   11    HZ2  LYS   1           1HZ      LYS   1  18.834  -2.799  -4.859
   12    HZ3  LYS   1           2HZ      LYS   1  18.736  -3.452  -3.363
   13    H    MET   2           H        MET   2  13.568  -3.334   1.649
   14    HA   MET   2           HA       MET   2  11.752  -4.114  -0.519
   15    HB2  MET   2           2HB      MET   2  12.085  -6.494  -0.537
   16    HB3  MET   2           1HB      MET   2  13.653  -5.771  -0.716
   17    HG2  MET   2           1HG      MET   2  14.217  -7.446   0.738
   18    HG3  MET   2           2HG      MET   2  13.884  -6.190   1.940
   19    HE1  MET   2           1HE      MET   2  12.443  -9.435   3.676
   20    HE2  MET   2           2HE      MET   2  13.485  -7.994   3.867
   21    HE3  MET   2           3HE      MET   2  13.934  -9.277   2.700
   22    H    ASN   3           H        ASN   3  10.963  -2.499   0.991
   23    HA   ASN   3           HA       ASN   3   8.921  -3.723   2.702
   24    HB2  ASN   3           1HB      ASN   3  10.749  -1.534   3.932
   25    HB3  ASN   3           2HB      ASN   3   9.203  -2.004   4.600
   26   HD21  ASN   3          1HD2      ASN   3  12.519  -2.727   4.631
   27   HD22  ASN   3          2HD2      ASN   3  12.394  -4.250   5.647
   28    H    MET   4           H        MET   4  10.165  -0.394   1.854
   29    HA   MET   4           HA       MET   4   7.517   0.539   1.341
   30    HB2  MET   4           2HB      MET   4   9.981   1.760  -0.027
   31    HB3  MET   4           1HB      MET   4   8.486   2.566   0.408
   32    HG2  MET   4           2HG      MET   4   9.165   2.076   2.931
   33    HG3  MET   4           1HG      MET   4  10.732   1.648   2.271
   34    HE1  MET   4           1HE      MET   4   7.959   4.588   1.737
   35    HE2  MET   4           2HE      MET   4   8.914   5.922   2.448
   36    HE3  MET   4           3HE      MET   4   8.457   4.518   3.457
   37    H    LEU   5           H        LEU   5   8.326  -1.810  -0.312
   38    HA   LEU   5           HA       LEU   5   7.923  -0.995  -3.153
   39    HB2  LEU   5           2HB      LEU   5   8.683  -3.685  -1.905
   40    HB3  LEU   5           1HB      LEU   5   8.438  -3.436  -3.626
   41    HG   LEU   5           HG       LEU   5  10.627  -2.182  -1.865
   42   HD11  LEU   5          1HD1      LEU   5  10.700  -4.254  -4.127
   43   HD12  LEU   5          2HD1      LEU   5  10.781  -4.613  -2.384
   44   HD13  LEU   5          3HD1      LEU   5  12.094  -3.678  -3.151
   45   HD21  LEU   5          1HD2      LEU   5  10.183  -1.751  -4.896
   46   HD22  LEU   5          2HD2      LEU   5  10.113  -0.503  -3.625
   47   HD23  LEU   5          3HD2      LEU   5  11.654  -1.295  -3.990
   48    H    LYS   6           H        LYS   6   6.723  -3.868  -1.471
   49    HA   LYS   6           HA       LYS   6   4.032  -3.543  -2.511
   50    HB2  LYS   6           2HB      LYS   6   5.062  -5.464  -0.318
   51    HB3  LYS   6           1HB      LYS   6   3.424  -5.509  -0.951
   52    HG2  LYS   6           1HG      LYS   6   4.288  -5.970  -3.273
   53    HG3  LYS   6           2HG      LYS   6   5.944  -5.961  -2.662
   54    HD2  LYS   6           1HD      LYS   6   5.389  -7.887  -1.115
   55    HD3  LYS   6           2HD      LYS   6   3.731  -7.901  -1.727
   56    HE2  LYS   6           2HE      LYS   6   4.596  -8.412  -4.065
   57    HE3  LYS   6           1HE      LYS   6   6.257  -8.399  -3.453
   58    HZ2  LYS   6           1HZ      LYS   6   5.406 -10.620  -3.562
   59    HZ3  LYS   6           2HZ      LYS   6   5.700 -10.236  -2.000
   60    H    GLU   7           H        GLU   7   5.409  -2.525   0.585
   61    HA   GLU   7           HA       GLU   7   2.747  -1.987   1.776
   62    HB2  GLU   7           1HB      GLU   7   3.752  -1.662   3.716
   63    HB3  GLU   7           2HB      GLU   7   5.210  -2.277   2.970
   64    HG2  GLU   7           1HG      GLU   7   5.837   0.199   2.503
   65    HG3  GLU   7           2HG      GLU   7   4.466   0.663   3.488
   66    HE2  GLU   7           HE2      GLU   7   7.533   0.306   3.496
   67    H    ASN   8           H        ASN   8   5.100   0.119   0.049
   68    HA   ASN   8           HA       ASN   8   3.393   2.471   0.273
   69    HB2  ASN   8           2HB      ASN   8   5.757   2.517  -0.741
   70    HB3  ASN   8           1HB      ASN   8   5.068   1.769  -2.222
   71   HD21  ASN   8          1HD2      ASN   8   5.008   4.693  -0.140
   72   HD22  ASN   8          2HD2      ASN   8   4.532   5.835  -1.494
   73    H    VAL   9           H        VAL   9   3.398   0.008  -2.350
   74    HA   VAL   9           HA       VAL   9   1.155   1.023  -3.772
   75    HB   VAL   9           HB       VAL   9   3.228  -0.871  -4.055
   76   HG11  VAL   9          1HG1      VAL   9   2.271  -3.013  -4.800
   77   HG12  VAL   9          2HG1      VAL   9   1.809  -2.766  -3.105
   78   HG13  VAL   9          3HG1      VAL   9   0.614  -2.496  -4.392
   79   HG21  VAL   9          1HG2      VAL   9   0.924  -0.344  -5.971
   80   HG22  VAL   9          2HG2      VAL   9   2.410   0.626  -5.754
   81   HG23  VAL   9          3HG2      VAL   9   2.535  -1.038  -6.361
   82    H    ASP  10           H        ASP  10   0.891  -0.161  -0.656
   83    HA   ASP  10           HA       ASP  10  -1.699  -1.508  -0.862
   84    HB2  ASP  10           1HB      ASP  10   0.331  -2.734   0.402
   85    HB3  ASP  10           2HB      ASP  10   0.026  -1.492   1.594
   86    HD2  ASP  10           HD2      ASP  10  -1.083  -4.238   0.100
   87    H    TYR  11           H        TYR  11   0.392   1.014   0.482
   88    HA   TYR  11           HA       TYR  11  -1.490   2.413   2.196
   89    HB2  TYR  11           1HB      TYR  11   1.158   2.550   2.144
   90    HB3  TYR  11           2HB      TYR  11   0.898   3.670   0.871
   91    HD1  TYR  11           HD1      TYR  11  -0.014   3.017   4.448
   92    HD2  TYR  11           HD2      TYR  11   0.085   5.962   1.334
   93    HE1  TYR  11           HE1      TYR  11  -0.405   4.796   6.119
   94    HE2  TYR  11           HE2      TYR  11  -0.306   7.741   3.002
   95    HH   TYR  11           HH       TYR  11  -0.689   6.972   6.464
   96    H    ILE  12           H        ILE  12  -0.715   2.865  -1.225
   97    HA   ILE  12           HA       ILE  12  -2.243   5.368  -1.537
   98    HB   ILE  12           HB       ILE  12  -0.607   3.760  -3.433
   99   HG12  ILE  12          1HG1      ILE  12   0.333   6.075  -4.038
  100   HG13  ILE  12          2HG1      ILE  12  -0.686   6.777  -2.796
  101   HG21  ILE  12          1HG2      ILE  12  -2.625   4.122  -4.819
  102   HG22  ILE  12          2HG2      ILE  12  -1.305   5.130  -5.417
  103   HG23  ILE  12          3HG2      ILE  12  -2.610   5.863  -4.447
  104   HD11  ILE  12          1HD1      ILE  12   1.596   4.740  -2.328
  105   HD12  ILE  12          2HD1      ILE  12   0.634   5.508  -1.032
  106   HD13  ILE  12          3HD1      ILE  12   1.687   6.493  -2.064
  107    H    GLN  13           H        GLN  13  -2.597   1.995  -2.672
  108    HA   GLN  13           HA       GLN  13  -5.339   2.114  -3.365
  109    HB2  GLN  13           1HB      GLN  13  -3.908  -0.335  -2.360
  110    HB3  GLN  13           2HB      GLN  13  -5.470  -0.289  -3.083
  111    HG2  GLN  13           2HG      GLN  13  -4.548   0.671  -5.222
  112    HG3  GLN  13           1HG      GLN  13  -2.925   0.579  -4.568
  113   HE21  GLN  13          1HE2      GLN  13  -1.856  -1.380  -4.854
  114   HE22  GLN  13          2HE2      GLN  13  -2.661  -2.907  -5.475
  115    H    LYS  14           H        LYS  14  -3.950   1.817  -0.077
  116    HA   LYS  14           HA       LYS  14  -6.503   1.181   1.199
  117    HB2  LYS  14           2HB      LYS  14  -4.378   0.598   2.244
  118    HB3  LYS  14           1HB      LYS  14  -3.944   2.305   2.456
  119    HG2  LYS  14           1HG      LYS  14  -5.863   2.572   4.037
  120    HG3  LYS  14           2HG      LYS  14  -6.367   0.905   3.774
  121    HD2  LYS  14           1HD      LYS  14  -3.660   1.785   4.988
  122    HD3  LYS  14           2HD      LYS  14  -5.087   1.353   5.921
  123    HE2  LYS  14           1HE      LYS  14  -5.035  -1.000   4.945
  124    HE3  LYS  14           2HE      LYS  14  -3.567  -0.588   4.047
  125    HZ2  LYS  14           1HZ      LYS  14  -2.451  -0.145   6.129
  126    HZ3  LYS  14           2HZ      LYS  14  -3.030  -1.673   6.090
  127    H    ASN  15           H        ASN  15  -4.829   4.291   0.671
  128    HA   ASN  15           HA       ASN  15  -6.478   6.092   2.164
  129    HB2  ASN  15           2HB      ASN  15  -4.237   6.560   0.908
  130    HB3  ASN  15           1HB      ASN  15  -5.290   6.763  -0.514
  131   HD21  ASN  15          1HD2      ASN  15  -4.434   8.899  -0.632
  132   HD22  ASN  15          2HD2      ASN  15  -5.062  10.227   0.469
  133    H    GLN  16           H        GLN  16  -6.644   5.327  -1.237
  134    HA   GLN  16           HA       GLN  16  -9.205   6.599  -1.763
  135    HB2  GLN  16           2HB      GLN  16  -8.606   6.303  -3.995
  136    HB3  GLN  16           1HB      GLN  16  -7.084   6.512  -3.185
  137    HG2  GLN  16           1HG      GLN  16  -6.812   3.924  -3.202
  138    HG3  GLN  16           2HG      GLN  16  -8.242   3.825  -4.206
  139   HE21  GLN  16          2HE2      GLN  16  -8.072   4.497  -6.401
  140   HE22  GLN  16          1HE2      GLN  16  -6.448   4.859  -7.174
  141    H    ASN  17           H        ASN  17  -8.529   3.392  -0.669
  142    HA   ASN  17           HA       ASN  17 -11.313   2.581  -0.891
  143    HB2  ASN  17           2HB      ASN  17 -10.427   1.935  -3.207
  144    HB3  ASN  17           1HB      ASN  17  -9.344   0.796  -2.449
  145   HD21  ASN  17          2HD2      ASN  17 -12.403   1.184  -3.766
  146   HD22  ASN  17          1HD2      ASN  17 -13.148  -0.376  -3.148
  147    H    LEU  18           H        LEU  18 -10.228   2.941   1.543
  148    HA   LEU  18           HA       LEU  18  -8.803   1.398   2.937
  149    HB2  LEU  18           2HB      LEU  18 -11.701   2.020   3.708
  150    HB3  LEU  18           1HB      LEU  18 -10.468   1.607   4.873
  151    HG   LEU  18           HG       LEU  18 -10.015   3.986   2.982
  152   HD11  LEU  18          1HD2      LEU  18 -11.028   5.515   4.623
  153   HD12  LEU  18          2HD2      LEU  18 -12.229   4.376   3.983
  154   HD13  LEU  18          3HD2      LEU  18 -11.567   4.131   5.623
  155   HD21  LEU  18          1HD1      LEU  18  -8.957   3.453   5.811
  156   HD22  LEU  18          2HD1      LEU  18  -8.064   3.174   4.296
  157   HD23  LEU  18          3HD1      LEU  18  -8.540   4.825   4.735
  158    H    PHE  19           H        PHE  19 -11.890   0.023   1.907
  159    HA   PHE  19           HA       PHE  19 -11.568  -2.552   3.252
  160    HB2  PHE  19           1HB      PHE  19 -13.690  -3.072   2.101
  161    HB3  PHE  19           2HB      PHE  19 -13.731  -1.661   3.128
  162    HD1  PHE  19           HD2      PHE  19 -13.844   0.700   2.045
  163    HD2  PHE  19           HD1      PHE  19 -14.238  -2.891  -0.298
  164    HE1  PHE  19           HE2      PHE  19 -14.957   1.969   0.264
  165    HE2  PHE  19           HE1      PHE  19 -15.363  -1.601  -2.066
