*HEADER    OXIDOREDUCTASE                          03-NOV-99   1DBY              
*TITLE     NMR STRUCTURES OF CHLOROPLAST THIOREDOXIN M CH2 FROM THE              
*TITLE    2 GREEN ALGA CHLAMYDOMONAS REINHARDTII                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CHLOROPLAST THIOREDOXIN M CH2;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: CHLAMYDOMONAS REINHARDTII;                      
*SOURCE   3 ORGANELLE: CHLOROPLAST;                                              
*SOURCE   4 GENE: NUCLEAR;                                                       
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21;                                      
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET3                                       
*KEYWDS    THIOREDOXIN M, THIOREDOXIN CH2, CHLOROPLASTIC THIOREDOXIN             
*EXPDTA    NMR, 28 STRUCTURES                                                    
*AUTHOR    J.M.LANCELIN, L.GUILHAUDIS, I.KRIMM, M.J.BLACKLEDGE,                  
*AUTHOR   2 D.MARION                                                             
*REVDAT   1   08-NOV-99 1DBY    0                                                

#remote_prochiral_center
1:VAL_6:HG1*    1:VAL_6:HG2*    1:VAL_6:CG1     1:VAL_6:CG2     1:VAL_6:CB     
1:VAL_14:HG1*   1:VAL_14:HG2*   1:VAL_14:CG1    1:VAL_14:CG2    1:VAL_14:CB    
1:VAL_15:HG1*   1:VAL_15:HG2*   1:VAL_15:CG1    1:VAL_15:CG2    1:VAL_15:CB    
1:LEU_16:HD1*   1:LEU_16:HD2*   1:LEU_16:CD1    1:LEU_16:CD2    1:LEU_16:CG    
1:VAL_20:HG1*   1:VAL_20:HG2*   1:VAL_20:CG1    1:VAL_20:CG2    1:VAL_20:CB    
1:VAL_22:HG1*   1:VAL_22:HG2*   1:VAL_22:CG1    1:VAL_22:CG2    1:VAL_22:CB    
1:VAL_24:HG1*   1:VAL_24:HG2*   1:VAL_24:CG1    1:VAL_24:CG2    1:VAL_24:CB    
1:VAL_40:HG1*   1:VAL_40:HG2*   1:VAL_40:CG1    1:VAL_40:CG2    1:VAL_40:CB    
1:VAL_41:HG1*   1:VAL_41:HG2*   1:VAL_41:CG1    1:VAL_41:CG2    1:VAL_41:CB    
1:VAL_55:HG1*   1:VAL_55:HG2*   1:VAL_55:CG1    1:VAL_55:CG2    1:VAL_55:CB    
1:VAL_65:HG1*   1:VAL_65:HG2*   1:VAL_65:CG1    1:VAL_65:CG2    1:VAL_65:CB    
1:VAL_79:HG1*   1:VAL_79:HG2*   1:VAL_79:CG1    1:VAL_79:CG2    1:VAL_79:CB    
1:VAL_99:HG1*   1:VAL_99:HG2*   1:VAL_99:CG1    1:VAL_99:CG2    1:VAL_99:CB    
1:VAL_102:HG1*  1:VAL_102:HG2*  1:VAL_102:CG1   1:VAL_102:CG2   1:VAL_102:CB   
1:LEU_57:HD1*   1:LEU_57:HD2*   1:LEU_57:CD1    1:LEU_57:CD2    1:LEU_57:CG    
1:LEU_23:HD2*   1:LEU_23:HD1*   1:LEU_23:CD2    1:LEU_23:CD1    1:LEU_23:CG    
1:LEU_52:HD1*   1:LEU_52:HD2*   1:LEU_52:CD1    1:LEU_52:CD2    1:LEU_52:CG    
1:VAL_93:HG2*   1:VAL_93:HG1*   1:VAL_93:CG2    1:VAL_93:CG1    1:VAL_93:CB    
1:LEU_106:HD2*  1:LEU_106:HD1*  1:LEU_106:CD2   1:LEU_106:CD1   1:LEU_106:CG   
!
#chiral
1:MET_1:CA        S
1:GLU_2:CA         S
1:ALA_3:CA         S
1:ALA_5:CA         S
1:VAL_6:CA         S
1:ASN_7:CA         S
1:ASP_8:CA         S
1:ASP_9:CA         S
1:THR_10:CA        S
1:THR_10:CB        R
1:PHE_11:CA        S
1:LYS_12:CA        S
1:ASN_13:CA        S
1:VAL_14:CA        S
1:VAL_15:CA        S
1:LEU_16:CA        S
1:GLU_17:CA        S
1:SER_18:CA        S
1:SER_19:CA        S
1:VAL_20:CA        S
1:PRO_21:CA        S
1:VAL_22:CA        S
1:LEU_23:CA        S
1:VAL_24:CA        S
1:ASP_25:CA        S
1:PHE_26:CA        S
1:TRP_27:CA        S
1:ALA_28:CA        S
1:PRO_29:CA        S
1:TRP_30:CA        S
1:CYS_31:CA        R
1:PRO_33:CA        S
1:CYS_34:CA        R
1:ARG_35:CA        S
1:ILE_36:CA        S
1:ILE_36:CB        S
1:ILE_37:CA        S
1:ILE_37:CB        S
1:ALA_38:CA        S
1:PRO_39:CA        S
1:VAL_40:CA        S
1:VAL_41:CA        S
1:ASP_42:CA        S
1:GLU_43:CA        S
1:ILE_44:CA        S
1:ILE_44:CB        S
1:ALA_45:CA        S
1:GLU_47:CA        S
1:TYR_48:CA        S
1:LYS_49:CA        S
1:ASP_50:CA        S
1:LYS_51:CA        S
1:LEU_52:CA        S
1:LYS_53:CA        S
1:CYS_54:CA       R
1:VAL_55:CA        S
1:LYS_56:CA        S
1:LEU_57:CA        S
1:ASN_58:CA        S
1:THR_59:CA        S
1:THR_59:CB        R
1:ASP_60:CA        S
1:GLU_61:CA        S
1:SER_62:CA        S
1:PRO_63:CA        S
1:ASN_64:CA        S
1:VAL_65:CA        S
1:ALA_66:CA        S
1:SER_67:CA        S
1:GLU_68:CA        S
1:TYR_69:CA        S
1:ILE_71:CA        S
1:ILE_71:CB        S
1:ARG_72:CA        S
1:SER_73:CA        S
1:ILE_74:CA        S
1:ILE_74:CB        S
1:PRO_75:CA        S
1:THR_76:CA        S
1:THR_76:CB        R
1:ILE_77:CA        S
1:ILE_77:CB        S
1:MET_78:CA        S
1:VAL_79:CA        S
1:PHE_80:CA        S
1:LYS_81:CA        S
1:LYS_84:CA        S
1:LYS_85:CA        S
1:CYS_86:CA       R
1:GLU_87:CA        S
1:THR_88:CA        S
1:THR_88:CB        R
1:ILE_89:CA        S
1:ILE_89:CB        S
1:ILE_90:CA        S
1:ILE_90:CB        S
1:ALA_92:CA        S
1:VAL_93:CA        S
1:PRO_94:CA        S
1:LYS_95:CA        S
1:ALA_96:CA        S
1:THR_97:CA        S
1:THR_97:CB        R
1:ILE_98:CA        S
1:ILE_98:CB        S
1:VAL_99:CA        S
1:GLN_100:CA       S
1:THR_101:CA       S
1:THR_101:CB       R
1:VAL_102:CA       S
1:GLU_103:CA       S
1:LYS_104:CA       S
1:TYR_105:CA       S
1:LEU_106:CA       S
1:ASN_107:CA      S
!
#distance
1:THR_10:O         1:VAL_14:HN         0.000  2.300 50.00 50.00 1000.000
1:THR_10:O         1:VAL_14:N          2.500  3.300 50.00 50.00 1000.000
1:PHE_11:O         1:LEU_16:HN         0.000  2.300 50.00 50.00 1000.000
1:PHE_11:O         1:LEU_16:N          2.500  3.300 50.00 50.00 1000.000
1:ALA_38:O         1:ASP_42:HN         0.000  2.300 50.00 50.00 1000.000
1:ALA_38:O         1:ASP_42:N          2.500  3.300 50.00 50.00 1000.000
1:PRO_39:O         1:GLU_43:HN         0.000  2.300 50.00 50.00 1000.000
1:PRO_39:O         1:GLU_43:N          2.500  3.300 50.00 50.00 1000.000
1:VAL_40:O         1:ILE_44:HN         0.000  2.300 50.00 50.00 1000.000
1:VAL_40:O         1:ILE_44:N          2.500  3.300 50.00 50.00 1000.000
1:LYS_95:O         1:VAL_99:HN         0.000  2.300 50.00 50.00 1000.000
1:LYS_95:O         1:VAL_99:N          2.500  3.300 50.00 50.00 1000.000
1:VAL_22:O         1:PHE_80:HN         0.000  2.300 50.00 50.00 1000.000
1:VAL_22:O         1:PHE_80:N          2.500  3.300 50.00 50.00 1000.000
1:PHE_80:O         1:VAL_22:HN         0.000  2.300 50.00 50.00 1000.000
1:PHE_80:O         1:VAL_22:N          2.500  3.300 50.00 50.00 1000.000
1:VAL_24:O         1:MET_78:HN         0.000  2.300 50.00 50.00 1000.000
1:VAL_24:O         1:MET_78:N          2.500  3.300 50.00 50.00 1000.000
1:MET_78:O         1:VAL_24:HN         0.000  2.300 50.00 50.00 1000.000
1:MET_78:O         1:VAL_24:N          2.500  3.300 50.00 50.00 1000.000
1:THR_76:O         1:PHE_26:HN         0.000  2.300 50.00 50.00 1000.000
1:THR_76:O         1:PHE_26:N          2.500  3.300 50.00 50.00 1000.000
1:GLU_87:O         1:VAL_79:HN         0.000  2.300 50.00 50.00 1000.000
1:GLU_87:O         1:VAL_79:N          2.500  3.300 50.00 50.00 1000.000
1:ILE_89:O         1:ILE_77:HN         0.000  2.300 50.00 50.00 1000.000
1:ILE_89:O         1:ILE_77:N          2.500  3.300 50.00 50.00 1000.000
1:ILE_77:O         1:ILE_89:HN         0.000  2.300 50.00 50.00 1000.000
1:ILE_77:O         1:ILE_89:N          2.500  3.300 50.00 50.00 1000.000
1:LYS_53:O         1:LEU_23:HN         0.000  2.300 50.00 50.00 1000.000
1:LYS_53:O         1:LEU_23:N          2.500  3.300 50.00 50.00 1000.000
1:LEU_57:O         1:TRP_27:HN         0.000  2.300 50.00 50.00 1000.000
1:LEU_57:O         1:TRP_27:N          2.500  3.300 50.00 50.00 1000.000
1:TRP_27:O         1:THR_59:HN         0.000  2.300 50.00 50.00 1000.000
1:TRP_27:O         1:THR_59:N          2.500  3.300 50.00 50.00 1000.000
1:TYR_48:O         1:LEU_52:HN         0.000  2.300 50.00 50.00 1000.000
1:TYR_48:O         1:LEU_52:N          2.500  3.300 50.00 50.00 1000.000
1:ASN_58:O         1:SER_62:HN         0.000  2.300 50.00 50.00 1000.000
1:ASN_58:O         1:SER_62:N          2.500  3.300 50.00 50.00 1000.000
1:ASN_58:OD1       1:ASP_60:HN         0.000  2.300 50.00 50.00 1000.000
1:ASN_58:OD1       1:ASP_60:N          2.500  3.300 50.00 50.00 1000.000
1:ASN_58:OD1       1:GLU_61:HN         0.000  2.300 50.00 50.00 1000.000
1:ASN_58:OD1       1:GLU_61:N          2.500  3.300 50.00 50.00 1000.000
1:LYS_84:O         1:LYS_81:HN         0.000  2.300 50.00 50.00 1000.000
1:LYS_84:O         1:LYS_81:N          2.500  3.300 50.00 50.00 1000.000
!