  166    HZ   PHE  19           HZ       PHE  19 -15.726   0.828  -1.788
  167    H    LYS  20           H        LYS  20  -9.221  -2.430   1.871
  168    HA   LYS  20           HA       LYS  20  -9.260  -3.555  -0.764
  169    HB2  LYS  20           1HB      LYS  20  -7.516  -2.100   0.159
  170    HB3  LYS  20           2HB      LYS  20  -7.018  -3.431   1.208
  171    HG2  LYS  20           1HG      LYS  20  -6.425  -4.804  -0.837
  172    HG3  LYS  20           2HG      LYS  20  -6.961  -3.480  -1.874
  173    HD2  LYS  20           1HD      LYS  20  -5.212  -1.967  -0.850
  174    HD3  LYS  20           2HD      LYS  20  -4.657  -3.267   0.192
  175    HE2  LYS  20           2HE      LYS  20  -4.594  -3.358  -2.905
  176    HE3  LYS  20           1HE      LYS  20  -3.245  -2.844  -1.898
  177    HZ2  LYS  20           1HZ      LYS  20  -3.052  -5.140  -2.559
  178    HZ3  LYS  20           2HZ      LYS  20  -4.476  -5.538  -1.862
  Start of MODEL   16
    1    H1   LYS   1           H        LYS   1  17.394  -2.322  -1.853
    2    HA   LYS   1           HA       LYS   1  15.388  -1.149  -3.557
    3    HB2  LYS   1           2HB      LYS   1  13.992  -3.186  -3.922
    4    HB3  LYS   1           1HB      LYS   1  15.355  -3.032  -4.997
    5    HG2  LYS   1           1HG      LYS   1  15.601  -4.857  -2.531
    6    HG3  LYS   1           2HG      LYS   1  14.647  -5.368  -3.912
    7    HD2  LYS   1           1HD      LYS   1  16.687  -5.040  -5.426
    8    HD3  LYS   1           2HD      LYS   1  17.626  -4.606  -4.010
    9    HE2  LYS   1           1HE      LYS   1  18.141  -6.898  -4.463
   10    HE3  LYS   1           2HE      LYS   1  17.172  -6.900  -2.992
   11    HZ2  LYS   1           1HZ      LYS   1  15.251  -7.533  -4.321
   12    HZ3  LYS   1           2HZ      LYS   1  16.467  -8.610  -4.501
   13    H    MET   2           H        MET   2  15.139  -0.033  -1.695
   14    HA   MET   2           HA       MET   2  13.757  -1.342   0.534
   15    HB2  MET   2           2HB      MET   2  15.340  -1.032   2.303
   16    HB3  MET   2           1HB      MET   2  16.189  -1.812   1.008
   17    HG2  MET   2           1HG      MET   2  17.818  -0.334   1.628
   18    HG3  MET   2           2HG      MET   2  17.044   0.680   0.400
   19    HE1  MET   2           1HE      MET   2  18.930   1.885   2.655
   20    HE2  MET   2           2HE      MET   2  18.047   2.915   1.484
   21    HE3  MET   2           3HE      MET   2  17.975   3.282   3.234
   22    H    ASN   3           H        ASN   3  12.446   0.034  -0.848
   23    HA   ASN   3           HA       ASN   3  11.772   2.515   0.585
   24    HB2  ASN   3           2HB      ASN   3  12.114   2.597  -2.506
   25    HB3  ASN   3           1HB      ASN   3  11.278   3.825  -1.582
   26   HD21  ASN   3          2HD2      ASN   3  14.342   2.855  -2.709
   27   HD22  ASN   3          1HD2      ASN   3  15.305   4.149  -1.836
   28    H    MET   4           H        MET   4  10.786   0.273  -2.087
   29    HA   MET   4           HA       MET   4   7.966   0.725  -1.419
   30    HB2  MET   4           2HB      MET   4   7.348  -0.910  -3.109
   31    HB3  MET   4           1HB      MET   4   8.279   0.457  -3.697
   32    HG2  MET   4           2HG      MET   4  10.306  -0.812  -3.790
   33    HG3  MET   4           1HG      MET   4   9.592  -2.172  -2.915
   34    HE1  MET   4           1HE      MET   4  10.346  -3.926  -4.851
   35    HE2  MET   4           2HE      MET   4  10.014  -3.683  -6.592
   36    HE3  MET   4           3HE      MET   4  11.127  -2.576  -5.734
   37    H    LEU   5           H        LEU   5   9.330  -0.146   0.880
   38    HA   LEU   5           HA       LEU   5   8.808  -3.026   1.359
   39    HB2  LEU   5           2HB      LEU   5  10.266  -3.210   3.093
   40    HB3  LEU   5           1HB      LEU   5  11.023  -2.520   1.700
   41    HG   LEU   5           HG       LEU   5  10.453  -0.191   2.928
   42   HD11  LEU   5          1HD2      LEU   5   9.310  -1.323   4.959
   43   HD12  LEU   5          2HD2      LEU   5  10.690  -0.296   5.392
   44   HD13  LEU   5          3HD2      LEU   5  10.860  -2.077   5.355
   45   HD21  LEU   5          1HD1      LEU   5  12.649  -1.011   2.225
   46   HD22  LEU   5          2HD1      LEU   5  12.776  -2.075   3.641
   47   HD23  LEU   5          3HD1      LEU   5  12.790  -0.283   3.843
   48    H    LYS   6           H        LYS   6   8.564   0.053   3.072
   49    HA   LYS   6           HA       LYS   6   6.028  -0.636   4.372
   50    HB2  LYS   6           1HB      LYS   6   7.932   0.723   5.464
   51    HB3  LYS   6           2HB      LYS   6   7.543   2.062   4.394
   52    HG2  LYS   6           1HG      LYS   6   5.211   2.169   5.412
   53    HG3  LYS   6           2HG      LYS   6   5.601   0.792   6.445
   54    HD2  LYS   6           1HD      LYS   6   7.464   2.128   7.524
   55    HD3  LYS   6           2HD      LYS   6   7.080   3.504   6.481
   56    HE2  LYS   6           1HE      LYS   6   4.741   3.609   7.490
   57    HE3  LYS   6           2HE      LYS   6   5.137   2.241   8.540
   58    HZ2  LYS   6           1HZ      LYS   6   6.509   4.872   8.523
   59    HZ3  LYS   6           2HZ      LYS   6   5.429   4.361   9.638
   60    H    GLU   7           H        GLU   7   7.013   1.385   1.627
   61    HA   GLU   7           HA       GLU   7   4.358   2.620   1.196
   62    HB2  GLU   7           2HB      GLU   7   6.593   2.219  -0.904
   63    HB3  GLU   7           1HB      GLU   7   5.157   3.195  -1.141
   64    HG2  GLU   7           2HG      GLU   7   5.870   4.781   0.672
   65    HG3  GLU   7           1HG      GLU   7   7.296   3.801   1.000
   66    HE2  GLU   7           HE2      GLU   7   7.113   6.220  -2.232
   67    H    ASN   8           H        ASN   8   5.776  -0.433  -0.114
   68    HA   ASN   8           HA       ASN   8   3.416  -0.999  -1.732
   69    HB2  ASN   8           1HB      ASN   8   5.579  -2.368  -1.857
   70    HB3  ASN   8           2HB      ASN   8   5.178  -3.086  -0.267
   71   HD21  ASN   8          1HD2      ASN   8   4.145  -5.039  -0.460
   72   HD22  ASN   8          2HD2      ASN   8   3.274  -5.643  -1.957
   73    H    VAL   9           H        VAL   9   4.175  -2.029   1.630
   74    HA   VAL   9           HA       VAL   9   1.634  -3.161   2.222
   75    HB   VAL   9           HB       VAL   9   4.255  -3.015   3.287
   76   HG11  VAL   9          1HG1      VAL   9   4.122  -2.494   5.675
   77   HG12  VAL   9          2HG1      VAL   9   3.677  -1.032   4.777
   78   HG13  VAL   9          3HG1      VAL   9   2.413  -2.009   5.554
   79   HG21  VAL   9          1HG2      VAL   9   1.828  -4.406   4.484
   80   HG22  VAL   9          2HG2      VAL   9   3.559  -4.789   4.768
   81   HG23  VAL   9          3HG2      VAL   9   2.863  -4.981   3.146
   82    H    ASP  10           H        ASP  10   1.850   0.029   1.468
   83    HA   ASP  10           HA       ASP  10  -0.063   1.124   3.390
   84    HB2  ASP  10           2HB      ASP  10   2.340   2.267   3.187
   85    HB3  ASP  10           1HB      ASP  10   1.710   2.789   1.639
   86    HD2  ASP  10           HD2      ASP  10   0.330   4.356   5.097
   87    H    TYR  11           H        TYR  11   1.104   0.572   0.096
   88    HA   TYR  11           HA       TYR  11  -1.025   1.788  -1.461
   89    HB2  TYR  11           1HB      TYR  11   1.422   1.075  -2.206
   90    HB3  TYR  11           2HB      TYR  11   0.718  -0.477  -2.390
   91    HD1  TYR  11           HD1      TYR  11   0.404   3.072  -3.533
   92    HD2  TYR  11           HD2      TYR  11  -0.822  -0.969  -4.279
   93    HE1  TYR  11           HE1      TYR  11  -0.411   3.733  -5.770
   94    HE2  TYR  11           HE2      TYR  11  -1.640  -0.310  -6.513
   95    HH   TYR  11           HH       TYR  11  -1.378   3.060  -7.654
   96    H    ILE  12           H        ILE  12  -0.708  -1.494  -0.174
   97    HA   ILE  12           HA       ILE  12  -2.923  -2.633  -1.745
   98    HB   ILE  12           HB       ILE  12  -1.093  -3.787   0.294
   99   HG12  ILE  12          1HG1      ILE  12  -0.913  -5.684  -1.436
  100   HG13  ILE  12          2HG1      ILE  12  -1.989  -4.784  -2.488
  101   HG21  ILE  12          1HG2      ILE  12  -3.241  -4.657   1.152
  102   HG22  ILE  12          2HG2      ILE  12  -2.334  -5.970   0.398
  103   HG23  ILE  12          3HG2      ILE  12  -3.703  -5.226  -0.471
  104   HD11  ILE  12          1HD1      ILE  12   0.401  -4.573  -3.158
  105   HD12  ILE  12          2HD1      ILE  12  -0.213  -2.971  -2.706
  106   HD13  ILE  12          3HD1      ILE  12   0.827  -3.889  -1.578
  107    H    GLN  13           H        GLN  13  -2.422  -1.717   1.677
  108    HA   GLN  13           HA       GLN  13  -5.195  -1.865   2.396
  109    HB2  GLN  13           2HB      GLN  13  -4.668  -0.632   4.390
  110    HB3  GLN  13           1HB      GLN  13  -3.551  -1.935   4.166
  111    HG2  GLN  13           2HG      GLN  13  -1.859  -0.234   3.271
  112    HG3  GLN  13           1HG      GLN  13  -3.006   1.057   3.592
  113   HE21  GLN  13          1HE2      GLN  13  -1.901   2.132   5.182
  114   HE22  GLN  13          2HE2      GLN  13  -1.366   1.380   6.768
  115    H    LYS  14           H        LYS  14  -3.344   0.744   0.768
  116    HA   LYS  14           HA       LYS  14  -5.427   2.766   1.070
  117    HB2  LYS  14           2HB      LYS  14  -3.091   3.364   0.545
  118    HB3  LYS  14           1HB      LYS  14  -3.220   2.592  -1.045
  119    HG2  LYS  14           1HG      LYS  14  -5.013   4.330  -1.648
  120    HG3  LYS  14           2HG      LYS  14  -4.814   5.033  -0.047
  121    HD2  LYS  14           1HD      LYS  14  -3.557   6.411  -1.531
  122    HD3  LYS  14           2HD      LYS  14  -2.369   5.526  -0.583
  123    HE2  LYS  14           2HE      LYS  14  -2.030   3.915  -2.544
  124    HE3  LYS  14           1HE      LYS  14  -3.251   4.796  -3.471
  125    HZ2  LYS  14           1HZ      LYS  14  -1.850   6.782  -3.281
  126    HZ3  LYS  14           2HZ      LYS  14  -0.722   5.955  -2.436
  127    H    ASN  15           H        ASN  15  -4.760   0.442  -1.557
  128    HA   ASN  15           HA       ASN  15  -6.662   1.219  -3.541
  129    HB2  ASN  15           2HB      ASN  15  -4.757  -0.536  -3.710
  130    HB3  ASN  15           1HB      ASN  15  -5.924  -1.627  -2.923
  131   HD21  ASN  15          1HD2      ASN  15  -5.725  -2.953  -4.776
  132   HD22  ASN  15          2HD2      ASN  15  -6.599  -2.548  -6.340
  133    H    GLN  16           H        GLN  16  -6.970  -1.285  -1.135
  134    HA   GLN  16           HA       GLN  16  -9.697  -2.023  -1.645
  135    HB2  GLN  16           1HB      GLN  16  -9.292  -3.726  -0.159
  136    HB3  GLN  16           2HB      GLN  16  -7.720  -3.399  -0.815
  137    HG2  GLN  16           1HG      GLN  16  -7.180  -2.013   1.292
  138    HG3  GLN  16           2HG      GLN  16  -8.710  -2.510   1.986
  139   HE21  GLN  16          2HE2      GLN  16  -8.924  -4.701   2.686
  140   HE22  GLN  16          1HE2      GLN  16  -7.469  -5.812   2.819
  141    H    ASN  17           H        ASN  17  -8.447   0.331   0.657