#NOE_distance
1:VAL_6:HN         1:VAL_6:HG1*       -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:VAL_6:HG2*       -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:VAL_6:HB         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:ASN_7:HB1        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:ASN_7:HB2        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HN        1:VAL_14:HB        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_14:HN        1:VAL_14:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_14:HN        1:VAL_14:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_14:HA        1:VAL_14:HG1*      -1.000  3.700  3.700 50.00 50.00 1000.000  0.00
1:VAL_14:HA        1:VAL_14:HG2*      -1.000  3.700  3.700 50.00 50.00 1000.000  0.00
1:VAL_15:HN        1:VAL_15:HB        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_15:HN        1:VAL_15:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_15:HN        1:VAL_15:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_15:HA        1:VAL_15:HG1*      -1.000  3.700  3.700 50.00 50.00 1000.000  0.00
1:VAL_15:HA        1:VAL_15:HG2*      -1.000  3.700  3.700 50.00 50.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HD1*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HD2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LEU_16:HA        1:LEU_16:HD1*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LEU_16:HA        1:LEU_16:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_20:HN        1:VAL_20:HG1*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_20:HN        1:VAL_20:HG2*      -1.000  3.900  3.900 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:VAL_22:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:VAL_22:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_22:HA        1:VAL_22:HG1*      -1.000  3.700  3.700 50.00 50.00 1000.000  0.00
1:VAL_22:HA        1:VAL_22:HG2*      -1.000  3.700  3.700 50.00 50.00 1000.000  0.00
1:GLU_2:HA         1:ALA_3:HN         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_3:HA         1:GLY_4:HN         -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:GLY_4:HA1        1:ALA_5:HN         -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:GLY_4:HA2        1:ALA_5:HN         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_5:HA         1:VAL_6:HN         -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_6:HA         1:ASN_7:HN         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASN_7:HA         1:ASP_8:HN         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASP_8:HA         1:ASP_9:HN         -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASP_9:HA         1:THR_10:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_10:HA        1:PHE_11:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_11:HA        1:LYS_12:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_12:HA        1:ASN_13:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_13:HA        1:VAL_14:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HA        1:VAL_15:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_15:HA        1:LEU_16:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_16:HA        1:GLU_17:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_17:HA        1:SER_18:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:SER_19:HA        1:VAL_20:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_20:HA        1:PRO_21:HD1       -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_20:HA        1:PRO_21:HD2       -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:PRO_21:HA        1:VAL_22:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_22:HA        1:LEU_23:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:LEU_23:HA        1:VAL_24:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_24:HA        1:ASP_25:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:PHE_26:HA        1:TRP_27:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:TRP_27:HA        1:ALA_28:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_28:HA        1:PRO_29:HD1       -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ALA_28:HA        1:PRO_29:HD2       -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:PRO_29:HA        1:TRP_30:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HA        1:CYS_31:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_33:HA        1:CYS_34:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:CYS_34:HA        1:ARG_35:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ARG_35:HA        1:ILE_36:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_36:HA        1:ILE_37:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_37:HA        1:ALA_38:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_39:HA        1:VAL_40:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_40:HA        1:VAL_41:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_41:HA        1:ASP_42:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_42:HA        1:GLU_43:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_43:HA        1:ILE_44:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_44:HA        1:ALA_45:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_45:HA        1:GLY_46:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_46:HA*       1:GLU_47:HN        -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:GLU_47:HA        1:TYR_48:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:TYR_48:HA        1:LYS_49:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_49:HA        1:ASP_50:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASP_50:HA        1:LYS_51:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_51:HA        1:LEU_52:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LEU_52:HA        1:LYS_53:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_53:HA        1:CYS_54:HN       -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:CYS_54:HA       1:VAL_55:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:VAL_55:HA        1:LYS_56:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:LYS_56:HA        1:LEU_57:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:LEU_57:HA        1:ASN_58:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ASN_58:HA        1:THR_59:HN        -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:THR_59:HA        1:ASP_60:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_60:HA        1:GLU_61:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_61:HA        1:SER_62:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_62:HA        1:PRO_63:HD1       -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:SER_62:HA        1:PRO_63:HD2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:PRO_63:HA        1:ASN_64:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_64:HA        1:VAL_65:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
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1:GLU_61:HB1       1:SER_62:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
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1:TYR_69:HB1       1:GLY_70:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
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1:LYS_81:HB1       1:GLY_82:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
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1:LYS_84:HB1       1:LYS_85:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
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1:GLU_103:HB1      1:LYS_104:HN       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
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1:TYR_105:HB1      1:LEU_106:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
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1:LYS_49:HG*       1:ASP_50:HN        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
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1:LEU_52:HG        1:LYS_53:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_53:HG*       1:CYS_54:HN       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HG1*      1:LYS_56:HN        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
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1:LYS_49:HA        1:LEU_52:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_59:HA        1:SER_62:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_63:HD1       1:ALA_66:HN        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_64:HA        1:SER_67:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_66:HA        1:TYR_69:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_95:HA        1:ILE_98:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_96:HA        1:VAL_99:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_98:HA        1:THR_101:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_99:HA        1:VAL_102:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_100:HA       1:GLU_103:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_102:HA       1:TYR_105:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_103:HA       1:LEU_106:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_10:HA        1:ASN_13:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_10:HA        1:ASN_13:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_11:HA        1:VAL_14:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ARG_35:HA        1:ALA_38:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_38:HA        1:VAL_41:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_39:HA        1:ASP_42:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_39:HA        1:ASP_42:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_41:HA        1:ILE_44:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_42:HA        1:ALA_45:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PRO_63:HA        1:ALA_66:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_64:HA        1:SER_67:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_95:HA        1:ILE_98:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_97:HA        1:GLN_100:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_97:HA        1:GLN_100:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_98:HA        1:THR_101:HB       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_100:HA       1:GLU_103:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_100:HA       1:GLU_103:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_101:HA       1:LYS_104:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_101:HA       1:LYS_104:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_102:HA       1:TYR_105:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_102:HA       1:TYR_105:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_103:HA       1:LEU_106:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_103:HA       1:LEU_106:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_10:HA        1:VAL_14:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_38:HA        1:ASP_42:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_39:HA        1:GLU_43:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_40:HA        1:ILE_44:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_65:HA        1:TYR_69:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_95:HA        1:VAL_99:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!
1:GLY_4:HN         1:VAL_55:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_5:HA         1:LYS_56:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:LYS_56:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:LEU_57:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASN_7:HA         1:LEU_57:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_21:HA        1:LYS_81:HA        -1.000  2.700  2.700 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:LYS_81:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_22:HA        1:LYS_53:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_22:HA        1:CYS_54:HN       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:PHE_80:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LEU_23:HA        1:PHE_80:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_23:HA        1:VAL_79:HA        -1.000  2.700  2.700 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:LYS_53:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:CYS_54:HA       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:VAL_55:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_24:HA        1:CYS_54:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_24:HN        1:VAL_79:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_24:HN        1:MET_78:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASP_25:HN        1:VAL_55:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_25:HN        1:LYS_56:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_25:HN        1:LEU_57:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASP_25:HA        1:MET_78:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_25:HA        1:ILE_77:HA        -1.000  2.700  2.700 50.00 50.00 1000.000  0.00
1:PHE_26:HN        1:ILE_77:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HN        1:THR_76:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:PHE_26:HA        1:LEU_57:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:PHE_26:HA        1:ASN_58:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HN        1:LEU_57:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HN        1:ASN_58:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:TRP_27:HA        1:THR_59:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_28:HA        1:ASN_58:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_28:HA        1:THR_59:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLU_87:HN        1:VAL_79:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:THR_88:HA        1:VAL_79:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_88:HA        1:MET_78:HA        -1.000  2.700  2.700 50.00 50.00 1000.000  0.00
1:ILE_89:HN        1:MET_78:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_89:HN        1:ILE_77:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_90:HA        1:ILE_77:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_90:HA        1:THR_76:HA        -1.000  2.700  2.700 50.00 50.00 1000.000  0.00
1:GLY_91:HN        1:THR_76:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:PHE_80:HZ        -1.000  3.300  3.300 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:PHE_80:HE*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:PHE_80:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:PHE_26:HZ        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:PHE_26:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:TYR_69:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:TYR_69:HE*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:PHE_80:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:PHE_26:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:PHE_80:HE*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:PHE_26:HE*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:PHE_26:HD*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:PHE_80:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:TYR_69:HD*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:PHE_80:HZ        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:PHE_11:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:TYR_69:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:TYR_69:HD*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:TYR_69:HE*       -1.000  7.300  7.300 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:PHE_11:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:PHE_80:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:PHE_80:HE*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:TYR_69:HE*       1:PHE_80:HD*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:TYR_69:HE*       1:PHE_80:HE*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:PHE_80:HZ        1:TYR_69:HE*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:PHE_80:HZ        1:PHE_26:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HD*       1:TYR_69:HD*       -1.000  9.000  9.000 50.00 50.00 1000.000  0.00
1:ALA_3:HN         1:ASP_42:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HA         1:SER_62:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HA         1:LEU_57:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HA         1:LEU_57:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:THR_10:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:THR_10:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_8:HN         1:SER_62:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:ASP_9:HN         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:THR_10:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_6:HG2*       1:VAL_55:HG1*      -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:VAL_6:HG2*       1:PHE_11:HD*       -1.000  6.300  6.300 50.00 50.00 1000.000  0.00
1:VAL_6:HG2*       1:PHE_11:HE*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:VAL_6:HG2*       1:PHE_11:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_6:HB         1:PHE_11:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ALA_3:HN         1:ALA_45:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLY_4:HN         1:VAL_55:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:PHE_11:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_8:HN         1:SER_62:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASP_8:HN         1:SER_62:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASP_9:HN         1:ASN_7:HB2        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_9:HN         1:THR_10:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASP_8:HN         1:ASN_7:HD21       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_8:HN         1:ASN_7:HD22       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_8:HN         1:LEU_57:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASP_8:HA         1:LYS_12:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_4:HN         1:VAL_14:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLY_4:HN         1:VAL_55:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:THR_10:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:VAL_14:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HN        1:VAL_6:HG2*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HA        1:VAL_15:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HA        1:VAL_15:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HB2       1:VAL_6:HG2*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:VAL_65:HG1*      -1.000  6.300  6.300 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:VAL_65:HG1*      -1.000  6.300  6.300 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:VAL_65:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:VAL_24:HG1*      -1.000  6.300  6.300 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:VAL_24:HG2*      -1.000  6.300  6.300 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:VAL_24:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LEU_57:HD2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:VAL_15:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:VAL_15:HG1*      -1.000  6.300  6.300 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:VAL_15:HG2*      -1.000  6.300  6.300 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:VAL_15:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:VAL_24:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:LEU_16:HD1*      -1.000  6.300  6.300 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:LEU_16:HD2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LEU_16:HG        -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:LEU_16:HG        -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:LYS_12:HN        1:VAL_14:HN        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_12:HN        1:VAL_15:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_12:HN        1:LEU_16:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_12:HA        1:LEU_16:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_12:HA        1:LEU_16:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_12:HA        1:GLU_17:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_13:HA        1:GLU_17:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HN        1:THR_10:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HA        1:ASN_13:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HA        1:ASN_13:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HA        1:SER_18:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HA        1:SER_18:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_1:HG1       1:MET_1:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_2:HG*        1:MET_1:HG1       -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:LEU_57:HN        1:TRP_27:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_3:HB*        1:GLU_2:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_5:HA         1:VAL_55:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_6:HA         1:THR_10:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_6:HG2*       1:VAL_6:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_6:HG1*       1:VAL_6:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_6:HG1*       1:VAL_24:HA        -1.000  6.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HA         1:ASP_8:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HA         1:GLU_61:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HA         1:SER_62:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_8:HB2        1:SER_62:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_8:HA         1:VAL_65:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASP_9:HB1        1:ASP_9:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_10:HG2*      1:VAL_6:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_10:HG2*      1:ASP_9:HB2        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_10:HG2*      1:ASN_7:HB1        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_10:HB        1:VAL_14:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LYS_12:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HA        1:LYS_12:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LYS_12:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LYS_12:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:LYS_12:HG1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LEU_57:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LEU_16:HD2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:VAL_65:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:VAL_65:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:VAL_65:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:VAL_15:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:ASP_8:HA         -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HE*       1:LYS_12:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LYS_12:HG2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LYS_12:HB1       1:ASN_13:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HG2*      1:VAL_6:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_14:HG2*      1:ASN_13:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_14:HG1*      1:THR_10:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG2*      1:VAL_14:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG1*      1:PHE_80:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG1*      1:VAL_22:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG2*      1:VAL_14:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_15:HB        1:LEU_16:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG2*      1:VAL_22:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG1*      1:VAL_22:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_15:HB        1:VAL_14:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG2*      1:VAL_14:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG2*      1:VAL_6:HG2*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_15:HG2*      1:VAL_55:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_16:HG        1:LEU_16:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_16:HG        1:LYS_12:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_16:HD1*      1:LYS_12:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_16:HD1*      1:LYS_12:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLU_17:HB1       1:ASN_13:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_18:HA        1:SER_19:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_20:HA        1:SER_19:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_20:HG1*      1:LYS_51:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_20:HG2*      1:PRO_21:HD2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_20:HA        1:VAL_20:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:VAL_22:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_22:HA        1:LEU_23:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_23:HA        1:LEU_23:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_24:HG2*      1:VAL_24:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_24:HG1*      1:VAL_24:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_24:HN        1:VAL_24:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_24:HN        1:LEU_23:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_24:HN        1:LEU_23:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_24:HN        1:VAL_24:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_24:HN        1:LEU_23:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_25:HN        1:ASP_25:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HN        1:PHE_26:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:TYR_69:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:ALA_66:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:PHE_26:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:MET_78:HG2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:MET_78:HG1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:VAL_24:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:MET_78:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:ALA_66:HB*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:ALA_66:HB*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:THR_76:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:ILE_74:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:LEU_57:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:VAL_65:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:VAL_65:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:VAL_24:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:VAL_24:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:VAL_24:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:ILE_71:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:ILE_71:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:ILE_71:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:PHE_26:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:TYR_69:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:TYR_69:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HA        1:LEU_57:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HA        1:ILE_74:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:MET_78:HG2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TRP_27:HD1       1:PHE_26:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HH2       1:PRO_29:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:PRO_29:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ3       1:PRO_29:HA        -1.000  3.300  3.300 50.00 50.00 1000.000  0.00