  142    HA   ASN  17           HA       ASN  17 -10.973   0.611   2.098
  143    HB2  ASN  17           1HB      ASN  17  -8.553   2.492   2.142
  144    HB3  ASN  17           2HB      ASN  17  -9.983   2.704   3.136
  145   HD21  ASN  17          2HD2      ASN  17  -7.693   2.597   4.397
  146   HD22  ASN  17          1HD2      ASN  17  -7.540   1.022   5.326
  147    H    LEU  18           H        LEU  18  -9.703   2.421  -0.762
  148    HA   LEU  18           HA       LEU  18 -11.556   4.461  -0.875
  149    HB2  LEU  18           2HB      LEU  18 -10.425   2.882  -3.230
  150    HB3  LEU  18           1HB      LEU  18 -11.111   4.488  -3.354
  151    HG   LEU  18           HG       LEU  18  -8.770   3.913  -1.462
  152   HD11  LEU  18          1HD2      LEU  18  -8.491   4.736  -4.402
  153   HD12  LEU  18          2HD2      LEU  18  -7.170   4.589  -3.199
  154   HD13  LEU  18          3HD2      LEU  18  -8.071   3.147  -3.704
  155   HD21  LEU  18          1HD1      LEU  18  -9.702   6.535  -2.678
  156   HD22  LEU  18          2HD1      LEU  18  -8.268   6.285  -1.619
  157   HD23  LEU  18          3HD1      LEU  18  -9.896   5.988  -0.985
  158    H    PHE  19           H        PHE  19 -12.059   1.479  -2.800
  159    HA   PHE  19           HA       PHE  19 -14.861   1.967  -3.218
  160    HB2  PHE  19           1HB      PHE  19 -14.896  -0.244  -4.295
  161    HB3  PHE  19           2HB      PHE  19 -13.743   0.895  -4.942
  162    HD1  PHE  19           HD2      PHE  19 -14.098  -2.335  -3.085
  163    HD2  PHE  19           HD1      PHE  19 -11.310   0.406  -4.884
  164    HE1  PHE  19           HE2      PHE  19 -12.375  -4.092  -3.115
  165    HE2  PHE  19           HE1      PHE  19  -9.615  -1.375  -4.941
  166    HZ   PHE  19           HZ       PHE  19 -10.138  -3.621  -4.055
  167    H    LYS  20           H        LYS  20 -13.386  -0.615  -1.234
  168    HA   LYS  20           HA       LYS  20 -15.945  -1.100   0.163
  169    HB2  LYS  20           2HB      LYS  20 -14.437  -2.923  -0.639
  170    HB3  LYS  20           1HB      LYS  20 -13.345  -2.491   0.671
  171    HG2  LYS  20           2HG      LYS  20 -16.284  -3.353   1.060
  172    HG3  LYS  20           1HG      LYS  20 -14.947  -4.486   0.986
  173    HD2  LYS  20           2HD      LYS  20 -13.879  -3.413   3.001
  174    HD3  LYS  20           1HD      LYS  20 -15.234  -2.308   3.156
  175    HE2  LYS  20           1HE      LYS  20 -15.476  -5.389   3.315
  176    HE3  LYS  20           2HE      LYS  20 -15.308  -4.320   4.705
  177    HZ2  LYS  20           1HZ      LYS  20 -17.549  -4.211   2.767
  178    HZ3  LYS  20           2HZ      LYS  20 -17.375  -3.222   4.056
  Start of MODEL   17
    1    H1   LYS   1           H        LYS   1  16.889  -2.130   0.147
    2    HA   LYS   1           HA       LYS   1  15.170  -0.107   1.260
    3    HB2  LYS   1           1HB      LYS   1  14.643   1.060  -0.993
    4    HB3  LYS   1           2HB      LYS   1  15.981   1.605  -0.015
    5    HG2  LYS   1           1HG      LYS   1  16.716   1.809  -2.215
    6    HG3  LYS   1           2HG      LYS   1  17.639   0.487  -1.530
    7    HD2  LYS   1           2HD      LYS   1  16.279  -1.179  -2.776
    8    HD3  LYS   1           1HD      LYS   1  15.179   0.085  -3.352
    9    HE2  LYS   1           1HE      LYS   1  17.111   1.163  -4.616
   10    HE3  LYS   1           2HE      LYS   1  18.198  -0.106  -4.033
   11    HZ2  LYS   1           1HZ      LYS   1  15.775  -0.564  -5.687
   12    HZ3  LYS   1           2HZ      LYS   1  16.776  -1.738  -5.147
   13    H    MET   2           H        MET   2  14.200  -2.032   1.744
   14    HA   MET   2           HA       MET   2  12.609  -3.307  -0.370
   15    HB2  MET   2           2HB      MET   2  13.503  -5.536  -0.267
   16    HB3  MET   2           1HB      MET   2  14.864  -4.473  -0.519
   17    HG2  MET   2           1HG      MET   2  15.467  -4.656   1.947
   18    HG3  MET   2           2HG      MET   2  14.160  -5.841   2.151
   19    HE1  MET   2           1HE      MET   2  17.260  -6.459   2.811
   20    HE2  MET   2           2HE      MET   2  17.417  -8.100   2.119
   21    HE3  MET   2           3HE      MET   2  15.943  -7.654   3.028
   22    H    ASN   3           H        ASN   3  11.459  -1.892   1.078
   23    HA   ASN   3           HA       ASN   3   9.709  -3.521   2.742
   24    HB2  ASN   3           2HB      ASN   3  11.417  -2.701   4.484
   25    HB3  ASN   3           1HB      ASN   3  10.998  -1.044   4.104
   26   HD21  ASN   3          2HD2      ASN   3   9.115  -0.207   5.076
   27   HD22  ASN   3          1HD2      ASN   3   8.070  -1.178   6.230
   28    H    MET   4           H        MET   4  10.223   0.054   2.149
   29    HA   MET   4           HA       MET   4   7.484   0.376   1.404
   30    HB2  MET   4           2HB      MET   4   9.702   2.276   0.436
   31    HB3  MET   4           1HB      MET   4   8.020   2.658   0.760
   32    HG2  MET   4           2HG      MET   4   8.541   2.094   3.284
   33    HG3  MET   4           1HG      MET   4  10.233   2.098   2.799
   34    HE1  MET   4           1HE      MET   4   9.051   4.115   5.010
   35    HE2  MET   4           2HE      MET   4   9.847   5.644   4.530
   36    HE3  MET   4           3HE      MET   4  10.768   4.111   4.497
   37    H    LEU   5           H        LEU   5   8.829  -1.655  -0.239
   38    HA   LEU   5           HA       LEU   5   8.577  -0.787  -3.078
   39    HB2  LEU   5           2HB      LEU   5   9.427  -3.432  -1.780
   40    HB3  LEU   5           1HB      LEU   5   9.283  -3.208  -3.517
   41    HG   LEU   5           HG       LEU   5  11.251  -1.811  -1.620
   42   HD11  LEU   5          1HD2      LEU   5  11.582  -3.870  -3.884
   43   HD12  LEU   5          2HD2      LEU   5  12.894  -3.207  -2.856
   44   HD13  LEU   5          3HD2      LEU   5  11.616  -4.219  -2.136
   45   HD21  LEU   5          1HD1      LEU   5  10.980  -1.379  -4.670
   46   HD22  LEU   5          2HD1      LEU   5  10.751  -0.152  -3.397
   47   HD23  LEU   5          3HD1      LEU   5  12.358  -0.843  -3.667
   48    H    LYS   6           H        LYS   6   7.425  -3.750  -1.508
   49    HA   LYS   6           HA       LYS   6   4.791  -3.547  -2.730
   50    HB2  LYS   6           2HB      LYS   6   6.029  -5.738  -2.211
   51    HB3  LYS   6           1HB      LYS   6   5.675  -5.500  -0.503
   52    HG2  LYS   6           1HG      LYS   6   3.189  -5.598  -1.026
   53    HG3  LYS   6           2HG      LYS   6   3.558  -5.780  -2.743
   54    HD2  LYS   6           1HD      LYS   6   4.790  -7.940  -2.243
   55    HD3  LYS   6           2HD      LYS   6   4.417  -7.753  -0.526
   56    HE2  LYS   6           1HE      LYS   6   1.929  -7.852  -1.053
   57    HE3  LYS   6           2HE      LYS   6   2.301  -8.035  -2.774
   58    HZ2  LYS   6           1HZ      LYS   6   3.164  -9.908  -0.639
   59    HZ3  LYS   6           2HZ      LYS   6   3.505 -10.076  -2.229
   60    H    GLU   7           H        GLU   7   5.994  -2.642   0.477
   61    HA   GLU   7           HA       GLU   7   3.303  -2.209   1.638
   62    HB2  GLU   7           2HB      GLU   7   5.948  -0.938   2.601
   63    HB3  GLU   7           1HB      GLU   7   4.429  -0.830   3.451
   64    HG2  GLU   7           2HG      GLU   7   5.951  -3.465   2.948
   65    HG3  GLU   7           1HG      GLU   7   6.001  -2.524   4.425
   66    HE2  GLU   7           HE2      GLU   7   2.902  -3.509   5.618
   67    H    ASN   8           H        ASN   8   5.516   0.073  -0.115
   68    HA   ASN   8           HA       ASN   8   3.660   2.299   0.251
   69    HB2  ASN   8           1HB      ASN   8   6.028   2.542  -0.741
   70    HB3  ASN   8           2HB      ASN   8   5.402   1.812  -2.254
   71   HD21  ASN   8          1HD2      ASN   8   5.158   4.640  -0.065
   72   HD22  ASN   8          2HD2      ASN   8   4.596   5.799  -1.372
   73    H    VAL   9           H        VAL   9   3.876  -0.069  -2.447
   74    HA   VAL   9           HA       VAL   9   1.567   0.803  -3.859
   75    HB   VAL   9           HB       VAL   9   3.799  -0.906  -4.177
   76   HG11  VAL   9          1HG2      VAL   9   3.025  -3.081  -5.027
   77   HG12  VAL   9          2HG2      VAL   9   1.326  -2.712  -4.636
   78   HG13  VAL   9          3HG2      VAL   9   2.513  -2.946  -3.335
   79   HG21  VAL   9          1HG1      VAL   9   2.889   0.593  -5.832
   80   HG22  VAL   9          2HG1      VAL   9   1.489  -0.482  -6.113
   81   HG23  VAL   9          3HG1      VAL   9   3.156  -1.029  -6.501
   82    H    ASP  10           H        ASP  10   1.357  -0.438  -0.783
   83    HA   ASP  10           HA       ASP  10  -1.114  -1.993  -1.032
   84    HB2  ASP  10           1HB      ASP  10   0.990  -3.095   0.182
   85    HB3  ASP  10           2HB      ASP  10   0.655  -1.884   1.396
   86    HD2  ASP  10           HD2      ASP  10  -0.562  -4.544  -0.275
   87    H    TYR  11           H        TYR  11   0.787   0.607   0.452
   88    HA   TYR  11           HA       TYR  11  -1.213   1.835   2.152
   89    HB2  TYR  11           2HB      TYR  11   1.436   2.139   2.139
   90    HB3  TYR  11           1HB      TYR  11   1.105   3.313   0.932
   91    HD1  TYR  11           HD1      TYR  11   0.208   2.373   4.448
   92    HD2  TYR  11           HD2      TYR  11   0.122   5.506   1.524
   93    HE1  TYR  11           HE1      TYR  11  -0.328   4.011   6.221
   94    HE2  TYR  11           HE2      TYR  11  -0.414   7.145   3.292
   95    HH   TYR  11           HH       TYR  11  -0.773   6.135   6.695
   96    H    ILE  12           H        ILE  12  -0.421   2.455  -1.236
   97    HA   ILE  12           HA       ILE  12  -2.069   4.890  -1.466
   98    HB   ILE  12           HB       ILE  12  -0.311   3.460  -3.389
   99   HG12  ILE  12          2HG1      ILE  12   0.501   5.828  -3.900
  100   HG13  ILE  12          1HG1      ILE  12  -0.618   6.451  -2.702
  101   HG21  ILE  12          1HG2      ILE  12  -2.317   3.720  -4.813
  102   HG22  ILE  12          2HG2      ILE  12  -2.440   5.445  -4.388
  103   HG23  ILE  12          3HG2      ILE  12  -1.063   4.842  -5.347
  104   HD11  ILE  12          1HD1      ILE  12   1.761   4.560  -2.128
  105   HD12  ILE  12          2HD1      ILE  12   0.692   5.267  -0.883
  106   HD13  ILE  12          3HD1      ILE  12   1.735   6.315  -1.863
  107    H    GLN  13           H        GLN  13  -2.252   1.552  -2.739
  108    HA   GLN  13           HA       GLN  13  -4.985   1.569  -3.477
  109    HB2  GLN  13           2HB      GLN  13  -3.481  -0.842  -2.488
  110    HB3  GLN  13           1HB      GLN  13  -5.013  -0.838  -3.287
  111    HG2  GLN  13           1HG      GLN  13  -4.016   0.224  -5.354
  112    HG3  GLN  13           2HG      GLN  13  -2.430   0.145  -4.614
  113   HE21  GLN  13          1HE2      GLN  13  -4.833  -1.653  -6.306
  114   HE22  GLN  13          2HE2      GLN  13  -3.920  -3.245  -6.335
  115    H    LYS  14           H        LYS  14  -3.613   1.193  -0.189
  116    HA   LYS  14           HA       LYS  14  -6.141   0.395   1.045
  117    HB2  LYS  14           1HB      LYS  14  -3.978  -0.124   2.072
  118    HB3  LYS  14           2HB      LYS  14  -3.647   1.593   2.367
  119    HG2  LYS  14           1HG      LYS  14  -5.616   1.666   3.929
  120    HG3  LYS  14           2HG      LYS  14  -5.980  -0.023   3.598
  121    HD2  LYS  14           2HD      LYS  14  -3.366   1.023   4.881
  122    HD3  LYS  14           1HD      LYS  14  -4.762   0.436   5.775
  123    HE2  LYS  14           2HE      LYS  14  -4.504  -1.861   4.702
  124    HE3  LYS  14           1HE      LYS  14  -3.066  -1.291   3.844
  125    HZ2  LYS  14           1HZ      LYS  14  -2.053  -0.802   5.999
  126    HZ3  LYS  14           2HZ      LYS  14  -3.379  -1.337   6.793
  127    H    ASN  15           H        ASN  15  -4.546   3.577   0.751
  128    HA   ASN  15           HA       ASN  15  -6.279   5.263   2.271
  129    HB2  ASN  15           2HB      ASN  15  -4.002   5.818   1.114
  130    HB3  ASN  15           1HB      ASN  15  -5.012   6.079  -0.330
  131   HD21  ASN  15          1HD2      ASN  15  -4.185   8.224  -0.322
  132   HD22  ASN  15          2HD2      ASN  15  -4.853   9.492   0.826
  133    H    GLN  16           H        GLN  16  -6.339   4.654  -1.162
  134    HA   GLN  16           HA       GLN  16  -8.817   6.031  -1.738
  135    HB2  GLN  16           1HB      GLN  16  -8.197   5.741  -3.946
  136    HB3  GLN  16           2HB      GLN  16  -6.676   5.816  -3.114
  137    HG2  GLN  16           2HG      GLN  16  -6.573   3.232  -3.192
  138    HG3  GLN  16           1HG      GLN  16  -8.015   3.237  -4.182
  139   HE21  GLN  16          2HE2      GLN  16  -7.830   3.907  -6.370
  140   HE22  GLN  16          1HE2      GLN  16  -6.197   4.183  -7.160
  141    H    ASN  17           H        ASN  17  -8.298   2.676  -0.855
  142    HA   ASN  17           HA       ASN  17 -11.203   2.147  -1.097
  143    HB2  ASN  17           1HB      ASN  17  -9.199   0.252  -2.456
  144    HB3  ASN  17           2HB      ASN  17 -10.842  -0.193  -2.070
  145   HD21  ASN  17          2HD2      ASN  17 -12.607   1.101  -3.104
  146   HD22  ASN  17          1HD2      ASN  17 -12.287   1.721  -4.801
  147    H    LEU  18           H        LEU  18  -9.999   2.683   1.318
  148    HA   LEU  18           HA       LEU  18  -9.113   0.920   2.941
  149    HB2  LEU  18           1HB      LEU  18 -11.618   2.587   3.529
  150    HB3  LEU  18           2HB      LEU  18 -10.588   1.933   4.777
  151    HG   LEU  18           HG       LEU  18  -9.387   3.756   2.621
  152   HD11  LEU  18          1HD2      LEU  18 -11.315   5.002   3.507
  153   HD12  LEU  18          2HD2      LEU  18  -9.786   5.735   4.029
  154   HD13  LEU  18          3HD2      LEU  18 -10.746   4.756   5.181
  155   HD21  LEU  18          1HD1      LEU  18  -7.674   4.248   4.276
  156   HD22  LEU  18          2HD1      LEU  18  -7.816   2.488   4.097
  157   HD23  LEU  18          3HD1      LEU  18  -8.524   3.282   5.526
  158    H    PHE  19           H        PHE  19 -12.494   0.600   1.972
  159    HA   PHE  19           HA       PHE  19 -13.234  -1.517   3.787
  160    HB2  PHE  19           2HB      PHE  19 -15.300  -1.630   2.364
  161    HB3  PHE  19           1HB      PHE  19 -14.958  -0.032   2.952
  162    HD1  PHE  19           HD2      PHE  19 -15.116  -2.203  -0.079
  163    HD2  PHE  19           HD1      PHE  19 -14.257   1.783   1.298
  164    HE1  PHE  19           HE2      PHE  19 -15.261  -1.364  -2.388
  165    HE2  PHE  19           HE1      PHE  19 -14.405   2.601  -1.015
  166    HZ   PHE  19           HZ       PHE  19 -14.910   1.036  -2.859
  167    H    LYS  20           H        LYS  20 -14.340  -3.692   2.646
  168    HA   LYS  20           HA       LYS  20 -12.109  -5.181   1.474
  169    HB2  LYS  20           1HB      LYS  20 -13.484  -6.068   3.309
  170    HB3  LYS  20           2HB      LYS  20 -14.858  -6.106   2.198
  171    HG2  LYS  20           1HG      LYS  20 -13.618  -7.768   0.740
  172    HG3  LYS  20           2HG      LYS  20 -12.233  -7.685   1.830
  173    HD2  LYS  20           1HD      LYS  20 -13.670  -8.550   3.722
  174    HD3  LYS  20           2HD      LYS  20 -15.061  -8.646   2.655
  175    HE2  LYS  20           2HE      LYS  20 -12.427 -10.236   2.256
  176    HE3  LYS  20           1HE      LYS  20 -13.853 -10.853   3.085
  177    HZ2  LYS  20           1HZ      LYS  20 -13.808  -9.989   0.250
  178    HZ3  LYS  20           2HZ      LYS  20 -15.120 -10.565   1.037
  Start of MODEL   18
    1    H1   LYS   1           H        LYS   1  16.927  -3.077   0.255
    2    HA   LYS   1           HA       LYS   1  15.412  -0.801   1.245
    3    HB2  LYS   1           1HB      LYS   1  14.382  -0.123  -0.868
    4    HB3  LYS   1           2HB      LYS   1  16.014   0.452  -0.695
    5    HG2  LYS   1           2HG      LYS   1  15.449  -2.071  -2.373
    6    HG3  LYS   1           1HG      LYS   1  15.099  -0.472  -3.008
    7    HD2  LYS   1           1HD      LYS   1  17.499   0.226  -2.667
    8    HD3  LYS   1           2HD      LYS   1  17.885  -1.386  -2.062
    9    HE2  LYS   1           1HE      LYS   1  17.172  -2.401  -4.279
   10    HE3  LYS   1           2HE      LYS   1  16.791  -0.786  -4.894
   11    HZ2  LYS   1           1HZ      LYS   1  18.970  -1.463  -5.571
   12    HZ3  LYS   1           2HZ      LYS   1  19.096  -0.163  -4.589
   13    H    MET   2           H        MET   2  13.710  -2.068  -0.950
   14    HA   MET   2           HA       MET   2  12.120  -3.887  -1.141
   15    HB2  MET   2           1HB      MET   2  14.684  -5.257  -0.150
   16    HB3  MET   2           2HB      MET   2  13.232  -6.212  -0.188
   17    HG2  MET   2           1HG      MET   2  14.320  -4.655  -2.617
   18    HG3  MET   2           2HG      MET   2  14.604  -6.376  -2.295
   19    HE1  MET   2           1HE      MET   2  13.592  -6.796  -4.808
   20    HE2  MET   2           2HE      MET   2  11.942  -6.296  -5.288
   21    HE3  MET   2           3HE      MET   2  13.195  -5.057  -4.985
   22    H    ASN   3           H        ASN   3  11.259  -2.304   0.443
   23    HA   ASN   3           HA       ASN   3   9.545  -3.786   2.194
   24    HB2  ASN   3           2HB      ASN   3   9.916  -2.787   4.419
   25    HB3  ASN   3           1HB      ASN   3  11.260  -3.767   3.924
   26   HD21  ASN   3          1HD2      ASN   3  10.486  -0.847   5.310
   27   HD22  ASN   3          2HD2      ASN   3  12.114  -0.027   5.095
   28    H    MET   4           H        MET   4  10.517  -0.265   2.234
   29    HA   MET   4           HA       MET   4   7.788   0.488   1.798
   30    HB2  MET   4           2HB      MET   4  10.157   2.313   1.075
   31    HB3  MET   4           1HB      MET   4   8.553   2.790   1.605
   32    HG2  MET   4           1HG      MET   4   9.145   1.632   3.902
   33    HG3  MET   4           2HG      MET   4  10.793   1.578   3.309
   34    HE1  MET   4           1HE      MET   4  12.450   3.571   3.386
   35    HE2  MET   4           2HE      MET   4  11.960   5.283   3.225
   36    HE3  MET   4           3HE      MET   4  11.660   4.141   1.882
   37    H    LEU   5           H        LEU   5   8.871  -1.230  -0.331
   38    HA   LEU   5           HA       LEU   5   8.343   0.262  -2.871
   39    HB2  LEU   5           1HB      LEU   5   9.484  -2.542  -2.469
   40    HB3  LEU   5           2HB      LEU   5   9.238  -1.767  -4.024
   41    HG   LEU   5           HG       LEU   5  11.168  -0.837  -1.799
   42   HD11  LEU   5          1HD2      LEU   5  11.749  -2.062  -4.537
   43   HD12  LEU   5          2HD2      LEU   5  11.707  -2.964  -3.005
   44   HD13  LEU   5          3HD2      LEU   5  12.919  -1.675  -3.219
   45   HD21  LEU   5          1HD1      LEU   5  10.455   1.192  -3.056
   46   HD22  LEU   5          2HD1      LEU   5  10.798   0.394  -4.613
   47   HD23  LEU   5          3HD1      LEU   5  12.124   0.776  -3.478
   48    H    LYS   6           H        LYS   6   7.668  -3.013  -1.675
   49    HA   LYS   6           HA       LYS   6   4.979  -3.112  -2.730
   50    HB2  LYS   6           2HB      LYS   6   4.722  -5.292  -1.590
   51    HB3  LYS   6           1HB      LYS   6   6.258  -5.185  -2.426
   52    HG2  LYS   6           2HG      LYS   6   7.403  -4.685  -0.183
   53    HG3  LYS   6           1HG      LYS   6   5.852  -4.909   0.624
   54    HD2  LYS   6           1HD      LYS   6   5.727  -7.270  -0.247
   55    HD3  LYS   6           2HD      LYS   6   7.264  -7.076  -1.076
   56    HE2  LYS   6           1HE      LYS   6   6.881  -6.859   1.994
   57    HE3  LYS   6           2HE      LYS   6   7.387  -8.317   1.145
   58    HZ2  LYS   6           1HZ      LYS   6   9.253  -7.108   2.042
   59    HZ3  LYS   6           2HZ      LYS   6   8.885  -5.760   1.194
   60    H    GLU   7           H        GLU   7   6.143  -2.131   0.455
   61    HA   GLU   7           HA       GLU   7   3.425  -1.945   1.653
   62    HB2  GLU   7           1HB      GLU   7   6.042  -0.626   2.631
   63    HB3  GLU   7           2HB      GLU   7   4.509  -0.525   3.478
   64    HG2  GLU   7           1HG      GLU   7   4.444  -3.017   3.792
   65    HG3  GLU   7           2HG      GLU   7   5.963  -3.189   2.920
   66    HE2  GLU   7           HE2      GLU   7   4.436  -2.174   5.709
   67    H    ASN   8           H        ASN   8   5.567   0.498   0.029
   68    HA   ASN   8           HA       ASN   8   3.632   2.643   0.351
   69    HB2  ASN   8           2HB      ASN   8   5.969   2.987  -0.642
   70    HB3  ASN   8           1HB      ASN   8   5.411   2.180  -2.144
   71   HD21  ASN   8          2HD2      ASN   8   5.002   5.060  -0.046
   72   HD22  ASN   8          1HD2      ASN   8   4.421   6.155  -1.399
   73    H    VAL   9           H        VAL   9   3.892   0.317  -2.389
   74    HA   VAL   9           HA       VAL   9   1.553   1.161  -3.766
   75    HB   VAL   9           HB       VAL   9   3.809  -0.497  -4.136
   76   HG11  VAL   9          1HG2      VAL   9   2.589  -2.573  -3.296
   77   HG12  VAL   9          2HG2      VAL   9   3.063  -2.681  -5.001
   78   HG13  VAL   9          3HG2      VAL   9   1.366  -2.352  -4.567
   79   HG21  VAL   9          1HG1      VAL   9   3.132  -0.613  -6.451
   80   HG22  VAL   9          2HG1      VAL   9   1.460  -0.106  -6.031
   81   HG23  VAL   9          3HG1      VAL   9   2.841   0.997  -5.760
   82    H    ASP  10           H        ASP  10   1.426  -0.204  -0.720
   83    HA   ASP  10           HA       ASP  10  -1.008  -1.813  -0.988
   84    HB2  ASP  10           2HB      ASP  10   1.127  -2.877   0.200
   85    HB3  ASP  10           1HB      ASP  10   0.770  -1.690   1.434
   86    HD2  ASP  10           HD2      ASP  10  -1.570  -4.941   0.928
   87    H    TYR  11           H        TYR  11   0.797   0.860   0.475
   88    HA   TYR  11           HA       TYR  11  -1.233   1.974   2.231
   89    HB2  TYR  11           2HB      TYR  11   1.397   2.380   2.214
   90    HB3  TYR  11           1HB      TYR  11   1.025   3.543   1.010
   91    HD1  TYR  11           HD2      TYR  11   0.172   2.573   4.527
   92    HD2  TYR  11           HD1      TYR  11  -0.045   5.696   1.600
   93    HE1  TYR  11           HE2      TYR  11  -0.417   4.192   6.300
   94    HE2  TYR  11           HE1      TYR  11  -0.634   7.317   3.369