1:TRP_27:HZ2       1:ASN_58:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HD1       1:ASN_58:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:CYS_34:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HA        1:CYS_34:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:PRO_29:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:ALA_28:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ2       1:ASN_58:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HA        1:CYS_31:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HH2       1:PRO_29:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ3       1:PRO_29:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ2       1:ASN_58:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ3       1:PRO_29:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HA        1:ILE_74:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HD1       1:LYS_56:HB*       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:ALA_28:HB*       -1.000  6.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ3       1:ALA_28:HB*       -1.000  6.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HA        1:ILE_74:HD1*      -1.000  6.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HD1       1:LEU_57:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ2       1:ALA_28:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ2       1:PRO_29:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:CYS_31:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:PRO_29:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HA        1:CYS_34:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:CYS_34:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:CYS_34:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ3       1:ALA_28:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_28:HB*       1:CYS_31:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PRO_29:HG1       1:ALA_28:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HZ3       1:CYS_31:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:CYS_31:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HZ2       1:ALA_28:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:ALA_28:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_30:HZ2       1:ILE_74:HD1*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TRP_30:HH2       1:ILE_74:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_30:HZ3       1:ILE_74:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:CYS_31:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:ILE_74:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:CYS_31:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_33:HD2       1:GLY_32:HA2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_33:HD1       1:GLY_32:HA1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_36:HG2*      1:ARG_35:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_36:HG11      1:GLY_32:HA1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_36:HG2*      1:ILE_36:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_36:HG11      1:ILE_36:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_36:HD1*      1:PRO_33:HA        -1.000  6.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_37:HG2*      1:ILE_37:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_37:HD1*      1:ILE_37:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_37:HD1*      1:ALA_92:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_40:HG2*      1:VAL_40:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_40:HG1*      1:VAL_40:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_40:HG1*      1:VAL_41:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_40:HG1*      1:PRO_39:HD1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_41:HG1*      1:ALA_38:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_41:HG2*      1:VAL_41:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_41:HG1*      1:VAL_41:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_44:HG2*      1:ALA_45:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_44:HA        1:GLU_43:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_44:HG11      1:ILE_44:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_44:HG2*      1:ILE_44:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_44:HG11      1:LYS_95:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_44:HG2*      1:GLU_43:HG2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_44:HN        1:ILE_44:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_44:HN        1:ILE_44:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_45:HB*       1:ILE_44:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_45:HN        1:ALA_45:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_45:HB*       1:ALA_3:HA         -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLY_46:HA*       1:LYS_49:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLU_47:HB2       1:TYR_48:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_47:HG1       1:GLU_47:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_47:HB2       1:ILE_44:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:GLU_47:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:LYS_51:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:GLU_47:HG1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:LYS_51:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:GLU_47:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:GLU_47:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:VAL_99:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:VAL_99:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:ILE_44:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:ILE_44:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:VAL_102:HG1*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:ILE_44:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:VAL_99:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:GLU_47:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LYS_51:HB1       1:PRO_21:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_52:HB1       1:TYR_48:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_52:HD1*      1:TYR_48:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_52:HB2       1:TYR_48:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_52:HD1*      1:TYR_48:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_52:HD1*      1:LYS_51:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_52:HD1*      1:VAL_102:HG2*     -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:LEU_52:HD1*      1:VAL_79:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_52:HD1*      1:VAL_102:HG1*     -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_52:HD1*      1:PRO_21:HG1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_53:HN        1:LYS_53:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_53:HA        1:VAL_55:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_53:HN        1:VAL_20:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_54:HA       1:VAL_55:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_54:HB2      1:ALA_45:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_54:HB1      1:ALA_45:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_54:HA       1:ALA_3:HA         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_54:HA       1:VAL_55:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:CYS_54:HA       1:VAL_55:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:CYS_54:HA       1:VAL_41:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:CYS_54:HA       1:LYS_53:HD*       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_54:HA       1:LEU_23:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_55:HG1*      1:VAL_24:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HG2*      1:GLY_4:HA2        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HG2*      1:GLY_4:HA1        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HA        1:LYS_56:HE*       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_55:HN        1:VAL_55:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_55:HG2*      1:LYS_56:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HG2*      1:VAL_6:HG2*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_55:HG2*      1:VAL_6:HG1*       -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:VAL_55:HG1*      1:VAL_24:HG2*      -1.000  5.300  5.300 50.00 50.00 1000.000  0.00
1:VAL_55:HN        1:VAL_55:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HN        1:VAL_55:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HN        1:VAL_24:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HA        1:VAL_55:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HA        1:VAL_55:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_55:HA        1:ALA_3:HB*        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_56:HD*       1:TRP_27:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_56:HA        1:VAL_24:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HD2*      1:LEU_57:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HD2*      1:ASN_58:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HB2       1:SER_62:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_57:HD1*      1:SER_62:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HD2*      1:THR_59:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HD1*      1:PHE_11:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HA        1:ASN_58:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_57:HN        1:LEU_57:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_57:HA        1:LEU_57:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_59:HG2*      1:ASP_60:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_59:HG2*      1:PRO_63:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_59:HA        1:SER_62:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_59:HG2*      1:ALA_66:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_59:HG2*      1:ASP_60:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASP_60:HB2       1:PRO_29:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_61:HB2       1:ASN_58:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_62:HA        1:GLU_61:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_65:HG1*      1:ASN_64:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_65:HG2*      1:ALA_66:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_65:HG1*      1:VAL_65:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_65:HG2*      1:VAL_65:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_65:HG1*      1:ASN_64:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_65:HG2*      1:VAL_65:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_65:HG2*      1:ALA_66:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ALA_66:HB*       1:THR_59:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_66:HB*       1:ALA_66:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_66:HB*       1:TYR_69:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:SER_67:HB*       1:SER_67:HA        -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:GLU_68:HB2       1:TYR_69:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_68:HB1       1:TYR_69:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_68:HB2       1:GLU_68:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_68:HB1       1:GLU_68:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_68:HB1       1:VAL_65:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:ALA_66:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HE*       1:GLU_68:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:GLU_68:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:LYS_85:HD1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HE*       1:GLU_68:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:VAL_65:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_69:HE*       1:VAL_65:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:ILE_71:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:GLY_70:HA1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HE*       1:LYS_84:HD*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_69:HE*       1:LEU_16:HD2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:ILE_71:HD1*      1:ILE_71:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_71:HG11      1:GLY_70:HA2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_71:HD1*      1:PHE_26:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_71:HD1*      1:TYR_69:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_71:HD1*      1:ILE_71:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_71:HD1*      1:ALA_66:HB*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_71:HG2*      1:THR_76:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_71:HD1*      1:THR_76:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_71:HD1*      1:ILE_71:HG11      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_71:HD1*      1:VAL_65:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ARG_72:HG1       1:ARG_72:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ARG_72:HG2       1:SER_73:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ARG_72:HB1       1:ARG_72:HD*       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ARG_72:HG1       1:ARG_72:HD*       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ARG_72:HG2       1:ARG_72:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_73:HB1       1:SER_73:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_74:HG2*      1:SER_73:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HG11      1:ILE_74:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:ILE_74:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:THR_59:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:CYS_31:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:CYS_31:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:ILE_74:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:ILE_74:HG12      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:THR_59:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:ILE_74:HG11      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:ILE_74:HG2*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ILE_74:HD1*      1:ALA_28:HB*       -1.000  5.300  3.300 50.00 50.00 1000.000  0.00
1:ILE_74:HG11      1:THR_59:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_75:HG1       1:ILE_90:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_75:HG2       1:ALA_92:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_75:HD2       1:PRO_33:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PRO_75:HA        1:THR_76:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_76:HG2*      1:ILE_90:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_76:HA        1:ILE_90:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_76:HA        1:ILE_90:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_77:HN        1:ILE_89:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_77:HA        1:VAL_24:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_77:HA        1:ASP_25:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_78:HE*       1:TYR_69:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:MET_78:HB2       1:MET_78:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_78:HB2       1:MET_78:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_78:HA        1:MET_78:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_78:HN        1:VAL_24:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:MET_78:HN        1:ILE_77:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_79:HB        1:GLU_87:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_79:HG1*      1:VAL_102:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HG2*      1:PHE_80:HB1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HG2*      1:PRO_21:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HG2*      1:LYS_81:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HG2*      1:LEU_23:HG        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HG1*      1:VAL_79:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HG1*      1:THR_101:HG2*     -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_79:HN        1:VAL_79:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HN        1:VAL_79:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HA        1:VAL_79:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HA        1:VAL_79:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HA        1:MET_78:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_80:HD*       1:VAL_79:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HD*       1:LYS_84:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HD*       1:LYS_81:HE*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_80:HA        1:LYS_81:HE*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:PHE_80:HE*       1:VAL_24:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HE*       1:MET_78:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HD*       1:VAL_22:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HE*       1:MET_78:HE*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_80:HZ        1:LYS_85:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_80:HD*       1:LYS_85:HG*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_80:HD*       1:VAL_79:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:PHE_80:HE*       1:PHE_26:HZ        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HN        1:VAL_24:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_80:HE*       1:LYS_84:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HE*       1:MET_78:HG1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_80:HZ        1:VAL_15:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_81:HD*       1:GLY_82:HA1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_82:HA1       1:LYS_81:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_84:HG2       1:GLY_83:HA2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_84:HA        1:GLY_83:HA2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_84:HA        1:LYS_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_85:HE1       1:THR_88:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_87:HG1       1:TYR_105:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_87:HG2       1:TYR_105:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_87:HG1       1:CYS_86:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_88:HA        1:MET_78:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_88:HA        1:MET_78:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_88:HA        1:ILE_89:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_89:HD1*      1:ILE_89:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_89:HG2*      1:THR_101:HB       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_89:HG2*      1:ILE_98:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_90:HG12      1:ILE_90:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_90:HG11      1:ILE_89:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_90:HA        1:ILE_90:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_92:HA        1:GLY_91:HA2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_92:HB*       1:PRO_75:HD2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_93:HG2*      1:PRO_94:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_93:HB        1:THR_97:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_93:HG1*      1:THR_97:HB        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_93:HG1*      1:PRO_94:HD2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_93:HG2*      1:LYS_95:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_93:HA        1:PRO_94:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_93:HG1*      1:VAL_93:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_95:HB2       1:PRO_94:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_97:HG2*      1:PRO_94:HD2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_97:HG2*      1:PRO_94:HD1       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_97:HG2*      1:ILE_98:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_97:HB        1:VAL_93:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_97:HG2*      1:VAL_93:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_98:HG2*      1:THR_101:HB       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_98:HG2*      1:ILE_98:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_99:HG2*      1:ALA_96:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_99:HG1*      1:GLN_100:HG2      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_101:HG2*     1:ILE_98:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_102:HG1*     1:THR_101:HB       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_102:HG1*     1:VAL_102:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_102:HG1*     1:ILE_98:HA        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_102:HG1*     1:GLU_103:HG2      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_102:HG1*     1:LEU_23:HB2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_102:HG1*     1:VAL_102:HB       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLU_103:HG1      1:GLU_103:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_104:HD*      1:TYR_105:HB2      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_104:HG*      1:TYR_105:HB2      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:VAL_102:HA       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:LYS_104:HE*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HE*      1:LYS_104:HE*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:LEU_106:HB2      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:VAL_79:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:THR_101:HG2*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_105:HE*      1:THR_101:HG2*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:VAL_79:HG2*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_105:HE*      1:GLU_87:HG2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HE*      1:LYS_104:HB1      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HE*      1:LYS_104:HG*      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:GLU_87:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:LEU_106:HD2*     1:LEU_106:HA       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_106:HG       1:LEU_106:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_106:HG       1:TYR_105:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_106:HD1*     1:LEU_52:HB1       -1.000  4.300  4.300 50.00 50.00 1000.000  0.00
1:LEU_106:HD2*     1:TYR_105:HB2      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_3:HN         1:GLU_2:HB*        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_3:HN         1:GLY_4:HN         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_3:HN         1:CYS_54:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_4:HN         1:VAL_55:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:ASN_7:HN         -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_6:HN         1:LYS_56:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_7:HD21       1:SER_62:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HN         1:PHE_11:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_7:HD21       1:GLU_61:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASP_8:HN         1:ASP_8:HB1        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_9:HN         1:ASP_9:HB2        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASP_9:HN         1:ASP_9:HB1        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:THR_10:HN        1:PHE_11:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_10:HN        1:THR_10:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_10:HN        1:PHE_11:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_11:HD*       1:LEU_16:HD1*      -1.000  7.500  7.500 50.00 50.00 1000.000  0.00
1:PHE_11:HZ        1:VAL_15:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_12:HN        1:LEU_16:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_13:HN        1:ASN_13:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASN_13:HD22      1:GLU_17:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_13:HN        1:ASN_13:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASN_13:HD21      1:LYS_12:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_13:HN        1:VAL_14:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_13:HN        1:PHE_11:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_14:HN        1:VAL_15:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_14:HN        1:LYS_12:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_15:HN        1:PHE_11:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_15:HN        1:VAL_14:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_16:HN        1:GLY_83:HA2       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_16:HN        1:LEU_16:HG        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLU_17:HN        1:GLU_17:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLU_17:HN        1:LEU_16:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:SER_18:HN        1:SER_18:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_18:HN        1:SER_18:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:PHE_80:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:LYS_53:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:VAL_79:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:VAL_22:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_22:HN        1:VAL_79:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:LEU_23:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:LEU_23:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:LEU_23:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:LEU_23:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:VAL_22:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:VAL_55:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:CYS_54:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_23:HN        1:LYS_53:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_24:HN        1:VAL_24:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASP_25:HN        1:VAL_55:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_25:HN        1:LYS_56:HB*       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_25:HN        1:ASP_25:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASP_25:HN        1:ASP_25:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HN        1:PHE_26:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HN        1:ILE_77:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HN        1:PHE_26:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:THR_59:HG2*      -1.000  6.500  6.500 50.00 50.00 1000.000  0.00
1:PHE_26:HD*       1:ILE_77:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:ILE_77:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HN        1:PHE_26:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:VAL_65:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HE*       1:ILE_71:HG11      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:PHE_26:HZ        1:MET_78:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HN        1:TRP_27:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:TRP_27:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HN        1:TRP_27:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HN        1:TRP_27:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:TRP_27:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:ALA_28:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE1       1:LYS_56:HG*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_27:HN        1:TRP_27:HD1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:TRP_27:HE1       1:LYS_56:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE3       1:PRO_29:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE1       1:ASN_58:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE1       1:ASN_58:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE1       1:LYS_56:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:TRP_27:HN        1:THR_59:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE1       1:ASN_58:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HE1       1:LYS_56:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_27:HN        1:LEU_57:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ2       1:ASN_58:HD21      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HZ2       1:ASN_58:HD22      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_27:HD1       1:TRP_27:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_28:HN        1:ALA_28:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_28:HN        1:CYS_31:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HZ2       1:ILE_74:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:TRP_30:HH2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HZ2       1:TRP_30:HZ3       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:TRP_30:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:TRP_30:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:TRP_30:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HD1       1:PRO_29:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HZ2       1:THR_59:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:TRP_30:HE3       1:CYS_31:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HZ2       1:THR_59:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TRP_30:HH2       1:ILE_74:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_31:HN        1:CYS_31:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_31:HN        1:PRO_29:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_31:HN        1:PRO_29:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_31:HN        1:CYS_31:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_31:HN        1:TRP_30:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_34:HN        1:CYS_34:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_34:HN        1:CYS_34:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:CYS_34:HN        1:PRO_33:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_34:HN        1:CYS_34:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ARG_35:HN        1:ARG_35:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ARG_35:HN        1:ARG_35:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ARG_35:HN        1:ARG_35:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ARG_35:HN        1:ARG_35:HG*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ARG_35:HN        1:PRO_33:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_36:HN        1:ILE_36:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_36:HN        1:ILE_36:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_36:HN        1:ILE_36:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_36:HN        1:ILE_36:HG12      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ILE_37:HN        1:ILE_37:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_37:HN        1:ALA_38:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_37:HN        1:ILE_37:HD1*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ILE_37:HN        1:ILE_36:HD1*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ILE_37:HN        1:ILE_37:HG12      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_38:HN        1:CYS_34:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_38:HN        1:ALA_38:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ALA_38:HN        1:VAL_41:HG1*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ALA_38:HN        1:VAL_41:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_38:HN        1:PRO_39:HG*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_40:HN        1:VAL_40:HB        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_40:HN        1:VAL_40:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_41:HN        1:VAL_41:HB        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_41:HN        1:VAL_41:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_41:HN        1:PRO_39:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_41:HN        1:ILE_37:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_41:HN        1:ALA_38:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_41:HN        1:VAL_41:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ASP_42:HN        1:VAL_40:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_43:HN        1:GLU_43:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLU_43:HN        1:GLU_43:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_43:HN        1:GLU_43:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ILE_44:HN        1:ILE_44:HB        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ILE_44:HN        1:ILE_44:HG12      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ILE_44:HN        1:ASP_42:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_44:HN        1:ASP_42:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_44:HN        1:ILE_44:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_44:HN        1:VAL_40:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_45:HN        1:VAL_41:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_46:HN        1:GLU_43:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_46:HN        1:GLU_47:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_46:HN        1:GLU_2:HB*        -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLU_47:HN        1:ALA_45:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_47:HN        1:GLU_47:HG1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLU_47:HN        1:GLU_43:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_47:HN        1:GLU_47:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:TYR_48:HN        1:TYR_48:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:ALA_45:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HE*       1:VAL_99:HB        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:ILE_44:HG12      -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_48:HD*       1:LEU_52:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:LYS_51:HN        1:LYS_51:HG*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_51:HN        1:TYR_48:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_51:HN        1:LYS_51:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_51:HN        1:LYS_51:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:LEU_52:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:LEU_52:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:LYS_51:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:TYR_48:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:ASP_50:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:LEU_52:HG        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:VAL_20:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:LEU_52:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_52:HN        1:LEU_52:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_53:HN        1:LYS_53:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_53:HN        1:PRO_21:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_53:HN        1:VAL_22:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LYS_53:HN        1:LEU_52:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:CYS_54:HN       1:CYS_54:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_55:HN        1:LEU_23:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_55:HN        1:VAL_41:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_55:HN        1:VAL_55:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_56:HN        1:LYS_56:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_56:HN        1:VAL_6:HG1*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_56:HN        1:LYS_56:HG*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_56:HN        1:LYS_56:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HN        1:TRP_27:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LEU_57:HN        1:LEU_57:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HN        1:LEU_57:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LEU_57:HN        1:LYS_56:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_58:HN        1:TRP_27:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HD22      1:TRP_27:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HN        1:LEU_57:HD2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_58:HN        1:ASN_58:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HD21      1:ASN_58:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HN        1:ASN_58:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ASN_58:HD21      1:ASN_58:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HN        1:LEU_57:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_58:HN        1:ASN_58:HD22      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HD22      1:PRO_29:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HD22      1:ASN_58:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HN        1:TRP_27:HZ2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_58:HN        1:TRP_27:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_59:HN        1:ASN_58:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_59:HN        1:PHE_26:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:THR_59:HN        1:ASN_58:HD22      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_59:HN        1:THR_59:HB        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:THR_59:HN        1:ASN_58:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_59:HN        1:ASP_60:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_59:HN        1:THR_59:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:THR_59:HN        1:ALA_28:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASP_60:HN        1:ALA_28:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASP_60:HN        1:PRO_63:HD2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_61:HN        1:GLU_61:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_61:HN        1:GLU_61:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_62:HN        1:SER_62:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_62:HN        1:ASN_58:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_62:HN        1:SER_62:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_64:HN        1:ASN_64:HD21      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_64:HD21      1:ASN_64:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_64:HN        1:ASN_64:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_64:HD22      1:ASN_64:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_64:HN        1:ASN_64:HD22      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_64:HD22      1:ASP_8:HB2        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_65:HN        1:VAL_65:HB        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_65:HN        1:VAL_65:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_66:HN        1:ALA_66:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ALA_66:HN        1:ASN_64:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:SER_67:HN        1:GLU_68:HG*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:SER_67:HN        1:SER_67:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:GLU_68:HN        1:TYR_69:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:GLU_68:HN        1:ASN_64:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_68:HN        1:VAL_65:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_68:HN        1:GLU_68:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_68:HN        1:GLY_70:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:GLU_68:HB1       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:LYS_85:HG*       -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:VAL_65:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:VAL_65:HA        -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_69:HN        1:GLU_68:HG*       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_69:HD*       1:MET_78:HB2       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:GLY_70:HN        1:ALA_66:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_70:HN        1:SER_67:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_71:HN        1:ILE_71:HB        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ILE_71:HN        1:ILE_71:HG12      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ILE_71:HN        1:SER_67:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_71:HN        1:ALA_66:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_71:HN        1:ILE_71:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_71:HN        1:ILE_71:HG11      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_71:HN        1:ILE_71:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_74:HN        1:ILE_74:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_74:HN        1:PRO_75:HD1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_76:HN        1:THR_76:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_76:HN        1:PHE_26:HD*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:THR_76:HN        1:ILE_74:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_76:HN        1:THR_76:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_76:HN        1:PHE_26:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_77:HN        1:ILE_89:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_78:HN        1:MET_78:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:MET_78:HN        1:VAL_24:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:MET_78:HN        1:PHE_26:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:VAL_79:HN        1:LYS_85:HG*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_79:HN        1:VAL_79:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_80:HN        1:PHE_80:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_80:HN        1:PHE_80:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_80:HN        1:VAL_22:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_80:HZ        1:MET_78:HB2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:PHE_80:HN        1:VAL_79:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:PHE_80:HD*       1:VAL_24:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:LYS_81:HN        1:LYS_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_81:HN        1:LYS_81:HB1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_81:HN        1:CYS_86:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_82:HN        1:PRO_21:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_82:HN        1:LYS_81:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLY_83:HN        1:GLY_83:HA1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLY_83:HN        1:LYS_84:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_84:HN        1:LYS_84:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_85:HN        1:LYS_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_85:HN        1:PHE_80:HE*       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:CYS_86:HN       1:CYS_86:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_86:HN       1:LYS_85:HE1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_86:HN       1:CYS_86:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_86:HN       1:LYS_81:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:CYS_86:HN       1:LYS_81:HD*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:CYS_86:HN       1:PHE_80:HA        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLU_87:HN        1:LYS_85:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_87:HN        1:GLU_87:HG1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLU_87:HN        1:GLU_87:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLU_87:HN        1:VAL_79:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_88:HN        1:GLU_87:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_88:HN        1:ILE_89:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_89:HN        1:ILE_89:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_89:HN        1:ILE_89:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_89:HN        1:ILE_89:HG12      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_89:HN        1:ILE_89:HG11      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ILE_89:HN        1:ILE_89:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ILE_89:HN        1:ILE_90:HN        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_90:HN        1:ILE_90:HB        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_92:HN        1:ALA_92:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ALA_92:HN        1:PRO_33:HG1       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_92:HN        1:PRO_75:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_93:HN        1:VAL_93:HG1*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:LYS_95:HN        1:LYS_95:HB2       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_95:HN        1:LYS_95:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_95:HN        1:ILE_98:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_95:HN        1:VAL_40:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_95:HN        1:ALA_96:HN        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_96:HN        1:PRO_94:HB1       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:ALA_96:HN        1:ALA_96:HB*       -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:ALA_96:HN        1:LYS_95:HG2       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ALA_96:HN        1:VAL_40:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ALA_96:HN        1:PRO_94:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_97:HN        1:THR_97:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_97:HN        1:THR_97:HG2*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_97:HN        1:LYS_95:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_97:HN        1:VAL_93:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_98:HN        1:ILE_98:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ILE_98:HN        1:ILE_98:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_99:HN        1:VAL_99:HB        -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_99:HN        1:VAL_99:HG2*      -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_99:HN        1:ALA_96:HB*       -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_99:HN        1:VAL_99:HG1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:VAL_99:HN        1:ILE_44:HD1*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLN_100:HN       1:GLN_100:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_100:HN       1:ALA_96:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_100:HN       1:GLN_100:HG2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_100:HE21     1:GLN_100:HG2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_100:HE21     1:GLN_100:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLN_100:HE22     1:GLN_100:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_101:HN       1:VAL_99:HB        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_101:HN       1:THR_101:HB       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_101:HN       1:THR_101:HG2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_101:HN       1:VAL_102:HB       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:THR_101:HN       1:VAL_102:HG1*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:THR_101:HN       1:GLN_100:HE21     -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:VAL_102:HN       1:VAL_102:HB       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:VAL_102:HN       1:VAL_102:HG2*     -1.000  4.500  4.500 50.00 50.00 1000.000  0.00
1:VAL_102:HN       1:VAL_102:HG1*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:GLU_103:HN       1:GLU_103:HB1      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:GLU_103:HN       1:VAL_99:HA        -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_103:HN       1:GLU_103:HG2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_103:HN       1:GLU_103:HG1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:GLU_103:HN       1:GLU_103:HB2      -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:LYS_104:HN       1:LYS_104:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_104:HN       1:LYS_104:HG*      -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:LYS_104:HN       1:GLN_100:HA       -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:LYS_104:HN       1:GLU_103:HA       -1.000  3.500  3.500 50.00 50.00 1000.000  0.00
1:TYR_105:HN       1:TYR_105:HB2      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:VAL_79:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_105:HN       1:TYR_105:HB1      -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:TYR_105:HE*      1:VAL_102:HA       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:TYR_105:HE*      1:ILE_89:HD1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:VAL_102:HG1*     -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_105:HE*      1:VAL_79:HG1*      -1.000  8.000  8.000 50.00 50.00 1000.000  0.00
1:TYR_105:HD*      1:VAL_102:HB       -1.000  7.000  7.000 50.00 50.00 1000.000  0.00
1:ASN_107:HN      1:LEU_106:HD2*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_107:HN      1:ASN_107:HB2     -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
1:ASN_107:HN      1:LEU_106:HD1*     -1.000  6.000  6.000 50.00 50.00 1000.000  0.00
1:ASN_107:HD22    1:ASN_107:HD21    -1.000  2.900  2.900 50.00 50.00 1000.000  0.00
1:ASN_107:HD22    1:ASN_107:HB2     -1.000  5.000  5.000 50.00 50.00 1000.000  0.00
!
#mixing_times
-9.990000E+02 
!
#NMR_dihedral
1:GLY_4:C          1:ALA_5:N          1:ALA_5:CA         1:ALA_5:C          -160.000 -80.000 200.00 200.00 1000.000
1:ALA_5:C          1:VAL_6:N          1:VAL_6:CA         1:VAL_6:C          -160.000 -80.000 200.00 200.00 1000.000
1:VAL_6:C          1:ASN_7:N          1:ASN_7:CA         1:ASN_7:C          -160.000 -80.000 200.00 200.00 1000.000
1:ASN_7:C          1:ASP_8:N          1:ASP_8:CA         1:ASP_8:C          -90.000 -40.000 200.00 200.00 1000.000
1:THR_10:C         1:PHE_11:N         1:PHE_11:CA        1:PHE_11:C         -90.000 -40.000 200.00 200.00 1000.000
1:PHE_11:C         1:LYS_12:N         1:LYS_12:CA        1:LYS_12:C         -90.000 -40.000 200.00 200.00 1000.000
1:LYS_12:C         1:ASN_13:N         1:ASN_13:CA        1:ASN_13:C         -90.000 -40.000 200.00 200.00 1000.000
1:VAL_14:C         1:VAL_15:N         1:VAL_15:CA        1:VAL_15:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_15:C         1:LEU_16:N         1:LEU_16:CA        1:LEU_16:C         -90.000 -40.000 200.00 200.00 1000.000
1:LEU_16:C         1:GLU_17:N         1:GLU_17:CA        1:GLU_17:C         -160.000 -80.000 200.00 200.00 1000.000
1:GLU_17:C         1:SER_18:N         1:SER_18:CA        1:SER_18:C         -90.000 -40.000 200.00 200.00 1000.000
1:SER_18:C         1:SER_19:N         1:SER_19:CA        1:SER_19:C         -160.000 -80.000 200.00 200.00 1000.000
1:SER_19:C         1:VAL_20:N         1:VAL_20:CA        1:VAL_20:C         -160.000 -80.000 200.00 200.00 1000.000
1:PRO_21:C         1:VAL_22:N         1:VAL_22:CA        1:VAL_22:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_22:C         1:LEU_23:N         1:LEU_23:CA        1:LEU_23:C         -160.000 -80.000 200.00 200.00 1000.000
1:LEU_23:C         1:VAL_24:N         1:VAL_24:CA        1:VAL_24:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_24:C         1:ASP_25:N         1:ASP_25:CA        1:ASP_25:C         -160.000 -80.000 200.00 200.00 1000.000
1:ASP_25:C         1:PHE_26:N         1:PHE_26:CA        1:PHE_26:C         -160.000 -80.000 200.00 200.00 1000.000
1:PHE_26:C         1:TRP_27:N         1:TRP_27:CA        1:TRP_27:C         -160.000 -80.000 200.00 200.00 1000.000
1:PRO_33:C         1:CYS_34:N         1:CYS_34:CA        1:CYS_34:C         -90.000 -40.000 200.00 200.00 1000.000
1:CYS_34:C         1:ARG_35:N         1:ARG_35:CA        1:ARG_35:C         -90.000 -40.000 200.00 200.00 1000.000
1:ARG_35:C         1:ILE_36:N         1:ILE_36:CA        1:ILE_36:C         -90.000 -40.000 200.00 200.00 1000.000
1:ILE_36:C         1:ILE_37:N         1:ILE_37:CA        1:ILE_37:C         -90.000 -40.000 200.00 200.00 1000.000
1:ILE_37:C         1:ALA_38:N         1:ALA_38:CA        1:ALA_38:C         -90.000 -40.000 200.00 200.00 1000.000
1:VAL_40:C         1:VAL_41:N         1:VAL_41:CA        1:VAL_41:C         -90.000 -40.000 200.00 200.00 1000.000
1:VAL_41:C         1:ASP_42:N         1:ASP_42:CA        1:ASP_42:C         -90.000 -40.000 200.00 200.00 1000.000
1:ASP_42:C         1:GLU_43:N         1:GLU_43:CA        1:GLU_43:C         -90.000 -40.000 200.00 200.00 1000.000
1:GLU_43:C         1:ILE_44:N         1:ILE_44:CA        1:ILE_44:C         -90.000 -40.000 200.00 200.00 1000.000
1:ILE_44:C         1:ALA_45:N         1:ALA_45:CA        1:ALA_45:C         -90.000 -40.000 200.00 200.00 1000.000
1:GLY_46:C         1:GLU_47:N         1:GLU_47:CA        1:GLU_47:C         -90.000 -40.000 200.00 200.00 1000.000
1:GLU_47:C         1:TYR_48:N         1:TYR_48:CA        1:TYR_48:C         -160.000 -80.000 200.00 200.00 1000.000
1:TYR_48:C         1:LYS_49:N         1:LYS_49:CA        1:LYS_49:C         -90.000 -40.000 200.00 200.00 1000.000
1:ASP_50:C         1:LYS_51:N         1:LYS_51:CA        1:LYS_51:C         -160.000 -80.000 200.00 200.00 1000.000
1:LYS_51:C         1:LEU_52:N         1:LEU_52:CA        1:LEU_52:C         -160.000 -80.000 200.00 200.00 1000.000
1:LEU_52:C         1:LYS_53:N         1:LYS_53:CA        1:LYS_53:C         -160.000 -80.000 200.00 200.00 1000.000
1:LYS_53:C         1:CYS_54:N        1:CYS_54:CA       1:CYS_54:C        -160.000 -80.000 200.00 200.00 1000.000
1:CYS_54:C        1:VAL_55:N         1:VAL_55:CA        1:VAL_55:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_55:C         1:LYS_56:N         1:LYS_56:CA        1:LYS_56:C         -160.000 -80.000 200.00 200.00 1000.000
1:LYS_56:C         1:LEU_57:N         1:LEU_57:CA        1:LEU_57:C         -160.000 -80.000 200.00 200.00 1000.000
1:ASP_60:C         1:GLU_61:N         1:GLU_61:CA        1:GLU_61:C         -160.000 -80.000 200.00 200.00 1000.000
1:GLU_61:C         1:SER_62:N         1:SER_62:CA        1:SER_62:C         -160.000 -80.000 200.00 200.00 1000.000
1:ASN_64:C         1:VAL_65:N         1:VAL_65:CA        1:VAL_65:C         -90.000 -40.000 200.00 200.00 1000.000
1:VAL_65:C         1:ALA_66:N         1:ALA_66:CA        1:ALA_66:C         -90.000 -40.000 200.00 200.00 1000.000
1:SER_67:C         1:GLU_68:N         1:GLU_68:CA        1:GLU_68:C         -90.000 -40.000 200.00 200.00 1000.000
1:GLU_68:C         1:TYR_69:N         1:TYR_69:CA        1:TYR_69:C         -160.000 -80.000 200.00 200.00 1000.000
1:ILE_71:C         1:ARG_72:N         1:ARG_72:CA        1:ARG_72:C         -160.000 -80.000 200.00 200.00 1000.000
1:SER_73:C         1:ILE_74:N         1:ILE_74:CA        1:ILE_74:C         -160.000 -80.000 200.00 200.00 1000.000
1:PRO_75:C         1:THR_76:N         1:THR_76:CA        1:THR_76:C         -160.000 -80.000 200.00 200.00 1000.000
1:THR_76:C         1:ILE_77:N         1:ILE_77:CA        1:ILE_77:C         -160.000 -80.000 200.00 200.00 1000.000
1:ILE_77:C         1:MET_78:N         1:MET_78:CA        1:MET_78:C         -160.000 -80.000 200.00 200.00 1000.000
1:MET_78:C         1:VAL_79:N         1:VAL_79:CA        1:VAL_79:C         -160.000 -80.000 200.00 200.00 1000.000
1:VAL_79:C         1:PHE_80:N         1:PHE_80:CA        1:PHE_80:C         -160.000 -80.000 200.00 200.00 1000.000
1:GLY_83:C         1:LYS_84:N         1:LYS_84:CA        1:LYS_84:C         -160.000 -80.000 200.00 200.00 1000.000
1:LYS_84:C         1:LYS_85:N         1:LYS_85:CA        1:LYS_85:C         -90.000 -40.000 200.00 200.00 1000.000
1:LYS_85:C         1:CYS_86:N        1:CYS_86:CA       1:CYS_86:C        -160.000 -80.000 200.00 200.00 1000.000
1:GLU_87:C         1:THR_88:N         1:THR_88:CA        1:THR_88:C         -160.000 -80.000 200.00 200.00 1000.000
1:THR_88:C         1:ILE_89:N         1:ILE_89:CA        1:ILE_89:C         -160.000 -80.000 200.00 200.00 1000.000
1:ILE_89:C         1:ILE_90:N         1:ILE_90:CA        1:ILE_90:C         -160.000 -80.000 200.00 200.00 1000.000
1:ALA_92:C         1:VAL_93:N         1:VAL_93:CA        1:VAL_93:C         -160.000 -80.000 200.00 200.00 1000.000
1:PRO_94:C         1:LYS_95:N         1:LYS_95:CA        1:LYS_95:C         -90.000 -40.000 200.00 200.00 1000.000
1:LYS_95:C         1:ALA_96:N         1:ALA_96:CA        1:ALA_96:C         -90.000 -40.000 200.00 200.00 1000.000
1:ILE_98:C         1:VAL_99:N         1:VAL_99:CA        1:VAL_99:C         -90.000 -40.000 200.00 200.00 1000.000
1:VAL_99:C         1:GLN_100:N        1:GLN_100:CA       1:GLN_100:C        -90.000 -40.000 200.00 200.00 1000.000
1:GLN_100:C        1:THR_101:N        1:THR_101:CA       1:THR_101:C        -90.000 -40.000 200.00 200.00 1000.000
1:VAL_102:C        1:GLU_103:N        1:GLU_103:CA       1:GLU_103:C        -90.000 -40.000 200.00 200.00 1000.000
1:GLU_103:C        1:LYS_104:N        1:LYS_104:CA       1:LYS_104:C        -90.000 -40.000 200.00 200.00 1000.000
!