   95    HH   TYR  11           HH       TYR  11  -0.939   6.299   6.774
   96    H    ILE  12           H        ILE  12  -0.468   2.674  -1.152
   97    HA   ILE  12           HA       ILE  12  -2.241   5.021  -1.351
   98    HB   ILE  12           HB       ILE  12  -0.418   3.712  -3.305
   99   HG12  ILE  12          2HG1      ILE  12   0.286   6.144  -3.753
  100   HG13  ILE  12          1HG1      ILE  12  -0.822   6.661  -2.496
  101   HG21  ILE  12          1HG2      ILE  12  -2.613   5.657  -4.233
  102   HG22  ILE  12          2HG2      ILE  12  -1.227   5.118  -5.218
  103   HG23  ILE  12          3HG2      ILE  12  -2.447   3.948  -4.706
  104   HD11  ILE  12          1HD1      ILE  12   1.557   6.582  -1.730
  105   HD12  ILE  12          2HD1      ILE  12   1.651   4.847  -2.092
  106   HD13  ILE  12          3HD1      ILE  12   0.594   5.437  -0.778
  107    H    GLN  13           H        GLN  13  -2.238   1.694  -2.673
  108    HA   GLN  13           HA       GLN  13  -4.969   1.600  -3.421
  109    HB2  GLN  13           2HB      GLN  13  -3.339  -0.758  -2.497
  110    HB3  GLN  13           1HB      GLN  13  -4.890  -0.820  -3.250
  111    HG2  GLN  13           2HG      GLN  13  -4.037   0.289  -5.331
  112    HG3  GLN  13           1HG      GLN  13  -2.424   0.356  -4.648
  113   HE21  GLN  13          2HE2      GLN  13  -1.135  -1.389  -5.160
  114   HE22  GLN  13          1HE2      GLN  13  -1.756  -3.005  -5.769
  115    H    LYS  14           H        LYS  14  -3.595   1.243  -0.128
  116    HA   LYS  14           HA       LYS  14  -6.080   0.296   1.078
  117    HB2  LYS  14           2HB      LYS  14  -3.927  -0.077   2.161
  118    HB3  LYS  14           1HB      LYS  14  -3.685   1.661   2.422
  119    HG2  LYS  14           2HG      LYS  14  -5.676   1.669   3.954
  120    HG3  LYS  14           1HG      LYS  14  -5.952  -0.044   3.655
  121    HD2  LYS  14           2HD      LYS  14  -3.411   1.160   4.950
  122    HD3  LYS  14           1HD      LYS  14  -4.789   0.525   5.839
  123    HE2  LYS  14           2HE      LYS  14  -4.404  -1.780   4.824
  124    HE3  LYS  14           1HE      LYS  14  -2.982  -1.160   3.972
  125    HZ2  LYS  14           1HZ      LYS  14  -2.026  -0.572   6.127
  126    HZ3  LYS  14           2HZ      LYS  14  -3.335  -1.152   6.916
  127    H    ASN  15           H        ASN  15  -4.687   3.580   0.834
  128    HA   ASN  15           HA       ASN  15  -6.643   5.110   2.260
  129    HB2  ASN  15           1HB      ASN  15  -4.325   5.804   1.392
  130    HB3  ASN  15           2HB      ASN  15  -5.121   6.037  -0.150
  131   HD21  ASN  15          1HD2      ASN  15  -4.411   8.227  -0.021
  132   HD22  ASN  15          2HD2      ASN  15  -5.296   9.448   1.026
  133    H    GLN  16           H        GLN  16  -6.440   4.458  -1.203
  134    HA   GLN  16           HA       GLN  16  -8.796   5.765  -2.142
  135    HB2  GLN  16           2HB      GLN  16  -6.809   5.348  -3.456
  136    HB3  GLN  16           1HB      GLN  16  -6.754   3.643  -3.043
  137    HG2  GLN  16           1HG      GLN  16  -7.282   3.713  -5.229
  138    HG3  GLN  16           2HG      GLN  16  -8.697   3.135  -4.360
  139   HE21  GLN  16          1HE2      GLN  16  -7.418   5.768  -6.320
  140   HE22  GLN  16          2HE2      GLN  16  -9.029   6.599  -6.602
  141    H    ASN  17           H        ASN  17  -8.348   2.401  -1.088
  142    HA   ASN  17           HA       ASN  17 -11.286   1.940  -1.179
  143    HB2  ASN  17           2HB      ASN  17 -11.201  -0.257  -2.231
  144    HB3  ASN  17           1HB      ASN  17 -10.797   1.049  -3.300
  145   HD21  ASN  17          2HD2      ASN  17  -8.834   0.949  -4.397
  146   HD22  ASN  17          1HD2      ASN  17  -7.642  -0.431  -4.192
  147    H    LEU  18           H        LEU  18 -10.068   2.495   1.205
  148    HA   LEU  18           HA       LEU  18  -9.246   0.743   2.886
  149    HB2  LEU  18           1HB      LEU  18 -11.725   2.470   3.411
  150    HB3  LEU  18           2HB      LEU  18 -10.725   1.814   4.682
  151    HG   LEU  18           HG       LEU  18  -9.461   3.577   2.514
  152   HD11  LEU  18          1HD2      LEU  18  -9.851   5.593   3.869
  153   HD12  LEU  18          2HD2      LEU  18 -11.382   4.874   3.332
  154   HD13  LEU  18          3HD2      LEU  18 -10.851   4.658   5.023
  155   HD21  LEU  18          1HD1      LEU  18  -7.941   2.314   4.041
  156   HD22  LEU  18          2HD1      LEU  18  -8.664   3.142   5.443
  157   HD23  LEU  18          3HD1      LEU  18  -7.772   4.074   4.197
  158    H    PHE  19           H        PHE  19 -12.750   0.735   2.301
  159    HA   PHE  19           HA       PHE  19 -13.253  -1.823   3.624
  160    HB2  PHE  19           2HB      PHE  19 -15.604  -1.311   3.005
  161    HB3  PHE  19           1HB      PHE  19 -14.802  -0.114   3.994
  162    HD1  PHE  19           HD2      PHE  19 -14.239   2.175   3.035
  163    HD2  PHE  19           HD1      PHE  19 -16.407  -0.718   0.695
  164    HE1  PHE  19           HE2      PHE  19 -14.998   3.950   1.519
  165    HE2  PHE  19           HE1      PHE  19 -17.149   1.075  -0.813
  166    HZ   PHE  19           HZ       PHE  19 -16.448   3.409  -0.407
  167    H    LYS  20           H        LYS  20 -11.463  -2.611   1.708
  168    HA   LYS  20           HA       LYS  20 -12.635  -3.425  -0.784
  169    HB2  LYS  20           2HB      LYS  20 -10.210  -2.970  -0.307
  170    HB3  LYS  20           1HB      LYS  20 -10.170  -4.547   0.485
  171    HG2  LYS  20           1HG      LYS  20 -10.895  -5.605  -1.749
  172    HG3  LYS  20           2HG      LYS  20 -10.859  -3.993  -2.467
  173    HD2  LYS  20           1HD      LYS  20  -8.347  -3.848  -1.786
  174    HD3  LYS  20           2HD      LYS  20  -8.474  -5.504  -1.226
  175    HE2  LYS  20           2HE      LYS  20  -7.492  -5.626  -3.408
  176    HE3  LYS  20           1HE      LYS  20  -9.134  -6.237  -3.598
  177    HZ2  LYS  20           1HZ      LYS  20  -8.184  -3.503  -4.286
  178    HZ3  LYS  20           2HZ      LYS  20  -8.503  -4.704  -5.348
  Start of MODEL   19
    1    H1   LYS   1           H        LYS   1  17.685  -0.195  -0.534
    2    HA   LYS   1           HA       LYS   1  15.803   1.973  -0.280
    3    HB2  LYS   1           1HB      LYS   1  15.044   1.896  -2.764
    4    HB3  LYS   1           2HB      LYS   1  16.327   2.967  -2.275
    5    HG2  LYS   1           1HG      LYS   1  16.937   2.165  -4.390
    6    HG3  LYS   1           2HG      LYS   1  18.068   1.461  -3.250
    7    HD2  LYS   1           1HD      LYS   1  16.897  -0.742  -3.390
    8    HD3  LYS   1           2HD      LYS   1  15.643  -0.045  -4.428
    9    HE2  LYS   1           1HE      LYS   1  17.406   0.456  -6.197
   10    HE3  LYS   1           2HE      LYS   1  18.652  -0.239  -5.150
   11    HZ2  LYS   1           1HZ      LYS   1  17.435  -2.345  -5.215
   12    HZ3  LYS   1           2HZ      LYS   1  16.284  -1.702  -6.181
   13    H    MET   2           H        MET   2  15.300   0.306   1.171
   14    HA   MET   2           HA       MET   2  13.628  -1.851   0.006
   15    HB2  MET   2           1HB      MET   2  14.781  -3.654   1.113
   16    HB3  MET   2           2HB      MET   2  15.974  -2.770   0.198
   17    HG2  MET   2           2HG      MET   2  15.654  -2.471   3.257
   18    HG3  MET   2           1HG      MET   2  16.778  -3.569   2.445
   19    HE1  MET   2           1HE      MET   2  17.619  -1.250   4.581
   20    HE2  MET   2           2HE      MET   2  19.112  -0.652   3.798
   21    HE3  MET   2           3HE      MET   2  18.777  -2.409   3.853
   22    H    ASN   3           H        ASN   3  12.498   0.168   0.834
   23    HA   ASN   3           HA       ASN   3  11.023  -0.688   3.251
   24    HB2  ASN   3           2HB      ASN   3  12.020   2.237   2.964
   25    HB3  ASN   3           1HB      ASN   3  10.773   1.735   4.083
   26   HD21  ASN   3          1HD2      ASN   3  14.156   2.005   3.664
   27   HD22  ASN   3          2HD2      ASN   3  14.621   1.240   5.266
   28    H    MET   4           H        MET   4  10.900   2.054   0.841
   29    HA   MET   4           HA       MET   4   8.093   1.653   0.479
   30    HB2  MET   4           1HB      MET   4   9.871   2.972  -1.657
   31    HB3  MET   4           2HB      MET   4   8.179   3.290  -1.313
   32    HG2  MET   4           1HG      MET   4   8.990   4.198   1.030
   33    HG3  MET   4           2HG      MET   4  10.611   4.125   0.349
   34    HE1  MET   4           1HE      MET   4   9.727   7.988   0.088
   35    HE2  MET   4           2HE      MET   4   9.237   6.860   1.386
   36    HE3  MET   4           3HE      MET   4  10.893   6.782   0.707
   37    H    LEU   5           H        LEU   5   9.629  -0.791  -0.092
   38    HA   LEU   5           HA       LEU   5   8.938  -1.574  -2.887
   39    HB2  LEU   5           2HB      LEU   5  10.464  -3.033  -0.665
   40    HB3  LEU   5           1HB      LEU   5  10.117  -3.735  -2.239
   41    HG   LEU   5           HG       LEU   5  11.900  -1.305  -1.640
   42   HD11  LEU   5          1HD2      LEU   5  13.694  -2.860  -2.319
   43   HD12  LEU   5          2HD2      LEU   5  12.722  -3.571  -1.003
   44   HD13  LEU   5          3HD2      LEU   5  12.484  -4.139  -2.676
   45   HD21  LEU   5          1HD1      LEU   5  10.889  -0.866  -3.868
   46   HD22  LEU   5          2HD1      LEU   5  12.580  -1.351  -4.068
   47   HD23  LEU   5          3HD1      LEU   5  11.273  -2.518  -4.415
   48    H    LYS   6           H        LYS   6   8.643  -3.349   0.170
   49    HA   LYS   6           HA       LYS   6   5.949  -4.275  -0.414
   50    HB2  LYS   6           1HB      LYS   6   7.542  -4.401   2.234
   51    HB3  LYS   6           2HB      LYS   6   5.969  -5.153   2.024
   52    HG2  LYS   6           1HG      LYS   6   6.857  -6.580   0.150
   53    HG3  LYS   6           2HG      LYS   6   8.459  -5.894   0.359
   54    HD2  LYS   6           1HD      LYS   6   6.904  -7.476   2.504
   55    HD3  LYS   6           2HD      LYS   6   8.102  -8.172   1.438
   56    HE2  LYS   6           1HE      LYS   6   8.703  -5.985   3.548
   57    HE3  LYS   6           2HE      LYS   6   8.953  -7.712   3.768
   58    HZ2  LYS   6           1HZ      LYS   6  10.549  -7.703   1.975
   59    HZ3  LYS   6           2HZ      LYS   6  10.981  -6.649   3.148
   60    H    GLU   7           H        GLU   7   7.104  -1.506   1.462
   61    HA   GLU   7           HA       GLU   7   4.444  -0.905   2.634
   62    HB2  GLU   7           1HB      GLU   7   6.826   1.030   2.310
   63    HB3  GLU   7           2HB      GLU   7   5.351   1.422   3.156
   64    HG2  GLU   7           2HG      GLU   7   7.300  -0.810   4.015
   65    HG3  GLU   7           1HG      GLU   7   7.251   0.810   4.679
   66    HE2  GLU   7           HE2      GLU   7   4.430   0.346   6.638
   67    H    ASN   8           H        ASN   8   6.043   0.251  -0.412
   68    HA   ASN   8           HA       ASN   8   3.791   1.986  -1.072
   69    HB2  ASN   8           1HB      ASN   8   5.979   1.950  -2.396
   70    HB3  ASN   8           2HB      ASN   8   5.490   0.365  -3.090