1:VAL_6:HA         1:VAL_6:CA         1:VAL_6:CB         1:VAL_6:HB         -120.000 -1.000 50.00 50.00 1000.000
1:PHE_11:N         1:PHE_11:CA        1:PHE_11:CB        1:PHE_11:CG        120.000 -120.000 50.00 50.00 1000.000
1:VAL_14:HA        1:VAL_14:CA        1:VAL_14:CB        1:VAL_14:HB        120.000 -120.000 50.00 50.00 1000.000
1:VAL_15:HA        1:VAL_15:CA        1:VAL_15:CB        1:VAL_15:HB        120.000 -120.000 50.00 50.00 1000.000
1:LEU_16:N         1:LEU_16:CA        1:LEU_16:CB        1:LEU_16:CG        -120.000 -1.000 50.00 50.00 1000.000
1:LEU_16:CA        1:LEU_16:CB        1:LEU_16:CG        1:LEU_16:HG         1.000 120.000 50.00 50.00 1000.000
1:SER_19:N         1:SER_19:CA        1:SER_19:CB        1:SER_19:OG         1.000 120.000 50.00 50.00 1000.000
1:VAL_22:HA        1:VAL_22:CA        1:VAL_22:CB        1:VAL_22:HB        120.000 -120.000 50.00 50.00 1000.000
1:LEU_23:N         1:LEU_23:CA        1:LEU_23:CB        1:LEU_23:CG        120.000 -1.000 50.00 50.00 1000.000
1:ASP_25:N         1:ASP_25:CA        1:ASP_25:CB        1:ASP_25:CG        120.000 -120.000 50.00 50.00 1000.000
1:PHE_26:N         1:PHE_26:CA        1:PHE_26:CB        1:PHE_26:CG        -120.000 -1.000 50.00 50.00 1000.000
1:TRP_27:N         1:TRP_27:CA        1:TRP_27:CB        1:TRP_27:CG         1.000 120.000 50.00 50.00 1000.000
1:TRP_30:N         1:TRP_30:CA        1:TRP_30:CB        1:TRP_30:CG         1.000 120.000 50.00 50.00 1000.000
1:CYS_31:N         1:CYS_31:CA        1:CYS_31:CB        1:CYS_31:SG        120.000 -120.000 50.00 50.00 1000.000
1:CYS_34:N         1:CYS_34:CA        1:CYS_34:CB        1:CYS_34:SG        -120.000 -1.000 50.00 50.00 1000.000
1:ARG_35:N         1:ARG_35:CA        1:ARG_35:CB        1:ARG_35:CG        120.000 -1.000 50.00 50.00 1000.000
1:VAL_40:HA        1:VAL_40:CA        1:VAL_40:CB        1:VAL_40:HB        120.000 -120.000 50.00 50.00 1000.000
1:VAL_41:HA        1:VAL_41:CA        1:VAL_41:CB        1:VAL_41:HB        120.000 -120.000 50.00 50.00 1000.000
1:ILE_44:N         1:ILE_44:CA        1:ILE_44:CB        1:ILE_44:CG1       -120.000 -1.000 50.00 50.00 1000.000
1:GLU_47:N         1:GLU_47:CA        1:GLU_47:CB        1:GLU_47:CG        120.000 -1.000 50.00 50.00 1000.000
1:TYR_48:N         1:TYR_48:CA        1:TYR_48:CB        1:TYR_48:CG        -120.000 -1.000 50.00 50.00 1000.000
1:LEU_52:N         1:LEU_52:CA        1:LEU_52:CB        1:LEU_52:CG        120.000 -120.000 50.00 50.00 1000.000
1:LEU_52:CA        1:LEU_52:CB        1:LEU_52:CG        1:LEU_52:HG        -120.000 -1.000 50.00 50.00 1000.000
1:CYS_54:N        1:CYS_54:CA       1:CYS_54:CB       1:CYS_54:SG       120.000 -120.000 50.00 50.00 1000.000
1:LEU_57:N         1:LEU_57:CA        1:LEU_57:CB        1:LEU_57:CG        120.000 -120.000 50.00 50.00 1000.000
1:ASN_58:N         1:ASN_58:CA        1:ASN_58:CB        1:ASN_58:CG        120.000 -120.000 50.00 50.00 1000.000
1:VAL_65:HA        1:VAL_65:CA        1:VAL_65:CB        1:VAL_65:HB        120.000 -120.000 50.00 50.00 1000.000
1:ILE_74:N         1:ILE_74:CA        1:ILE_74:CB        1:ILE_74:CG1        1.000 120.000 50.00 50.00 1000.000
1:THR_76:N         1:THR_76:CA        1:THR_76:CB        1:THR_76:OG1       -120.000 -1.000 50.00 50.00 1000.000
1:VAL_79:HA        1:VAL_79:CA        1:VAL_79:CB        1:VAL_79:HB        120.000 -120.000 50.00 50.00 1000.000
1:PHE_80:N         1:PHE_80:CA        1:PHE_80:CB        1:PHE_80:CG        -120.000 -1.000 50.00 50.00 1000.000
1:VAL_93:HA        1:VAL_93:CA        1:VAL_93:CB        1:VAL_93:HB        -120.000 -1.000 50.00 50.00 1000.000
1:THR_97:N         1:THR_97:CA        1:THR_97:CB        1:THR_97:OG1       -120.000 -1.000 50.00 50.00 1000.000
1:ILE_98:N         1:ILE_98:CA        1:ILE_98:CB        1:ILE_98:CG1       -120.000 -1.000 50.00 50.00 1000.000
1:VAL_99:HA        1:VAL_99:CA        1:VAL_99:CB        1:VAL_99:HB        120.000 -120.000 50.00 50.00 1000.000
1:THR_101:N        1:THR_101:CA       1:THR_101:CB       1:THR_101:OG1      -120.000 -1.000 50.00 50.00 1000.000

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1  -7.606   2.873  -6.662
    2   2H    MET   1          2H        MET   1  -8.481   1.533  -6.466
    3   3H    MET   1          3H        MET   1  -9.280   2.893  -6.754
    4    HA   MET   1           HA       MET   1  -9.173   1.323  -8.629
    5   1HB   MET   1          1HB       MET   1  -8.633   2.727 -10.383
    6   2HB   MET   1          2HB       MET   1  -9.069   3.850  -9.106
    7   1HG   MET   1          1HG       MET   1  -6.266   3.152 -10.083
    8   2HG   MET   1          2HG       MET   1  -7.131   4.659 -10.328
    9   1HE   MET   1          1HE       MET   1  -8.299   5.521  -7.589
   10   2HE   MET   1          2HE       MET   1  -7.302   6.573  -8.625
   11   3HE   MET   1          3HE       MET   1  -6.923   6.402  -6.897
   12    H    GLU   2           HN       GLU   2  -7.386   0.703 -10.504
   13    HA   GLU   2           HA       GLU   2  -5.944  -1.359  -9.440
   14   1HB   GLU   2          1HB       GLU   2  -4.709  -1.441 -11.526
   15   2HB   GLU   2          2HB       GLU   2  -6.421  -1.169 -11.811
   16   1HG   GLU   2          2HG       GLU   2  -4.239   0.978 -11.946
   17   2HG   GLU   2          1HG       GLU   2  -4.924   0.120 -13.324
   18    H    ALA   3           H        ALA   3  -3.988  -1.790  -8.631
   19    HA   ALA   3           HA       ALA   3  -2.649   0.255  -7.242
   20   1HB   ALA   3          1HB       ALA   3  -1.801  -2.621  -7.761
   21   2HB   ALA   3          2HB       ALA   3  -2.927  -2.109  -6.497
   22   3HB   ALA   3          3HB       ALA   3  -1.236  -1.567  -6.436
   23    H    GLY   4           H        GLY   4  -1.010   1.587  -7.802
   24   1HA   GLY   4          1HA       GLY   4   0.464   1.152 -10.334
   25   2HA   GLY   4          2HA       GLY   4   0.540   2.551  -9.255
   26    H    ALA   5           H        ALA   5   2.938   2.191  -9.787
   27    HA   ALA   5           HA       ALA   5   4.192   0.440  -7.722
   28   1HB   ALA   5          1HB       ALA   5   4.561  -0.570  -9.941
   29   2HB   ALA   5          2HB       ALA   5   6.066   0.099  -9.276
   30   3HB   ALA   5          3HB       ALA   5   5.192   0.978 -10.550
   31    H    VAL   6           H        VAL   6   5.823   1.514  -6.552
   32    HA   VAL   6           HA       VAL   6   6.556   4.269  -7.387
   33    HB   VAL   6           HB       VAL   6   6.349   4.812  -4.817
   34   1HG1  VAL   6          1HG1      VAL   6   4.541   3.749  -3.635
   35   2HG1  VAL   6          2HG1      VAL   6   4.196   2.678  -5.005
   36   3HG1  VAL   6          3HG1      VAL   6   5.721   2.522  -4.128
   37   1HG2  VAL   6          1HG2      VAL   6   5.173   6.083  -6.407
   38   2HG2  VAL   6          2HG2      VAL   6   4.029   5.615  -5.140
   39   3HG2  VAL   6          3HG2      VAL   6   4.011   4.784  -6.719
   40    H    ASN   7           H        ASN   7   8.259   5.137  -6.069
   41    HA   ASN   7           HA       ASN   7  10.048   3.351  -4.639
   42   1HB   ASN   7          1HB       ASN   7  10.792   4.617  -7.301
   43   2HB   ASN   7          2HB       ASN   7  12.012   4.297  -6.077
   44   1HD2  ASN   7          2HD2      ASN   7  11.752   2.027  -4.973
   45   2HD2  ASN   7          1HD2      ASN   7  11.697   0.711  -6.137
   46    H    ASP   8           HN       ASP   8  11.942   4.873  -3.939
   47    HA   ASP   8           HA       ASP   8  11.088   6.706  -2.150
   48   1HB   ASP   8          2HB       ASP   8  13.458   6.029  -2.457
   49   2HB   ASP   8          1HB       ASP   8  13.603   7.095  -3.847
   50    H    ASP   9           HN       ASP   9  12.245   7.791  -5.321
   51    HA   ASP   9           HA       ASP   9  11.588  10.463  -5.169
   52   1HB   ASP   9          1HB       ASP   9  11.495   8.714  -7.677
   53   2HB   ASP   9          2HB       ASP   9  11.758  10.460  -7.603
   54    H    THR  10           H        THR  10   9.524   7.924  -6.752
   55    HA   THR  10           HA       THR  10   7.444   9.793  -7.406
   56    HB   THR  10           HB       THR  10   6.248   7.559  -7.908
   57    HG1  THR  10           HG1      THR  10   7.893   5.852  -8.073
   58   1HG2  THR  10          1HG2      THR  10   8.963   8.120  -9.193
   59   2HG2  THR  10          2HG2      THR  10   7.428   8.906  -9.619
   60   3HG2  THR  10          3HG2      THR  10   7.642   7.172  -9.908
   61    H    PHE  11           H        PHE  11   8.004   7.586  -4.709
   62    HA   PHE  11           HA       PHE  11   5.571   7.376  -3.457
   63   1HB   PHE  11          1HB       PHE  11   7.726   6.415  -2.697
   64   2HB   PHE  11          2HB       PHE  11   8.261   7.985  -2.175
   65    HD1  PHE  11           HD1      PHE  11   7.528   8.995  -0.106
   66    HD2  PHE  11           HD2      PHE  11   5.885   5.241  -1.446
   67    HE1  PHE  11           HE1      PHE  11   6.500   8.662   2.105
   68    HE2  PHE  11           HE2      PHE  11   4.862   4.902   0.788
   69    HZ   PHE  11           HZ       PHE  11   5.060   6.647   2.526
   70    H    LYS  12           HN       LYS  12   7.860  10.014  -3.191
   71    HA   LYS  12           HA       LYS  12   6.569  11.703  -1.343
   72   1HB   LYS  12          2HB       LYS  12   8.008  12.653  -3.858
   73   2HB   LYS  12          1HB       LYS  12   7.755  13.576  -2.377
   74   1HG   LYS  12          1HG       LYS  12   9.460  11.064  -2.676
   75   2HG   LYS  12          2HG       LYS  12  10.056  12.714  -2.602
   76   1HD   LYS  12          1HD       LYS  12   9.185  12.952  -0.300
   77   2HD   LYS  12          2HD       LYS  12   8.582  11.283  -0.338
   78   1HE   LYS  12          2HE       LYS  12  11.511  12.049  -0.710
   79   2HE   LYS  12          1HE       LYS  12  10.794  11.540   0.826
   80   1HZ   LYS  12          1HZ       LYS  12  10.849   9.900  -1.613
   81   2HZ   LYS  12          2HZ       LYS  12  11.863   9.744  -0.328
   82   3HZ   LYS  12          3HZ       LYS  12  10.252   9.453  -0.145
   83    H    ASN  13           H        ASN  13   6.142  11.712  -4.887
   84    HA   ASN  13           HA       ASN  13   3.988  13.664  -4.928
   85   1HB   ASN  13          2HB       ASN  13   5.307  11.767  -6.877
   86   2HB   ASN  13          1HB       ASN  13   3.698  12.343  -7.261
   87   1HD2  ASN  13          2HD2      ASN  13   5.798  14.599  -5.422
   88   2HD2  ASN  13          1HD2      ASN  13   6.182  15.569  -6.828
   89    H    VAL  14           H        VAL  14   4.042  10.196  -5.569
   90    HA   VAL  14           HA       VAL  14   1.214   9.937  -5.907
   91    HB   VAL  14           HB       VAL  14   3.505   7.960  -5.451
   92   1HG1  VAL  14          1HG1      VAL  14   3.412   7.672  -7.913
   93   2HG1  VAL  14          2HG1      VAL  14   2.129   8.893  -8.012
   94   3HG1  VAL  14          3HG1      VAL  14   3.767   9.351  -7.509
   95   1HG2  VAL  14          1HG2      VAL  14   1.492   6.740  -4.984
   96   2HG2  VAL  14          2HG2      VAL  14   2.021   6.315  -6.620
   97   3HG2  VAL  14          3HG2      VAL  14   0.673   7.452  -6.404
   98    H    VAL  15           H        VAL  15   3.202   9.724  -3.000
   99    HA   VAL  15           HA       VAL  15   0.812   8.723  -1.512
  100    HB   VAL  15           HB       VAL  15   3.705   8.412  -0.657
  101   1HG1  VAL  15          1HG1      VAL  15   1.118   7.066   0.204