   71   HD21  ASN   8          1HD2      ASN   8   4.547   0.602  -5.084
   72   HD22  ASN   8          2HD2      ASN   8   3.793   2.142  -5.734
   73    H    VAL   9           H        VAL   9   4.336  -1.453  -1.981
   74    HA   VAL   9           HA       VAL   9   1.827  -1.873  -3.253
   75    HB   VAL   9           HB       VAL   9   4.327  -3.144  -2.902
   76   HG11  VAL   9          1HG1      VAL   9   3.949  -5.487  -2.248
   77   HG12  VAL   9          2HG1      VAL   9   2.238  -5.176  -1.859
   78   HG13  VAL   9          3HG1      VAL   9   3.526  -4.456  -0.869
   79   HG21  VAL   9          1HG2      VAL   9   3.051  -3.019  -4.943
   80   HG22  VAL   9          2HG2      VAL   9   3.595  -4.677  -4.618
   81   HG23  VAL   9          3HG2      VAL   9   1.877  -4.227  -4.347
   82    H    ASP  10           H        ASP  10   2.070  -1.156  -0.005
   83    HA   ASP  10           HA       ASP  10  -0.051  -2.878   1.056
   84    HB2  ASP  10           2HB      ASP  10   2.286  -2.778   2.322
   85    HB3  ASP  10           1HB      ASP  10   1.791  -1.140   2.681
   86    HD2  ASP  10           HD2      ASP  10   0.188  -0.767   3.971
   87    H    TYR  11           H        TYR  11   1.332   0.331   0.462
   88    HA   TYR  11           HA       TYR  11  -0.792   2.021   1.499
   89    HB2  TYR  11           2HB      TYR  11   1.731   2.636   0.898
   90    HB3  TYR  11           1HB      TYR  11   1.111   2.823  -0.690
   91    HD1  TYR  11           HD1      TYR  11   0.593   4.000   2.828
   92    HD2  TYR  11           HD2      TYR  11  -0.295   4.771  -1.293
   93    HE1  TYR  11           HE1      TYR  11  -0.188   6.270   3.423
   94    HE2  TYR  11           HE2      TYR  11  -1.077   7.039  -0.703
   95    HH   TYR  11           HH       TYR  11  -1.423   8.504   0.931
   96    H    ILE  12           H        ILE  12  -0.301   0.677  -1.733
   97    HA   ILE  12           HA       ILE  12  -2.436   2.253  -3.022
   98    HB   ILE  12           HB       ILE  12  -0.497   0.259  -4.071
   99   HG12  ILE  12          2HG1      ILE  12  -0.222   2.000  -5.927
  100   HG13  ILE  12          1HG1      ILE  12  -1.380   3.027  -5.104
  101   HG21  ILE  12          1HG2      ILE  12  -1.602   0.147  -6.323
  102   HG22  ILE  12          2HG2      ILE  12  -3.030   0.984  -5.659
  103   HG23  ILE  12          3HG2      ILE  12  -2.574  -0.634  -5.074
  104   HD11  ILE  12          1HD1      ILE  12   0.245   3.283  -3.173
  105   HD12  ILE  12          2HD1      ILE  12   1.367   2.154  -3.983
  106   HD13  ILE  12          3HD1      ILE  12   0.991   3.724  -4.721
  107    H    GLN  13           H        GLN  13  -1.940  -1.183  -2.171
  108    HA   GLN  13           HA       GLN  13  -4.638  -2.017  -2.362
  109    HB2  GLN  13           1HB      GLN  13  -2.595  -3.169  -0.476
  110    HB3  GLN  13           2HB      GLN  13  -4.139  -3.838  -0.842
  111    HG2  GLN  13           1HG      GLN  13  -3.578  -4.084  -3.272
  112    HG3  GLN  13           2HG      GLN  13  -1.979  -3.425  -2.982
  113   HE21  GLN  13          2HE2      GLN  13  -0.468  -5.032  -2.825
  114   HE22  GLN  13          1HE2      GLN  13  -0.783  -6.729  -2.200
  115    H    LYS  14           H        LYS  14  -3.092  -0.227   0.338
  116    HA   LYS  14           HA       LYS  14  -5.356  -0.557   2.158
  117    HB2  LYS  14           1HB      LYS  14  -3.098  -0.023   2.976
  118    HB3  LYS  14           2HB      LYS  14  -3.173   1.592   2.243
  119    HG2  LYS  14           2HG      LYS  14  -5.147   2.096   3.782
  120    HG3  LYS  14           1HG      LYS  14  -5.000   0.490   4.484
  121    HD2  LYS  14           2HD      LYS  14  -2.865   2.719   4.564
  122    HD3  LYS  14           1HD      LYS  14  -3.964   2.340   5.870
  123    HE2  LYS  14           1HE      LYS  14  -1.751   0.446   4.818
  124    HE3  LYS  14           2HE      LYS  14  -1.637   1.471   6.241
  125    HZ2  LYS  14           1HZ      LYS  14  -2.202  -0.749   6.858
  126    HZ3  LYS  14           2HZ      LYS  14  -3.435   0.247   7.259
  127    H    ASN  15           H        ASN  15  -4.507   2.047  -0.125
  128    HA   ASN  15           HA       ASN  15  -6.447   4.051   0.455
  129    HB2  ASN  15           1HB      ASN  15  -4.452   4.096  -1.232
  130    HB3  ASN  15           2HB      ASN  15  -5.607   3.307  -2.334
  131   HD21  ASN  15          1HD2      ASN  15  -5.275   5.121  -3.712
  132   HD22  ASN  15          2HD2      ASN  15  -6.117   6.719  -3.388
  133    H    GLN  16           H        GLN  16  -6.651   1.496  -1.903
  134    HA   GLN  16           HA       GLN  16  -9.369   1.967  -2.737
  135    HB2  GLN  16           1HB      GLN  16  -8.915   0.443  -4.403
  136    HB3  GLN  16           2HB      GLN  16  -7.383   1.201  -4.093
  137    HG2  GLN  16           2HG      GLN  16  -6.660  -0.829  -2.711
  138    HG3  GLN  16           1HG      GLN  16  -8.182  -1.615  -3.088
  139   HE21  GLN  16          2HE2      GLN  16  -5.061  -0.725  -4.366
  140   HE22  GLN  16          1HE2      GLN  16  -5.253  -1.628  -5.952
  141    H    ASN  17           H        ASN  17  -8.137  -0.297  -0.320
  142    HA   ASN  17           HA       ASN  17 -10.623  -1.816  -0.177
  143    HB2  ASN  17           2HB      ASN  17  -9.760  -3.105   1.606
  144    HB3  ASN  17           1HB      ASN  17  -8.553  -2.927   0.364
  145   HD21  ASN  17          2HD2      ASN  17  -7.056  -3.684   1.921
  146   HD22  ASN  17          1HD2      ASN  17  -6.420  -2.592   3.251
  147    H    LEU  18           H        LEU  18  -9.570   1.025   1.725
  148    HA   LEU  18           HA       LEU  18 -11.352   1.011   3.781
  149    HB2  LEU  18           1HB      LEU  18 -10.578   3.456   2.120
  150    HB3  LEU  18           2HB      LEU  18 -11.200   3.541   3.755
  151    HG   LEU  18           HG       LEU  18  -8.692   1.901   3.119
  152   HD11  LEU  18          1HD2      LEU  18  -7.266   3.819   3.687
  153   HD12  LEU  18          2HD2      LEU  18  -8.267   4.175   2.267
  154   HD13  LEU  18          3HD2      LEU  18  -8.705   4.877   3.850
  155   HD21  LEU  18          1HD1      LEU  18  -9.670   1.367   5.260
  156   HD22  LEU  18          2HD1      LEU  18  -9.640   3.086   5.753
  157   HD23  LEU  18          3HD1      LEU  18  -8.112   2.185   5.465
  158    H    PHE  19           H        PHE  19 -12.294   2.494   0.666
  159    HA   PHE  19           HA       PHE  19 -15.089   2.810   1.449
  160    HB2  PHE  19           1HB      PHE  19 -15.332   3.783  -0.796
  161    HB3  PHE  19           2HB      PHE  19 -14.139   4.540   0.228
  162    HD1  PHE  19           HD1      PHE  19 -14.612   2.549  -2.912
  163    HD2  PHE  19           HD2      PHE  19 -11.736   4.561  -0.415
  164    HE1  PHE  19           HE1      PHE  19 -13.002   2.567  -4.764
  165    HE2  PHE  19           HE2      PHE  19 -10.163   4.616  -2.303
  166    HZ   PHE  19           HZ       PHE  19 -10.781   3.609  -4.470
  167    H    LYS  20           H        LYS  20 -14.757   0.095   1.759
  168    HA   LYS  20           HA       LYS  20 -15.597  -1.422  -0.550
  169    HB2  LYS  20           2HB      LYS  20 -14.213  -2.295   1.281
  170    HB3  LYS  20           1HB      LYS  20 -15.631  -2.219   2.331
  171    HG2  LYS  20           2HG      LYS  20 -16.811  -3.894   0.840
  172    HG3  LYS  20           1HG      LYS  20 -15.409  -3.922  -0.232
  173    HD2  LYS  20           2HD      LYS  20 -13.974  -4.776   1.666
  174    HD3  LYS  20           1HD      LYS  20 -15.355  -4.762   2.750
  175    HE2  LYS  20           2HE      LYS  20 -15.165  -6.471   0.169
  176    HE3  LYS  20           1HE      LYS  20 -14.744  -7.043   1.781
  177    HZ2  LYS  20           1HZ      LYS  20 -17.434  -6.125   0.943
  178    HZ3  LYS  20           2HZ      LYS  20 -16.969  -7.678   1.156
  Start of MODEL   20
    1    H1   LYS   1           H        LYS   1  17.432  -1.365  -0.947
    2    HA   LYS   1           HA       LYS   1  15.500   0.190  -2.402
    3    HB2  LYS   1           1HB      LYS   1  14.509  -1.669  -3.749
    4    HB3  LYS   1           2HB      LYS   1  15.942  -0.969  -4.444
    5    HG2  LYS   1           1HG      LYS   1  16.153  -3.588  -2.838
    6    HG3  LYS   1           2HG      LYS   1  15.515  -3.591  -4.473
    7    HD2  LYS   1           2HD      LYS   1  17.644  -2.552  -5.338
    8    HD3  LYS   1           1HD      LYS   1  18.312  -2.550  -3.705
    9    HE2  LYS   1           1HE      LYS   1  18.095  -5.083  -3.605
   10    HE3  LYS   1           2HE      LYS   1  17.456  -5.086  -5.255
   11    HZ2  LYS   1           1HZ      LYS   1  19.537  -4.054  -5.986
   12    HZ3  LYS   1           2HZ      LYS   1  20.125  -4.057  -4.461
   13    H    MET   2           H        MET   2  15.028   0.413  -0.243
   14    HA   MET   2           HA       MET   2  13.470  -1.764   0.989
   15    HB2  MET   2           1HB      MET   2  14.820  -2.021   3.027
   16    HB3  MET   2           2HB      MET   2  15.782  -2.367   1.619
   17    HG2  MET   2           2HG      MET   2  17.238  -1.245   3.113
   18    HG3  MET   2           1HG      MET   2  16.929  -0.118   1.801
   19    HE1  MET   2           1HE      MET   2  14.926  -1.086   5.249
   20    HE2  MET   2           2HE      MET   2  15.474   0.315   6.213
   21    HE3  MET   2           3HE      MET   2  16.667  -0.878   5.619
   22    H    ASN   3           H        ASN   3  12.327   0.206   0.033
   23    HA   ASN   3           HA       ASN   3  11.128   1.600   2.327
   24    HB2  ASN   3           1HB      ASN   3  12.125   3.244  -0.111
   25    HB3  ASN   3           2HB      ASN   3  10.945   3.838   1.033
   26   HD21  ASN   3          2HD2      ASN   3  14.299   3.485   0.466
   27   HD22  ASN   3          1HD2      ASN   3  14.852   4.155   2.082
   28    H    MET   4           H        MET   4  10.798   1.609  -1.304
   29    HA   MET   4           HA       MET   4   7.966   1.254  -1.080
   30    HB2  MET   4           1HB      MET   4   9.551   0.431  -3.584
   31    HB3  MET   4           2HB      MET   4   7.897   1.007  -3.495
   32    HG2  MET   4           1HG      MET   4   8.924   3.307  -2.667
   33    HG3  MET   4           2HG      MET   4  10.467   2.631  -3.153
   34    HE1  MET   4           1HE      MET   4   7.062   3.994  -5.992
   35    HE2  MET   4           2HE      MET   4   6.687   2.942  -4.595
   36    HE3  MET   4           3HE      MET   4   7.383   4.572  -4.330
   37    H    LEU   5           H        LEU   5   9.456  -0.890   0.281
   38    HA   LEU   5           HA       LEU   5   8.608  -3.457  -0.971
   39    HB2  LEU   5           2HB      LEU   5  10.213  -2.818   1.562
   40    HB3  LEU   5           1HB      LEU   5   9.766  -4.448   1.081
   41    HG   LEU   5           HG       LEU   5  11.635  -2.517  -0.400
   42   HD11  LEU   5          1HD2      LEU   5  12.436  -3.563   1.714
   43   HD12  LEU   5          2HD2      LEU   5  12.063  -5.185   1.074
   44   HD13  LEU   5          3HD2      LEU   5  13.338  -4.184   0.307
   45   HD21  LEU   5          1HD1      LEU   5  10.816  -5.365  -1.288
   46   HD22  LEU   5          2HD1      LEU   5  12.176  -4.423  -1.962
   47   HD23  LEU   5          3HD1      LEU   5  10.516  -3.847  -2.174