  102   2HG1  VAL  15          2HG1      VAL  15   2.742   6.743   0.839
  103   3HG1  VAL  15          3HG1      VAL  15   1.988   8.315   1.116
  104   1HG2  VAL  15          1HG2      VAL  15   1.952   6.491  -2.235
  105   2HG2  VAL  15          2HG2      VAL  15   3.472   6.063  -1.432
  106   3HG2  VAL  15          3HG2      VAL  15   3.477   7.206  -2.766
  107    H    LEU  16           H        LEU  16   3.798  10.576  -0.588
  108    HA   LEU  16           HA       LEU  16   2.523  11.750   1.637
  109   1HB   LEU  16          1HB       LEU  16   4.862  12.840   0.017
  110   2HB   LEU  16          2HB       LEU  16   4.352  13.406   1.593
  111    HG   LEU  16           HG       LEU  16   5.444  10.642   0.917
  112   1HD1  LEU  16          1HD1      LEU  16   6.544  12.866   2.690
  113   2HD1  LEU  16          2HD1      LEU  16   7.347  11.335   2.281
  114   3HD1  LEU  16          3HD1      LEU  16   7.063  12.556   1.024
  115   1HD2  LEU  16          1HD2      LEU  16   3.848  10.267   2.700
  116   2HD2  LEU  16          2HD2      LEU  16   5.441  10.356   3.462
  117   3HD2  LEU  16          3HD2      LEU  16   4.353  11.750   3.545
  118    H    GLU  17           HN       GLU  17   2.889  13.123  -1.640
  119    HA   GLU  17           HA       GLU  17   1.289  15.485  -0.900
  120   1HB   GLU  17          2HB       GLU  17   2.544  14.569  -3.502
  121   2HB   GLU  17          1HB       GLU  17   1.852  16.156  -3.203
  122   1HG   GLU  17          1HG       GLU  17   3.561  16.714  -1.588
  123   2HG   GLU  17          2HG       GLU  17   4.222  15.078  -1.600
  124    H    SER  18           H        SER  18   0.086  12.510  -1.202
  125    HA   SER  18           HA       SER  18  -1.607  12.753  -3.524
  126   1HB   SER  18          2HB       SER  18  -2.656  10.729  -2.716
  127   2HB   SER  18          1HB       SER  18  -0.915  10.599  -2.527
  128    HG   SER  18           HG       SER  18  -1.073  10.806  -0.395
  129    H    SER  19           H        SER  19  -3.843  13.149  -3.664
  130    HA   SER  19           HA       SER  19  -5.031  14.919  -1.636
  131   1HB   SER  19          1HB       SER  19  -6.746  15.024  -3.579
  132   2HB   SER  19          2HB       SER  19  -5.130  15.702  -3.875
  133    HG   SER  19           HG       SER  19  -5.760  14.292  -5.579
  134    H    VAL  20           H        VAL  20  -5.941  12.160  -3.619
  135    HA   VAL  20           HA       VAL  20  -8.120  11.267  -1.880
  136    HB   VAL  20           HB       VAL  20  -7.622   9.183  -3.605
  137   1HG1  VAL  20          1HG1      VAL  20  -5.748  10.333  -4.729
  138   2HG1  VAL  20          2HG1      VAL  20  -7.091   9.884  -5.789
  139   3HG1  VAL  20          3HG1      VAL  20  -6.905  11.572  -5.299
  140   1HG2  VAL  20          1HG2      VAL  20  -9.418  10.025  -4.998
  141   2HG2  VAL  20          2HG2      VAL  20  -9.280  11.625  -4.239
  142   3HG2  VAL  20          3HG2      VAL  20  -9.785  10.216  -3.276
  143    HA   PRO  21           HA       PRO  21  -5.991   8.413   0.712
  144   1HB   PRO  21          1HB       PRO  21  -7.783   6.231  -0.375
  145   2HB   PRO  21          2HB       PRO  21  -7.387   6.565   1.334
  146   1HG   PRO  21          2HG       PRO  21  -9.732   7.326   0.307
  147   2HG   PRO  21          1HG       PRO  21  -8.833   8.484   1.334
  148   1HD   PRO  21          2HD       PRO  21  -9.005   8.455  -1.692
  149   2HD   PRO  21          1HD       PRO  21  -9.122   9.794  -0.578
  150    H    VAL  22           H        VAL  22  -4.746   6.338   0.732
  151    HA   VAL  22           HA       VAL  22  -3.901   5.377  -1.905
  152    HB   VAL  22           HB       VAL  22  -1.821   6.467   0.018
  153   1HG1  VAL  22          1HG1      VAL  22  -1.046   4.763  -1.630
  154   2HG1  VAL  22          2HG1      VAL  22  -1.418   5.937  -2.916
  155   3HG1  VAL  22          3HG1      VAL  22  -0.233   6.327  -1.678
  156   1HG2  VAL  22          1HG2      VAL  22  -1.505   8.372  -1.546
  157   2HG2  VAL  22          2HG2      VAL  22  -3.051   8.440  -0.695
  158   3HG2  VAL  22          3HG2      VAL  22  -2.989   7.915  -2.391
  159    H    LEU  23           H        LEU  23  -2.998   3.282  -1.796
  160    HA   LEU  23           HA       LEU  23  -2.621   2.120   0.961
  161   1HB   LEU  23          1HB       LEU  23  -4.776   1.460   0.089
  162   2HB   LEU  23          2HB       LEU  23  -4.065   0.736  -1.343
  163    HG   LEU  23           HG       LEU  23  -2.948  -0.181   1.285
  164   1HD1  LEU  23          1HD1      LEU  23  -3.987  -1.615  -1.209
  165   2HD1  LEU  23          2HD1      LEU  23  -3.213  -2.426   0.147
  166   3HD1  LEU  23          3HD1      LEU  23  -2.277  -1.292  -0.834
  167   1HD2  LEU  23          1HD2      LEU  23  -5.396   0.043   1.802
  168   2HD2  LEU  23          2HD2      LEU  23  -4.792  -1.619   1.863
  169   3HD2  LEU  23          3HD2      LEU  23  -5.736  -1.078   0.468
  170    H    VAL  24           H        VAL  24  -0.407   2.065   1.009
  171    HA   VAL  24           HA       VAL  24   1.068   1.331  -1.492
  172    HB   VAL  24           HB       VAL  24   2.139   2.470   1.111
  173   1HG1  VAL  24          1HG1      VAL  24   4.159   2.920  -0.282
  174   2HG1  VAL  24          2HG1      VAL  24   3.834   1.193  -0.136
  175   3HG1  VAL  24          3HG1      VAL  24   3.409   2.051  -1.632
  176   1HG2  VAL  24          1HG2      VAL  24   1.656   3.888  -1.544
  177   2HG2  VAL  24          2HG2      VAL  24   0.669   4.118  -0.084
  178   3HG2  VAL  24          3HG2      VAL  24   2.372   4.575  -0.073
  179    H    ASP  25           HN       ASP  25   1.686  -0.793  -1.669
  180    HA   ASP  25           HA       ASP  25   1.922  -2.455   0.789
  181   1HB   ASP  25          2HB       ASP  25   0.565  -3.425  -0.965
  182   2HB   ASP  25          1HB       ASP  25   1.844  -3.147  -2.154
  183    H    PHE  26           H        PHE  26   3.943  -2.321   1.711
  184    HA   PHE  26           HA       PHE  26   6.299  -1.680   0.043
  185   1HB   PHE  26          2HB       PHE  26   5.917  -2.377   2.966
  186   2HB   PHE  26          1HB       PHE  26   7.491  -2.257   2.212
  187    HD1  PHE  26           HD1      PHE  26   8.646  -0.232   2.287
  188    HD2  PHE  26           HD2      PHE  26   4.336  -0.179   2.553
  189    HE1  PHE  26           HE1      PHE  26   8.703   2.172   2.886
  190    HE2  PHE  26           HE2      PHE  26   4.405   2.233   3.081
  191    HZ   PHE  26           HZ       PHE  26   6.588   3.394   3.355
  192    H    TRP  27           H        TRP  27   6.988  -3.308  -1.279
  193    HA   TRP  27           HA       TRP  27   6.734  -6.138  -0.361
  194   1HB   TRP  27          2HB       TRP  27   6.047  -6.813  -2.535
  195   2HB   TRP  27          1HB       TRP  27   5.033  -5.443  -2.135
  196    HD1  TRP  27           HD1      TRP  27   6.012  -3.057  -3.253
  197    HE1  TRP  27           HE1      TRP  27   7.338  -2.590  -5.439
  198    HE3  TRP  27           HE3      TRP  27   7.181  -7.872  -4.543
  199    HZ2  TRP  27           HZ2      TRP  27   8.944  -4.121  -7.280
  200    HZ3  TRP  27           HZ3      TRP  27   8.458  -8.323  -6.588
  201    HH2  TRP  27           HH2      TRP  27   9.363  -6.466  -7.959
  202    H    ALA  28           H        ALA  28   7.989  -7.443  -2.308
  203    HA   ALA  28           HA       ALA  28  10.296  -6.246  -3.393
  204   1HB   ALA  28          1HB       ALA  28  10.812  -8.050  -0.982
  205   2HB   ALA  28          2HB       ALA  28  12.047  -7.479  -2.116
  206   3HB   ALA  28          3HB       ALA  28  11.216  -6.316  -1.075
  207    HA   PRO  29           HA       PRO  29   9.697  -9.981  -5.758
  208   1HB   PRO  29          1HB       PRO  29  12.255 -10.578  -6.633
  209   2HB   PRO  29          2HB       PRO  29  11.159  -9.331  -7.324
  210   1HG   PRO  29          1HG       PRO  29  13.365  -8.914  -5.271
  211   2HG   PRO  29          2HG       PRO  29  13.079  -7.985  -6.776
  212   1HD   PRO  29          2HD       PRO  29  12.116  -6.985  -4.479
  213   2HD   PRO  29          1HD       PRO  29  11.058  -7.047  -5.887
  214    H    TRP  30           H        TRP  30  12.277 -10.063  -3.258
  215    HA   TRP  30           HA       TRP  30  12.190 -12.980  -3.094
  216   1HB   TRP  30          2HB       TRP  30  13.473 -12.579  -0.983
  217   2HB   TRP  30          1HB       TRP  30  14.199 -11.981  -2.464
  218    HD1  TRP  30           HD1      TRP  30  15.054  -9.609  -2.461
  219    HE1  TRP  30           HE1      TRP  30  15.022  -7.612  -0.843
  220    HE3  TRP  30           HE3      TRP  30  11.702 -11.411   0.976
  221    HZ2  TRP  30           HZ2      TRP  30  13.595  -6.846   1.548
  222    HZ3  TRP  30           HZ3      TRP  30  11.010 -10.011   2.887
  223    HH2  TRP  30           HH2      TRP  30  11.892  -7.706   3.142
  224    H    CYS  31           H        CYS  31   9.973 -10.533  -2.121
  225    HA   CYS  31           HA       CYS  31   9.176 -11.896   0.377
  226   1HB   CYS  31          2HB       CYS  31   9.212  -9.475   0.329
  227   2HB   CYS  31          1HB       CYS  31   8.031  -9.461  -0.988
  228    H    GLY  32           H        GLY  32   8.710 -13.900  -0.673
  229   1HA   GLY  32          1HA       GLY  32   6.847 -14.659  -2.498
  230   2HA   GLY  32          2HA       GLY  32   7.022 -15.482  -0.943
  231    HA   PRO  33           HA       PRO  33   3.017 -14.265   0.370
  232   1HB   PRO  33          2HB       PRO  33   3.136 -12.441   2.478
  233   2HB   PRO  33          1HB       PRO  33   3.286 -14.214   2.593
  234   1HG   PRO  33          2HG       PRO  33   5.494 -12.173   2.512
  235   2HG   PRO  33          1HG       PRO  33   5.364 -13.634   3.520
  236   1HD   PRO  33          1HD       PRO  33   6.885 -13.515   1.295
  237   2HD   PRO  33          2HD       PRO  33   6.012 -15.023   1.686
  238    H    CYS  34           H        CYS  34   5.128 -11.422   0.001
  239    HA   CYS  34           HA       CYS  34   3.041  -9.484  -0.445
  240   1HB   CYS  34          2HB       CYS  34   5.799  -9.400  -1.715
  241   2HB   CYS  34          1HB       CYS  34   4.621  -8.117  -1.490
  242    H    ARG  35           HN       ARG  35   5.073 -11.455  -2.659
  243    HA   ARG  35           HA       ARG  35   3.911 -10.597  -5.086
  244   1HB   ARG  35          2HB       ARG  35   5.326 -13.141  -4.209
  245   2HB   ARG  35          1HB       ARG  35   4.716 -12.932  -5.855
  246   1HG   ARG  35          2HG       ARG  35   6.081 -11.018  -6.263
  247   2HG   ARG  35          1HG       ARG  35   6.501 -10.844  -4.550
  248   1HD   ARG  35          1HD       ARG  35   8.316 -11.799  -5.939
  249   2HD   ARG  35          2HD       ARG  35   7.846 -12.814  -4.556
  250    HE   ARG  35           HE       ARG  35   6.404 -13.633  -6.879
  251   1HH1  ARG  35          2HH1      ARG  35   9.706 -13.564  -5.613
  252   2HH1  ARG  35          1HH1      ARG  35  10.203 -15.028  -6.419
  253   1HH2  ARG  35          2HH2      ARG  35   7.042 -15.546  -7.962
  254   2HH2  ARG  35          1HH2      ARG  35   8.663 -16.164  -7.801
  255    H    ILE  36           H        ILE  36   2.942 -13.445  -3.037
  256    HA   ILE  36           HA       ILE  36   0.793 -14.024  -4.944
  257    HB   ILE  36           HB       ILE  36   0.104 -15.785  -3.449
  258   1HG1  ILE  36          2HG1      ILE  36   1.842 -16.185  -1.461