   48    H    LYS   6           H        LYS   6   8.412  -2.450   2.420
   49    HA   LYS   6           HA       LYS   6   5.671  -3.360   2.695
   50    HB2  LYS   6           1HB      LYS   6   7.447  -3.337   4.555
   51    HB3  LYS   6           2HB      LYS   6   7.244  -1.594   4.685
   52    HG2  LYS   6           1HG      LYS   6   4.800  -1.957   5.310
   53    HG3  LYS   6           2HG      LYS   6   5.019  -3.699   5.134
   54    HD2  LYS   6           1HD      LYS   6   6.773  -3.654   6.971
   55    HD3  LYS   6           2HD      LYS   6   6.539  -1.910   7.143
   56    HE2  LYS   6           1HE      LYS   6   4.096  -2.307   7.765
   57    HE3  LYS   6           2HE      LYS   6   4.346  -4.052   7.606
   58    HZ2  LYS   6           1HZ      LYS   6   6.042  -3.896   9.346
   59    HZ3  LYS   6           2HZ      LYS   6   5.806  -2.285   9.493
   60    H    GLU   7           H        GLU   7   7.012  -0.149   2.031
   61    HA   GLU   7           HA       GLU   7   4.469   1.300   2.472
   62    HB2  GLU   7           2HB      GLU   7   6.869   2.207   0.747
   63    HB3  GLU   7           1HB      GLU   7   5.468   3.198   1.097
   64    HG2  GLU   7           2HG      GLU   7   5.956   3.171   3.547
   65    HG3  GLU   7           1HG      GLU   7   7.337   2.110   3.295
   66    HE2  GLU   7           HE2      GLU   7   9.108   2.955   3.017
   67    H    ASN   8           H        ASN   8   5.857  -0.185  -0.538
   68    HA   ASN   8           HA       ASN   8   3.579   0.693  -2.144
   69    HB2  ASN   8           1HB      ASN   8   5.688  -0.405  -3.124
   70    HB3  ASN   8           2HB      ASN   8   5.111  -1.978  -2.475
   71   HD21  ASN   8          1HD2      ASN   8   4.184  -3.158  -4.094
   72   HD22  ASN   8          2HD2      ASN   8   3.365  -2.481  -5.589
   73    H    VAL   9           H        VAL   9   4.037  -2.395  -0.360
   74    HA   VAL   9           HA       VAL   9   1.441  -3.454  -0.825
   75    HB   VAL   9           HB       VAL   9   3.954  -4.229   0.223
   76   HG11  VAL   9          1HG2      VAL   9   3.594  -5.393   2.362
   77   HG12  VAL   9          2HG2      VAL   9   1.911  -4.820   2.475
   78   HG13  VAL   9          3HG2      VAL   9   3.259  -3.672   2.619
   79   HG21  VAL   9          1HG1      VAL   9   3.097  -6.486   0.130
   80   HG22  VAL   9          2HG1      VAL   9   2.545  -5.520  -1.253
   81   HG23  VAL   9          3HG1      VAL   9   1.405  -5.887   0.072
   82    H    ASP  10           H        ASP  10   1.910  -0.651   0.923
   83    HA   ASP  10           HA       ASP  10  -0.149  -0.999   2.981
   84    HB2  ASP  10           2HB      ASP  10   2.286  -0.127   3.683
   85    HB3  ASP  10           1HB      ASP  10   1.773   1.305   2.821
   86    HD2  ASP  10           HD2      ASP  10   1.133  -0.777   5.389
   87    H    TYR  11           H        TYR  11   1.185   0.715   0.189
   88    HA   TYR  11           HA       TYR  11  -0.844   2.769  -0.191
   89    HB2  TYR  11           2HB      TYR  11   1.626   2.647  -1.166
   90    HB3  TYR  11           1HB      TYR  11   0.914   1.644  -2.361
   91    HD1  TYR  11           HD1      TYR  11   0.614   5.044  -0.813
   92    HD2  TYR  11           HD2      TYR  11  -0.552   2.583  -4.124
   93    HE1  TYR  11           HE1      TYR  11  -0.179   7.048  -2.023
   94    HE2  TYR  11           HE2      TYR  11  -1.346   4.582  -5.334
   95    HH   TYR  11           HH       TYR  11  -1.648   6.779  -5.262
   96    H    ILE  12           H        ILE  12  -0.578  -0.515  -1.476
   97    HA   ILE  12           HA       ILE  12  -2.809  -0.257  -3.388
   98    HB   ILE  12           HB       ILE  12  -0.947  -2.493  -2.766
   99   HG12  ILE  12          1HG1      ILE  12  -0.783  -2.628  -5.318
  100   HG13  ILE  12          2HG1      ILE  12  -1.866  -1.255  -5.437
  101   HG21  ILE  12          1HG2      ILE  12  -2.211  -4.116  -4.210
  102   HG22  ILE  12          2HG2      ILE  12  -3.576  -2.970  -4.293
  103   HG23  ILE  12          3HG2      ILE  12  -3.105  -3.708  -2.742
  104   HD11  ILE  12          1HD1      ILE  12   0.947  -1.226  -4.153
  105   HD12  ILE  12          2HD1      ILE  12   0.531  -0.636  -5.774
  106   HD13  ILE  12          3HD1      ILE  12  -0.101   0.208  -4.348
  107    H    GLN  13           H        GLN  13  -2.218  -2.026  -0.334
  108    HA   GLN  13           HA       GLN  13  -4.911  -2.640   0.283
  109    HB2  GLN  13           1HB      GLN  13  -2.745  -2.113   2.303
  110    HB3  GLN  13           2HB      GLN  13  -4.305  -2.764   2.632
  111    HG2  GLN  13           1HG      GLN  13  -3.907  -4.745   1.133
  112    HG3  GLN  13           2HG      GLN  13  -2.290  -4.164   0.792
  113   HE21  GLN  13          2HE2      GLN  13  -4.244  -5.864   3.067
  114   HE22  GLN  13          1HE2      GLN  13  -2.914  -6.181   4.290
  115    H    LYS  14           H        LYS  14  -3.219   0.491   0.738
  116    HA   LYS  14           HA       LYS  14  -5.330   1.709   2.343
  117    HB2  LYS  14           2HB      LYS  14  -3.060   2.620   2.335
  118    HB3  LYS  14           1HB      LYS  14  -3.182   3.039   0.616
  119    HG2  LYS  14           1HG      LYS  14  -5.017   4.712   1.229
  120    HG3  LYS  14           2HG      LYS  14  -4.853   4.231   2.914
  121    HD2  LYS  14           2HD      LYS  14  -3.655   6.292   2.637
  122    HD3  LYS  14           1HD      LYS  14  -2.454   5.038   2.921
  123    HE2  LYS  14           2HE      LYS  14  -1.916   4.972   0.440
  124    HE3  LYS  14           1HE      LYS  14  -3.188   6.159   0.119
  125    HZ2  LYS  14           1HZ      LYS  14  -1.995   7.748   1.474
  126    HZ3  LYS  14           2HZ      LYS  14  -1.056   7.203   0.252
  127    H    ASN  15           H        ASN  15  -4.730   1.785  -1.176
  128    HA   ASN  15           HA       ASN  15  -6.759   3.577  -2.085
  129    HB2  ASN  15           1HB      ASN  15  -4.806   2.485  -3.427
  130    HB3  ASN  15           2HB      ASN  15  -5.915   1.102  -3.567
  131   HD21  ASN  15          1HD2      ASN  15  -5.826   1.360  -5.813
  132   HD22  ASN  15          2HD2      ASN  15  -6.739   2.696  -6.685
  133    H    GLN  16           H        GLN  16  -6.861   0.099  -2.002
  134    HA   GLN  16           HA       GLN  16  -9.587  -0.278  -2.818
  135    HB2  GLN  16           1HB      GLN  16  -9.032  -2.527  -2.843
  136    HB3  GLN  16           2HB      GLN  16  -7.533  -1.722  -3.184
  137    HG2  GLN  16           2HG      GLN  16  -6.912  -2.008  -0.671
  138    HG3  GLN  16           1HG      GLN  16  -8.341  -3.010  -0.491
  139   HE21  GLN  16          1HE2      GLN  16  -7.538  -5.053  -0.288
  140   HE22  GLN  16          2HE2      GLN  16  -6.266  -5.808  -1.374
  141    H    ASN  17           H        ASN  17  -8.280  -0.031   0.446
  142    HA   ASN  17           HA       ASN  17 -10.727  -0.974   1.740
  143    HB2  ASN  17           1HB      ASN  17  -8.359   0.500   3.009
  144    HB3  ASN  17           2HB      ASN  17  -9.738  -0.103   3.911
  145   HD21  ASN  17          1HD2      ASN  17  -7.332  -0.912   4.658
  146   HD22  ASN  17          2HD2      ASN  17  -7.116  -2.690   4.262
  147    H    LEU  18           H        LEU  18  -9.685   2.382   0.883
  148    HA   LEU  18           HA       LEU  18 -11.638   3.793   2.232
  149    HB2  LEU  18           1HB      LEU  18 -10.568   4.391  -0.561
  150    HB3  LEU  18           2HB      LEU  18 -11.331   5.569   0.487
  151    HG   LEU  18           HG       LEU  18  -8.861   4.003   1.402
  152   HD11  LEU  18          1HD2      LEU  18  -8.803   6.662  -0.121
  153   HD12  LEU  18          2HD2      LEU  18  -7.402   5.827   0.628
  154   HD13  LEU  18          3HD2      LEU  18  -8.256   5.074  -0.733
  155   HD21  LEU  18          1HD1      LEU  18 -10.043   5.055   3.216
  156   HD22  LEU  18          2HD1      LEU  18  -9.981   6.646   2.399
  157   HD23  LEU  18          3HD1      LEU  18  -8.474   5.836   2.954
  158    H    PHE  19           H        PHE  19 -12.096   2.979  -1.230
  159    HA   PHE  19           HA       PHE  19 -14.934   3.416  -1.184
  160    HB2  PHE  19           1HB      PHE  19 -14.911   2.570  -3.500
  161    HB3  PHE  19           2HB      PHE  19 -13.859   3.923  -3.171
  162    HD1  PHE  19           HD1      PHE  19 -13.912   0.264  -4.018
  163    HD2  PHE  19           HD2      PHE  19 -11.429   3.747  -3.545
  164    HE1  PHE  19           HE1      PHE  19 -12.088  -0.861  -5.226
  165    HE2  PHE  19           HE2      PHE  19  -9.638   2.625  -4.802
  166    HZ   PHE  19           HZ       PHE  19  -9.954   0.320  -5.631
  167    H    LYS  20           H        LYS  20 -13.258   0.288  -1.596
  168    HA   LYS  20           HA       LYS  20 -15.718  -1.205  -0.950
  169    HB2  LYS  20           2HB      LYS  20 -14.221  -1.893  -2.786
  170    HB3  LYS  20           1HB      LYS  20 -13.009  -2.300  -1.569
  171    HG2  LYS  20           2HG      LYS  20 -14.617  -4.007  -0.576
  172    HG3  LYS  20           1HG      LYS  20 -15.805  -3.575  -1.809
  173    HD2  LYS  20           2HD      LYS  20 -14.174  -4.304  -3.618
  174    HD3  LYS  20           1HD      LYS  20 -13.000  -4.743  -2.371
  175    HE2  LYS  20           1HE      LYS  20 -14.648  -6.442  -1.423
  176    HE3  LYS  20           2HE      LYS  20 -15.814  -6.005  -2.682
  177    HZ2  LYS  20           1HZ      LYS  20 -14.214  -6.715  -4.347
  178    HZ3  LYS  20           2HZ      LYS  20 -14.590  -7.931  -3.321
  Start of MODEL   21
    1    H1   LYS   1           H        LYS   1  17.687   0.188   1.545
    2    HA   LYS   1           HA       LYS   1  15.455  -0.614   3.179
    3    HB2  LYS   1           2HB      LYS   1  14.359   1.630   3.377
    4    HB3  LYS   1           1HB      LYS   1  15.610   1.312   4.542
    5    HG2  LYS   1           2HG      LYS   1  16.192   2.995   2.028
    6    HG3  LYS   1           1HG      LYS   1  15.369   3.696   3.401
    7    HD2  LYS   1           1HD      LYS   1  18.215   2.517   3.451
    8    HD3  LYS   1           2HD      LYS   1  17.793   4.212   3.324
    9    HE2  LYS   1           2HE      LYS   1  16.688   4.128   5.617
   10    HE3  LYS   1           1HE      LYS   1  17.156   2.428   5.772
   11    HZ2  LYS   1           1HZ      LYS   1  19.047   4.680   5.393
   12    HZ3  LYS   1           2HZ      LYS   1  19.475   3.108   5.529
   13    H    MET   2           H        MET   2  15.086  -1.754   1.346
   14    HA   MET   2           HA       MET   2  14.056  -0.347  -0.992
   15    HB2  MET   2           2HB      MET   2  15.657  -0.931  -2.676
   16    HB3  MET   2           1HB      MET   2  16.549  -0.239  -1.359
   17    HG2  MET   2           2HG      MET   2  17.981  -1.947  -1.861
   18    HG3  MET   2           1HG      MET   2  17.014  -2.806  -0.652
   19    HE1  MET   2           1HE      MET   2  17.709  -5.190  -1.601
   20    HE2  MET   2           2HE      MET   2  17.662  -5.626  -3.335
   21    HE3  MET   2           3HE      MET   2  18.800  -4.371  -2.763
   22    H    ASN   3           H        ASN   3  12.479  -1.453   0.282
   23    HA   ASN   3           HA       ASN   3  11.451  -3.759  -1.164
   24    HB2  ASN   3           2HB      ASN   3  12.835  -4.921   0.696
   25    HB3  ASN   3           1HB      ASN   3  11.836  -4.141   1.903
   26   HD21  ASN   3          2HD2      ASN   3   9.803  -5.086   2.331
   27   HD22  ASN   3          1HD2      ASN   3   9.230  -6.626   1.513
   28    H    MET   4           H        MET   4  10.763  -1.905   1.909
   29    HA   MET   4           HA       MET   4   8.000  -1.586   1.193
   30    HB2  MET   4           1HB      MET   4   9.497   0.321   3.077
   31    HB3  MET   4           2HB      MET   4   7.795  -0.098   3.084
   32    HG2  MET   4           2HG      MET   4   8.602  -2.566   3.692
   33    HG3  MET   4           1HG      MET   4  10.161  -1.818   3.975
   34    HE1  MET   4           1HE      MET   4   6.341  -1.235   6.563
   35    HE2  MET   4           2HE      MET   4   6.258  -0.966   4.798
   36    HE3  MET   4           3HE      MET   4   6.677  -2.585   5.439
   37    H    LEU   5           H        LEU   5   9.474  -0.737  -1.082
   38    HA   LEU   5           HA       LEU   5   9.366   2.215  -1.330
   39    HB2  LEU   5           2HB      LEU   5  10.772   2.283  -3.108
   40    HB3  LEU   5           1HB      LEU   5  11.449   1.356  -1.815
   41    HG   LEU   5           HG       LEU   5  10.398  -0.719  -3.208
   42   HD11  LEU   5          1HD1      LEU   5   9.465   0.782  -5.080
   43   HD12  LEU   5          2HD1      LEU   5  11.121   1.286  -5.456
   44   HD13  LEU   5          3HD1      LEU   5  10.631  -0.424  -5.660
   45   HD21  LEU   5          1HD2      LEU   5  13.047   0.720  -3.782
   46   HD22  LEU   5          2HD2      LEU   5  12.697  -0.463  -2.499
   47   HD23  LEU   5          3HD2      LEU   5  12.691  -0.999  -4.196
   48    H    LYS   6           H        LYS   6   8.563  -0.634  -3.245
   49    HA   LYS   6           HA       LYS   6   6.081   0.529  -4.312
   50    HB2  LYS   6           2HB      LYS   6   7.753  -0.898  -5.684
   51    HB3  LYS   6           1HB      LYS   6   7.281  -2.296  -4.733
   52    HG2  LYS   6           2HG      LYS   6   4.889  -2.051  -5.616
   53    HG3  LYS   6           1HG      LYS   6   5.379  -0.612  -6.496
   54    HD2  LYS   6           2HD      LYS   6   5.320  -2.367  -8.096
   55    HD3  LYS   6           1HD      LYS   6   7.021  -1.995  -7.853
   56    HE2  LYS   6           2HE      LYS   6   7.230  -4.041  -6.326
   57    HE3  LYS   6           1HE      LYS   6   5.511  -4.382  -6.563
   58    HZ2  LYS   6           1HZ      LYS   6   6.917  -5.668  -8.030
   59    HZ3  LYS   6           2HZ      LYS   6   7.583  -4.327  -8.686
   60    H    GLU   7           H        GLU   7   6.966  -1.930  -1.911
   61    HA   GLU   7           HA       GLU   7   4.210  -2.889  -1.462
   62    HB2  GLU   7           2HB      GLU   7   6.619  -3.069   0.465
   63    HB3  GLU   7           1HB      GLU   7   5.080  -3.839   0.759
   64    HG2  GLU   7           2HG      GLU   7   6.950  -4.502  -1.604
   65    HG3  GLU   7           1HG      GLU   7   6.842  -5.401  -0.104
   66    HE2  GLU   7           HE2      GLU   7   3.861  -7.018  -0.825
   67    H    ASN   8           H        ASN   8   6.031  -0.188   0.110
   68    HA   ASN   8           HA       ASN   8   3.821   0.359   1.956
   69    HB2  ASN   8           2HB      ASN   8   6.177   1.440   2.123
   70    HB3  ASN   8           1HB      ASN   8   5.734   2.459   0.721
   71   HD21  ASN   8          2HD2      ASN   8   4.965   1.717   4.140
   72   HD22  ASN   8          1HD2      ASN   8   4.268   3.374   4.506
   73    H    VAL   9           H        VAL   9   4.557   1.761  -1.278
   74    HA   VAL   9           HA       VAL   9   2.177   3.307  -1.513
   75    HB   VAL   9           HB       VAL   9   4.683   2.966  -2.781
   76   HG11  VAL   9          1HG1      VAL   9   4.333   2.772  -5.205
   77   HG12  VAL   9          2HG1      VAL   9   2.585   2.493  -5.005
   78   HG13  VAL   9          3HG1      VAL   9   3.754   1.276  -4.450
   79   HG21  VAL   9          1HG2      VAL   9   3.577   5.057  -2.311
   80   HG22  VAL   9          2HG2      VAL   9   2.400   4.790  -3.629
   81   HG23  VAL   9          3HG2      VAL   9   4.149   4.985  -3.990
   82    H    ASP  10           H        ASP  10   2.115  -0.003  -1.317
   83    HA   ASP  10           HA       ASP  10  -0.045  -0.585  -3.219
   84    HB2  ASP  10           2HB      ASP  10   2.164  -2.048  -3.294
   85    HB3  ASP  10           1HB      ASP  10   1.614  -2.608  -1.732
   86    HD2  ASP  10           HD2      ASP  10  -0.876  -4.670  -2.905
   87    H    TYR  11           H        TYR  11   1.277  -0.645   0.069
   88    HA   TYR  11           HA       TYR  11  -0.989  -1.740   1.521
   89    HB2  TYR  11           1HB      TYR  11   1.564  -1.499   2.265
   90    HB3  TYR  11           2HB      TYR  11   1.091   0.082   2.707
   91    HD1  TYR  11           HD1      TYR  11   0.184  -3.511   3.253
   92    HD2  TYR  11           HD2      TYR  11  -0.335   0.485   4.700
   93    HE1  TYR  11           HE1      TYR  11  -0.719  -4.401   5.380
   94    HE2  TYR  11           HE2      TYR  11  -1.237  -0.395   6.826
   95    HH   TYR  11           HH       TYR  11  -1.558  -3.905   7.378
   96    H    ILE  12           H        ILE  12  -0.121   1.616   0.823
   97    HA   ILE  12           HA       ILE  12  -2.207   2.797   2.544
   98    HB   ILE  12           HB       ILE  12  -0.054   4.008   0.879
   99   HG12  ILE  12          2HG1      ILE  12   0.325   5.420   2.990
  100   HG13  ILE  12          1HG1      ILE  12  -0.938   4.506   3.792
  101   HG21  ILE  12          1HG2      ILE  12  -0.911   6.343   1.237
  102   HG22  ILE  12          2HG2      ILE  12  -1.969   5.404   0.181
  103   HG23  ILE  12          3HG2      ILE  12  -2.438   5.677   1.877
  104   HD11  ILE  12          1HD1      ILE  12   0.495   2.426   3.650
  105   HD12  ILE  12          2HD1      ILE  12   1.715   3.332   2.712
  106   HD13  ILE  12          3HD1      ILE  12   1.383   3.764   4.403
  107    H    GLN  13           H        GLN  13  -1.550   2.581  -0.960
  108    HA   GLN  13           HA       GLN  13  -4.132   3.280  -1.875
  109    HB2  GLN  13           2HB      GLN  13  -2.238   1.412  -3.277
  110    HB3  GLN  13           1HB      GLN  13  -3.684   2.075  -3.939
  111    HG2  GLN  13           1HG      GLN  13  -2.882   4.416  -3.713
  112    HG3  GLN  13           2HG      GLN  13  -1.395   3.858  -2.963
  113   HE21  GLN  13          1HE2      GLN  13   0.038   4.545  -4.518
  114   HE22  GLN  13          2HE2      GLN  13   0.015   3.985  -6.265
  115    H    LYS  14           H        LYS  14  -3.074   0.102  -0.571
  116    HA   LYS  14           HA       LYS  14  -5.509  -1.301  -1.389
  117    HB2  LYS  14           1HB      LYS  14  -3.448  -2.521  -0.888
  118    HB3  LYS  14           2HB      LYS  14  -3.532  -2.062   0.824
  119    HG2  LYS  14           1HG      LYS  14  -5.723  -3.362   0.964
  120    HG3  LYS  14           2HG      LYS  14  -5.557  -3.809  -0.729
  121    HD2  LYS  14           1HD      LYS  14  -3.627  -4.552   1.564
  122    HD3  LYS  14           2HD      LYS  14  -4.848  -5.611   0.898
  123    HE2  LYS  14           2HE      LYS  14  -2.369  -4.578  -0.645
  124    HE3  LYS  14           1HE      LYS  14  -2.528  -6.157   0.112
  125    HZ2  LYS  14           1HZ      LYS  14  -2.974  -6.234  -2.243
  126    HZ3  LYS  14           2HZ      LYS  14  -4.200  -5.161  -2.122
  127    H    ASN  15           H        ASN  15  -4.581   0.258   1.676
  128    HA   ASN  15           HA       ASN  15  -6.765  -0.347   3.398
  129    HB2  ASN  15           2HB      ASN  15  -4.523   0.927   3.875
  130    HB3  ASN  15           1HB      ASN  15  -5.429   2.344   3.290
  131   HD21  ASN  15          1HD2      ASN  15  -5.015   3.250   5.369
  132   HD22  ASN  15          2HD2      ASN  15  -6.007   2.752   6.831
  133    H    GLN  16           H        GLN  16  -6.368   2.424   1.314
  134    HA   GLN  16           HA       GLN  16  -8.935   3.636   1.840
  135    HB2  GLN  16           1HB      GLN  16  -8.087   5.454   0.715
  136    HB3  GLN  16           2HB      GLN  16  -6.679   4.721   1.418
  137    HG2  GLN  16           1HG      GLN  16  -6.166   3.629  -0.855
  138    HG3  GLN  16           2HG      GLN  16  -7.497   4.522  -1.564
  139   HE21  GLN  16          2HE2      GLN  16  -7.236   6.803  -1.854
  140   HE22  GLN  16          1HE2      GLN  16  -5.595   7.605  -1.684
  141    H    ASN  17           H        ASN  17  -7.940   1.522  -0.838
  142    HA   ASN  17           HA       ASN  17 -10.344   2.073  -2.404
  143    HB2  ASN  17           2HB      ASN  17  -9.744   0.395  -3.989
  144    HB3  ASN  17           1HB      ASN  17  -8.386   1.407  -3.613
  145   HD21  ASN  17          2HD2      ASN  17  -9.676  -1.752  -2.371
  146   HD22  ASN  17          1HD2      ASN  17  -8.063  -2.597  -2.597
  147    H    LEU  18           H        LEU  18  -9.802  -0.410   0.068
  148    HA   LEU  18           HA       LEU  18 -12.036  -2.000  -0.331
  149    HB2  LEU  18           1HB      LEU  18 -10.682  -1.244   2.293
  150    HB3  LEU  18           2HB      LEU  18 -11.704  -2.648   2.066
  151    HG   LEU  18           HG       LEU  18  -9.215  -2.194   0.339
  152   HD11  LEU  18          1HD1      LEU  18  -8.476  -2.176   2.693
  153   HD12  LEU  18          2HD1      LEU  18  -9.320  -3.720   3.001
  154   HD13  LEU  18          3HD1      LEU  18  -7.930  -3.651   1.874
  155   HD21  LEU  18          1HD2      LEU  18 -10.722  -3.779  -0.650
  156   HD22  LEU  18          2HD2      LEU  18 -10.799  -4.733   0.861
  157   HD23  LEU  18          3HD2      LEU  18  -9.266  -4.603  -0.070
  158    H    PHE  19           H        PHE  19 -13.590   0.123  -0.899
  159    HA   PHE  19           HA       PHE  19 -14.981   1.291   1.290
  160    HB2  PHE  19           1HB      PHE  19 -15.993   1.238  -1.520
  161    HB3  PHE  19           2HB      PHE  19 -16.367   2.345  -0.235
  162    HD1  PHE  19           HD1      PHE  19 -14.471   3.901   0.700
  163    HD2  PHE  19           HD2      PHE  19 -14.031   1.693  -2.965
  164    HE1  PHE  19           HE1      PHE  19 -12.841   5.557  -0.114
  165    HE2  PHE  19           HE2      PHE  19 -12.390   3.343  -3.752
  166    HZ   PHE  19           HZ       PHE  19 -11.801   5.284  -2.340
  167    H    LYS  20           H        LYS  20 -16.593  -0.756  -1.131
  168    HA   LYS  20           HA       LYS  20 -18.745  -1.466   0.674
  169    HB2  LYS  20           1HB      LYS  20 -18.916  -1.119  -1.798
  170    HB3  LYS  20           2HB      LYS  20 -18.236  -2.731  -1.987
  171    HG2  LYS  20           2HG      LYS  20 -20.852  -2.075  -0.479
  172    HG3  LYS  20           1HG      LYS  20 -20.770  -2.454  -2.190
  173    HD2  LYS  20           1HD      LYS  20 -19.764  -4.732  -1.618
  174    HD3  LYS  20           2HD      LYS  20 -20.034  -4.404   0.086
  175    HE2  LYS  20           1HE      LYS  20 -22.262  -4.491  -2.062
  176    HE3  LYS  20           2HE      LYS  20 -21.813  -5.837  -1.019
  177    HZ2  LYS  20           1HZ      LYS  20 -23.696  -4.689  -0.139
  178    HZ3  LYS  20           2HZ      LYS  20 -22.446  -4.551   0.905