  259   2HG1  ILE  36          1HG1      ILE  36   1.918 -14.428  -1.483
  260   1HG2  ILE  36          1HG2      ILE  36   2.122 -17.117  -3.607
  261   2HG2  ILE  36          2HG2      ILE  36   2.019 -16.061  -5.022
  262   3HG2  ILE  36          3HG2      ILE  36   3.142 -15.670  -3.701
  263   1HD1  ILE  36          1HD1      ILE  36  -0.547 -16.199  -1.110
  264   2HD1  ILE  36          2HD1      ILE  36   0.240 -15.210   0.134
  265   3HD1  ILE  36          3HD1      ILE  36  -0.633 -14.434  -1.200
  266    H    ILE  37           H        ILE  37   0.968 -11.916  -2.099
  267    HA   ILE  37           HA       ILE  37  -1.931 -11.622  -1.959
  268    HB   ILE  37           HB       ILE  37   0.467 -10.251  -0.684
  269   1HG1  ILE  37          1HG1      ILE  37  -0.177 -12.573   0.081
  270   2HG1  ILE  37          2HG1      ILE  37  -0.225 -11.335   1.323
  271   1HG2  ILE  37          1HG2      ILE  37  -1.281  -9.224   0.892
  272   2HG2  ILE  37          2HG2      ILE  37  -2.439  -9.464  -0.438
  273   3HG2  ILE  37          3HG2      ILE  37  -0.968  -8.472  -0.661
  274   1HD1  ILE  37          1HD1      ILE  37  -2.646 -12.509  -0.128
  275   2HD1  ILE  37          2HD1      ILE  37  -2.710 -11.248   1.125
  276   3HD1  ILE  37          3HD1      ILE  37  -2.112 -12.869   1.510
  277    H    ALA  38           H        ALA  38   0.697  -9.838  -3.533
  278    HA   ALA  38           HA       ALA  38  -0.297  -7.496  -4.281
  279   1HB   ALA  38          1HB       ALA  38   1.095  -9.396  -6.214
  280   2HB   ALA  38          2HB       ALA  38   1.875  -8.365  -4.998
  281   3HB   ALA  38          3HB       ALA  38   0.991  -7.636  -6.348
  282    HA   PRO  39           HA       PRO  39  -3.010  -9.010  -7.978
  283   1HB   PRO  39          2HB       PRO  39  -4.018 -11.666  -7.039
  284   2HB   PRO  39          1HB       PRO  39  -3.518 -11.177  -8.679
  285   1HG   PRO  39          1HG       PRO  39  -1.941 -12.817  -7.163
  286   2HG   PRO  39          2HG       PRO  39  -1.208 -11.512  -8.148
  287   1HD   PRO  39          1HD       PRO  39  -1.988 -11.394  -5.219
  288   2HD   PRO  39          2HD       PRO  39  -0.393 -11.038  -5.940
  289    H    VAL  40           H        VAL  40  -3.599 -10.188  -4.691
  290    HA   VAL  40           HA       VAL  40  -6.432  -9.750  -4.572
  291    HB   VAL  40           HB       VAL  40  -4.515  -9.848  -2.209
  292   1HG1  VAL  40          1HG1      VAL  40  -7.384 -10.702  -2.600
  293   2HG1  VAL  40          2HG1      VAL  40  -6.845  -9.212  -1.781
  294   3HG1  VAL  40          3HG1      VAL  40  -6.442 -10.798  -1.090
  295   1HG2  VAL  40          1HG2      VAL  40  -4.956 -12.313  -2.194
  296   2HG2  VAL  40          2HG2      VAL  40  -5.711 -12.172  -3.794
  297   3HG2  VAL  40          3HG2      VAL  40  -3.979 -11.842  -3.582
  298    H    VAL  41           H        VAL  41  -3.504  -8.015  -3.518
  299    HA   VAL  41           HA       VAL  41  -4.630  -5.659  -2.441
  300    HB   VAL  41           HB       VAL  41  -2.058  -6.050  -4.033
  301   1HG1  VAL  41          1HG1      VAL  41  -0.932  -6.284  -1.939
  302   2HG1  VAL  41          2HG1      VAL  41  -2.417  -5.912  -1.027
  303   3HG1  VAL  41          3HG1      VAL  41  -2.294  -7.408  -1.961
  304   1HG2  VAL  41          1HG2      VAL  41  -1.224  -4.010  -2.840
  305   2HG2  VAL  41          2HG2      VAL  41  -2.417  -3.746  -4.105
  306   3HG2  VAL  41          3HG2      VAL  41  -2.905  -3.664  -2.386
  307    H    ASP  42           HN       ASP  42  -3.643  -6.353  -5.834
  308    HA   ASP  42           HA       ASP  42  -4.464  -3.859  -6.875
  309   1HB   ASP  42          2HB       ASP  42  -3.018  -5.547  -8.047
  310   2HB   ASP  42          1HB       ASP  42  -4.435  -6.531  -8.361
  311    H    GLU  43           HN       GLU  43  -6.223  -7.006  -7.132
  312    HA   GLU  43           HA       GLU  43  -8.459  -5.867  -8.408
  313   1HB   GLU  43          1HB       GLU  43  -9.611  -7.865  -7.990
  314   2HB   GLU  43          2HB       GLU  43  -7.925  -8.291  -8.283
  315   1HG   GLU  43          1HG       GLU  43  -7.613  -8.433  -5.804
  316   2HG   GLU  43          2HG       GLU  43  -9.353  -8.199  -5.584
  317    H    ILE  44           H        ILE  44  -7.926  -6.285  -4.836
  318    HA   ILE  44           HA       ILE  44 -10.436  -5.191  -4.035
  319    HB   ILE  44           HB       ILE  44  -7.655  -5.180  -2.783
  320   1HG1  ILE  44          2HG1      ILE  44 -10.261  -6.684  -2.217
  321   2HG1  ILE  44          1HG1      ILE  44  -8.839  -7.364  -2.999
  322   1HG2  ILE  44          1HG2      ILE  44  -8.879  -3.180  -1.930
  323   2HG2  ILE  44          2HG2      ILE  44 -10.238  -4.236  -1.477
  324   3HG2  ILE  44          3HG2      ILE  44  -8.653  -4.374  -0.689
  325   1HD1  ILE  44          1HD1      ILE  44  -7.512  -6.836  -0.919
  326   2HD1  ILE  44          2HD1      ILE  44  -9.061  -6.416  -0.126
  327   3HD1  ILE  44          3HD1      ILE  44  -8.774  -8.051  -0.682
  328    H    ALA  45           H        ALA  45  -7.274  -3.586  -4.747
  329    HA   ALA  45           HA       ALA  45  -8.232  -0.968  -4.291
  330   1HB   ALA  45          1HB       ALA  45  -6.125  -1.778  -6.339
  331   2HB   ALA  45          2HB       ALA  45  -5.858  -1.716  -4.577
  332   3HB   ALA  45          3HB       ALA  45  -6.346  -0.250  -5.462
  333    H    GLY  46           H        GLY  46  -8.485  -3.040  -7.168
  334   1HA   GLY  46          2HA       GLY  46  -9.493  -1.155  -9.037
  335   2HA   GLY  46          1HA       GLY  46  -9.822  -2.901  -9.014
  336    H    GLU  47           HN       GLU  47 -11.130  -3.323  -6.672
  337    HA   GLU  47           HA       GLU  47 -13.793  -2.464  -7.153
  338   1HB   GLU  47          2HB       GLU  47 -12.524  -3.496  -4.573
  339   2HB   GLU  47          1HB       GLU  47 -14.245  -3.276  -4.831
  340   1HG   GLU  47          1HG       GLU  47 -14.255  -4.896  -6.665
  341   2HG   GLU  47          2HG       GLU  47 -12.504  -5.084  -6.578
  342    H    TYR  48           H        TYR  48 -11.383  -1.206  -4.845
  343    HA   TYR  48           HA       TYR  48 -13.104   1.149  -4.216
  344   1HB   TYR  48          1HB       TYR  48 -10.332   0.381  -3.264
  345   2HB   TYR  48          2HB       TYR  48 -11.258   1.791  -2.726
  346    HD1  TYR  48           HD1      TYR  48 -10.748  -1.751  -2.207
  347    HD2  TYR  48           HD2      TYR  48 -13.544   1.465  -1.612
  348    HE1  TYR  48           HE1      TYR  48 -12.346  -3.329  -1.137
  349    HE2  TYR  48           HE2      TYR  48 -15.067  -0.075  -0.421
  350    HH   TYR  48           HH       TYR  48 -15.565  -2.356   0.015
  351    H    LYS  49           HN       LYS  49 -13.058   1.291  -6.656
  352    HA   LYS  49           HA       LYS  49 -10.989   2.679  -8.005
  353   1HB   LYS  49          1HB       LYS  49 -13.010   3.537  -9.431
  354   2HB   LYS  49          2HB       LYS  49 -12.501   1.855  -9.462
  355   1HG   LYS  49          2HG       LYS  49 -14.912   2.083  -9.467
  356   2HG   LYS  49          1HG       LYS  49 -14.339   1.134  -8.115
  357   1HD   LYS  49          1HD       LYS  49 -14.628   3.249  -6.656
  358   2HD   LYS  49          2HD       LYS  49 -15.283   4.048  -8.093
  359   1HE   LYS  49          2HE       LYS  49 -17.149   3.281  -6.801
  360   2HE   LYS  49          1HE       LYS  49 -17.030   2.171  -8.175
  361   1HZ   LYS  49          1HZ       LYS  49 -15.804   0.670  -6.668
  362   2HZ   LYS  49          2HZ       LYS  49 -17.347   0.971  -6.165
  363   3HZ   LYS  49          3HZ       LYS  49 -16.071   1.711  -5.432
  364    H    ASP  50           HN       ASP  50 -10.888   4.818  -8.675
  365    HA   ASP  50           HA       ASP  50 -10.635   7.011  -8.525
  366   1HB   ASP  50          1HB       ASP  50 -13.229   6.930  -6.924
  367   2HB   ASP  50          2HB       ASP  50 -12.460   8.378  -7.574
  368    H    LYS  51           HN       LYS  51 -11.656   5.876  -5.319
  369    HA   LYS  51           HA       LYS  51 -10.150   8.061  -4.053
  370   1HB   LYS  51          1HB       LYS  51 -11.540   5.774  -2.665
  371   2HB   LYS  51          2HB       LYS  51 -11.037   7.277  -1.962
  372   1HG   LYS  51          2HG       LYS  51 -12.653   8.562  -3.099
  373   2HG   LYS  51          1HG       LYS  51 -13.088   7.285  -4.232
  374   1HD   LYS  51          1HD       LYS  51 -13.443   6.719  -1.288
  375   2HD   LYS  51          2HD       LYS  51 -14.568   7.826  -2.075
  376   1HE   LYS  51          1HE       LYS  51 -15.413   5.504  -2.075
  377   2HE   LYS  51          2HE       LYS  51 -15.247   6.174  -3.705
  378   1HZ   LYS  51          1HZ       LYS  51 -13.306   4.378  -2.429
  379   2HZ   LYS  51          2HZ       LYS  51 -13.252   4.938  -3.984
  380   3HZ   LYS  51          3HZ       LYS  51 -14.456   3.923  -3.517
  381    H    LEU  52           H        LEU  52  -9.931   4.502  -4.008
  382    HA   LEU  52           HA       LEU  52  -7.610   4.752  -2.190
  383   1HB   LEU  52          2HB       LEU  52  -9.379   2.964  -1.985
  384   2HB   LEU  52          1HB       LEU  52  -8.679   2.207  -3.408
  385    HG   LEU  52           HG       LEU  52  -6.396   2.446  -2.016
  386   1HD1  LEU  52          1HD1      LEU  52  -6.788   2.247   0.430
  387   2HD1  LEU  52          2HD1      LEU  52  -7.422   3.782  -0.162
  388   3HD1  LEU  52          3HD1      LEU  52  -8.519   2.425   0.179
  389   1HD2  LEU  52          1HD2      LEU  52  -6.844   0.226  -0.994
  390   2HD2  LEU  52          2HD2      LEU  52  -7.343   0.316  -2.685
  391   3HD2  LEU  52          3HD2      LEU  52  -8.566   0.397  -1.393
  392    H    LYS  53           HN       LYS  53  -5.886   5.709  -3.241
  393    HA   LYS  53           HA       LYS  53  -5.006   4.705  -5.832
  394   1HB   LYS  53          1HB       LYS  53  -4.776   7.079  -4.694
  395   2HB   LYS  53          2HB       LYS  53  -3.287   6.424  -4.060
  396   1HG   LYS  53          2HG       LYS  53  -4.095   6.527  -7.001
  397   2HG   LYS  53          1HG       LYS  53  -2.991   7.646  -6.197
  398   1HD   LYS  53          1HD       LYS  53  -1.385   5.882  -5.738
  399   2HD   LYS  53          2HD       LYS  53  -2.441   4.640  -6.428
  400   1HE   LYS  53          2HE       LYS  53  -1.344   6.987  -8.022
  401   2HE   LYS  53          1HE       LYS  53  -0.627   5.367  -7.968
  402   1HZ   LYS  53          1HZ       LYS  53  -3.341   5.978  -8.905
  403   2HZ   LYS  53          2HZ       LYS  53  -2.043   5.612  -9.850
  404   3HZ   LYS  53          3HZ       LYS  53  -2.664   4.479  -8.828
  405    H    CYS  54           H        CYS  54  -4.773   2.448  -5.430
  406    HA   CYS  54           HA       CYS  54  -3.044   1.628  -3.239
  407   1HB   CYS  54          2HB       CYS  54  -4.863   0.250  -4.019
  408   2HB   CYS  54          1HB       CYS  54  -4.078   0.079  -5.599
  409    HG   CYS  54           HG       CYS  54  -3.758  -2.105  -4.244
  410    H    VAL  55           H        VAL  55  -0.893   0.598  -3.502
  411    HA   VAL  55           HA       VAL  55   0.445   0.893  -6.021
  412    HB   VAL  55           HB       VAL  55   2.055   2.412  -4.102
  413   1HG1  VAL  55          1HG1      VAL  55  -0.086   3.190  -3.113
  414   2HG1  VAL  55          2HG1      VAL  55  -0.516   3.883  -4.698
  415   3HG1  VAL  55          3HG1      VAL  55   0.907   4.462  -3.836
  416   1HG2  VAL  55          1HG2      VAL  55   2.059   4.076  -5.929
  417   2HG2  VAL  55          2HG2      VAL  55   0.814   3.147  -6.780
  418   3HG2  VAL  55          3HG2      VAL  55   2.425   2.440  -6.498
  419    H    LYS  56           HN       LYS  56   2.714   0.251  -5.869
  420    HA   LYS  56           HA       LYS  56   3.308  -1.507  -3.527
  421   1HB   LYS  56          2HB       LYS  56   3.360  -1.959  -6.493
  422   2HB   LYS  56          1HB       LYS  56   4.437  -2.881  -5.433
  423   1HG   LYS  56          2HG       LYS  56   2.710  -3.849  -4.205
  424   2HG   LYS  56          1HG       LYS  56   1.471  -2.736  -4.794
  425   1HD   LYS  56          2HD       LYS  56   2.911  -4.527  -6.769
  426   2HD   LYS  56          1HD       LYS  56   1.686  -5.206  -5.689
  427   1HE   LYS  56          1HE       LYS  56   0.546  -4.618  -7.720
  428   2HE   LYS  56          2HE       LYS  56   0.034  -3.502  -6.450
  429   1HZ   LYS  56          1HZ       LYS  56   0.481  -2.423  -8.548
  430   2HZ   LYS  56          2HZ       LYS  56   1.504  -1.865  -7.395
  431   3HZ   LYS  56          3HZ       LYS  56   2.044  -2.939  -8.521
  432    H    LEU  57           H        LEU  57   5.109  -0.975  -2.547
  433    HA   LEU  57           HA       LEU  57   7.169   0.694  -3.943
  434   1HB   LEU  57          1HB       LEU  57   6.049   1.770  -2.007
  435   2HB   LEU  57          2HB       LEU  57   6.565   0.410  -0.986
  436    HG   LEU  57           HG       LEU  57   8.862   0.969  -1.174
  437   1HD1  LEU  57          1HD1      LEU  57   8.794   2.848   0.186
  438   2HD1  LEU  57          2HD1      LEU  57   7.140   2.226   0.345
  439   3HD1  LEU  57          3HD1      LEU  57   7.459   3.607  -0.710
  440   1HD2  LEU  57          1HD2      LEU  57   9.101   1.818  -3.399
  441   2HD2  LEU  57          2HD2      LEU  57   9.463   3.181  -2.315
  442   3HD2  LEU  57          3HD2      LEU  57   7.894   3.105  -3.127
  443    H    ASN  58           H        ASN  58   9.012  -0.378  -4.462
  444    HA   ASN  58           HA       ASN  58   9.521  -3.039  -3.351
  445   1HB   ASN  58          2HB       ASN  58  10.041  -2.512  -5.668
  446   2HB   ASN  58          1HB       ASN  58  11.211  -1.306  -5.153
  447   1HD2  ASN  58          2HD2      ASN  58  11.054  -4.362  -6.330
  448   2HD2  ASN  58          1HD2      ASN  58  12.487  -5.045  -5.579
  449    H    THR  59           H        THR  59  10.310  -3.322  -1.441
  450    HA   THR  59           HA       THR  59  11.250  -1.179   0.235
  451    HB   THR  59           HB       THR  59  11.206  -4.202   0.786
  452    HG1  THR  59           HG1      THR  59   9.201  -3.557   0.090
  453   1HG2  THR  59          1HG2      THR  59  10.979  -1.771   2.620
  454   2HG2  THR  59          2HG2      THR  59  12.380  -2.861   2.525
  455   3HG2  THR  59          3HG2      THR  59  10.821  -3.469   3.110
  456    H    ASP  60           HN       ASP  60  12.850  -3.561  -1.776
  457    HA   ASP  60           HA       ASP  60  15.409  -3.486  -0.357
  458   1HB   ASP  60          1HB       ASP  60  14.270  -5.370  -1.790
  459   2HB   ASP  60          2HB       ASP  60  14.902  -4.495  -3.179
  460    H    GLU  61           HN       GLU  61  13.914  -2.182  -3.230
  461    HA   GLU  61           HA       GLU  61  16.175  -0.637  -4.217
  462   1HB   GLU  61          2HB       GLU  61  14.427  -1.813  -5.586
  463   2HB   GLU  61          1HB       GLU  61  13.235  -0.677  -4.918
  464   1HG   GLU  61          2HG       GLU  61  14.345   1.201  -6.057
  465   2HG   GLU  61          1HG       GLU  61  15.613   0.105  -6.636
  466    H    SER  62           H        SER  62  13.362  -0.010  -2.154
  467    HA   SER  62           HA       SER  62  14.160   2.849  -1.832
  468   1HB   SER  62          1HB       SER  62  11.346   1.770  -2.293
  469   2HB   SER  62          2HB       SER  62  11.800   3.380  -1.743
  470    HG   SER  62           HG       SER  62  13.366   2.835  -3.803
  471    HA   PRO  63           HA       PRO  63  13.923   0.373   2.168
  472   1HB   PRO  63          2HB       PRO  63  16.496   0.798   2.972
  473   2HB   PRO  63          1HB       PRO  63  16.029  -0.432   1.768
  474   1HG   PRO  63          2HG       PRO  63  17.166   2.269   1.118
  475   2HG   PRO  63          1HG       PRO  63  17.707   0.667   0.551
  476   1HD   PRO  63          1HD       PRO  63  15.970   2.122  -0.935
  477   2HD   PRO  63          2HD       PRO  63  15.794   0.365  -0.797
  478    H    ASN  64           H        ASN  64  15.418   3.256   1.162
  479    HA   ASN  64           HA       ASN  64  15.717   5.118   3.078
  480   1HB   ASN  64          2HB       ASN  64  13.995   5.511   0.598
  481   2HB   ASN  64          1HB       ASN  64  14.546   6.816   1.659
  482   1HD2  ASN  64          1HD2      ASN  64  15.389   7.501  -0.513
  483   2HD2  ASN  64          2HD2      ASN  64  17.025   6.971  -0.938
  484    H    VAL  65           H        VAL  65  12.440   5.021   1.770
  485    HA   VAL  65           HA       VAL  65  11.503   6.389   3.996
  486    HB   VAL  65           HB       VAL  65   9.171   5.437   2.873
  487   1HG1  VAL  65          1HG1      VAL  65   9.447   7.524   1.368
  488   2HG1  VAL  65          2HG1      VAL  65  11.181   7.517   1.751
  489   3HG1  VAL  65          3HG1      VAL  65  10.001   7.869   3.028
  490   1HG2  VAL  65          1HG2      VAL  65  11.015   5.331   0.522
  491   2HG2  VAL  65          2HG2      VAL  65   9.270   5.083   0.628
  492   3HG2  VAL  65          3HG2      VAL  65  10.367   3.923   1.407
  493    H    ALA  66           H        ALA  66  11.670   2.974   3.202
  494    HA   ALA  66           HA       ALA  66   9.858   1.924   5.162
  495   1HB   ALA  66          1HB       ALA  66  12.424   0.618   4.133
  496   2HB   ALA  66          2HB       ALA  66  10.875   0.610   3.270
  497   3HB   ALA  66          3HB       ALA  66  11.039  -0.187   4.844
  498    H    SER  67           H        SER  67  13.263   2.925   5.283
  499    HA   SER  67           HA       SER  67  13.750   2.099   7.994
  500   1HB   SER  67          2HB       SER  67  15.206   4.250   6.391
  501   2HB   SER  67          1HB       SER  67  15.810   3.331   7.776
  502    HG   SER  67           HG       SER  67  15.063   2.246   5.241
  503    H    GLU  68           HN       GLU  68  12.914   5.188   6.437
  504    HA   GLU  68           HA       GLU  68  12.856   6.847   8.735
  505   1HB   GLU  68          2HB       GLU  68  11.161   6.928   6.205
  506   2HB   GLU  68          1HB       GLU  68  11.206   8.214   7.402
  507   1HG   GLU  68          1HG       GLU  68  13.494   8.728   6.974
  508   2HG   GLU  68          2HG       GLU  68  13.767   7.237   6.074
  509    H    TYR  69           H        TYR  69  10.253   4.823   7.338
  510    HA   TYR  69           HA       TYR  69   8.328   5.564   9.397
  511   1HB   TYR  69          2HB       TYR  69   8.422   3.553   7.130
  512   2HB   TYR  69          1HB       TYR  69   7.157   3.473   8.339
  513    HD1  TYR  69           HD1      TYR  69   7.987   4.910   5.203
  514    HD2  TYR  69           HD2      TYR  69   5.797   5.645   8.840
  515    HE1  TYR  69           HE1      TYR  69   6.814   6.771   4.111
  516    HE2  TYR  69           HE2      TYR  69   4.471   7.397   7.669
  517    HH   TYR  69           HH       TYR  69   5.163   8.390   4.319
  518    H    GLY  70           H        GLY  70  10.568   2.823   8.906
  519   1HA   GLY  70          1HA       GLY  70  11.489   1.610  10.746
  520   2HA   GLY  70          2HA       GLY  70  10.049   1.954  11.721
  521    H    ILE  71           H        ILE  71  10.723   0.595   8.489
  522    HA   ILE  71           HA       ILE  71   8.913  -1.716   9.030
  523    HB   ILE  71           HB       ILE  71   9.481  -0.329   6.380
  524   1HG1  ILE  71          1HG1      ILE  71   7.035   0.035   8.163
  525   2HG1  ILE  71          2HG1      ILE  71   8.288   1.232   7.839
  526   1HG2  ILE  71          1HG2      ILE  71   7.451  -2.446   7.218
  527   2HG2  ILE  71          2HG2      ILE  71   7.498  -1.671   5.617
  528   3HG2  ILE  71          3HG2      ILE  71   8.833  -2.681   6.133
  529   1HD1  ILE  71          1HD1      ILE  71   6.286   0.216   5.825
  530   2HD1  ILE  71          2HD1      ILE  71   7.809   0.998   5.368
  531   3HD1  ILE  71          3HD1      ILE  71   6.641   1.872   6.348
  532    H    ARG  72           HN       ARG  72   9.684  -3.708   8.235
  533    HA   ARG  72           HA       ARG  72  12.199  -3.861   6.768
  534   1HB   ARG  72          1HB       ARG  72  13.204  -3.818   8.939
  535   2HB   ARG  72          2HB       ARG  72  11.939  -4.832   9.644
  536   1HG   ARG  72          1HG       ARG  72  14.023  -6.090   9.354
  537   2HG   ARG  72          2HG       ARG  72  12.715  -6.793   8.414
  538   1HD   ARG  72          1HD       ARG  72  13.702  -5.455   6.373
  539   2HD   ARG  72          2HD       ARG  72  15.058  -5.108   7.434
  540    HE   ARG  72           HE       ARG  72  15.781  -7.287   7.252
  541   1HH1  ARG  72          1HH1      ARG  72  12.502  -7.064   5.827
  542   2HH1  ARG  72          2HH1      ARG  72  12.604  -8.645   5.112
  543   1HH2  ARG  72          1HH2      ARG  72  15.862  -9.330   6.282
  544   2HH2  ARG  72          2HH2      ARG  72  14.520  -9.938   5.353
  545    H    SER  73           H        SER  73  10.127  -5.995   8.870
  546    HA   SER  73           HA       SER  73   9.997  -8.069   6.975
  547   1HB   SER  73          1HB       SER  73   7.751  -7.503   8.874
  548   2HB   SER  73          2HB       SER  73   8.534  -9.049   8.512
  549    HG   SER  73           HG       SER  73   9.157  -8.245  10.590
  550    H    ILE  74           H        ILE  74   8.257  -8.583   5.493
  551    HA   ILE  74           HA       ILE  74   6.262  -6.576   4.968
  552    HB   ILE  74           HB       ILE  74   6.988  -6.668   2.439
  553   1HG1  ILE  74          2HG1      ILE  74   9.775  -6.828   3.569
  554   2HG1  ILE  74          1HG1      ILE  74   8.970  -8.256   2.907
  555   1HG2  ILE  74          1HG2      ILE  74   6.894  -4.652   3.953
  556   2HG2  ILE  74          2HG2      ILE  74   8.587  -4.951   4.395
  557   3HG2  ILE  74          3HG2      ILE  74   8.156  -4.547   2.736
  558   1HD1  ILE  74          1HD1      ILE  74   9.401  -5.687   1.359
  559   2HD1  ILE  74          2HD1      ILE  74  10.284  -7.194   1.155
  560   3HD1  ILE  74          3HD1      ILE  74   8.565  -7.141   0.782
  561    HA   PRO  75           HA       PRO  75   4.806  -6.663   2.616
  562   1HB   PRO  75          1HB       PRO  75   2.099  -7.068   2.777
  563   2HB   PRO  75          2HB       PRO  75   3.163  -7.710   1.510
  564   1HG   PRO  75          1HG       PRO  75   2.196  -9.070   4.039
  565   2HG   PRO  75          2HG       PRO  75   2.181  -9.753   2.385
  566   1HD   PRO  75          2HD       PRO  75   4.168 -10.382   4.157
  567   2HD   PRO  75          1HD       PRO  75   4.535 -10.102   2.447
  568    H    THR  76           H        THR  76   4.206  -4.826   3.346
  569    HA   THR  76           HA       THR  76   2.925  -4.421   5.973
  570    HB   THR  76           HB       THR  76   5.557  -3.126   5.150
  571    HG1  THR  76           HG1      THR  76   6.171  -4.734   6.460
  572   1HG2  THR  76          1HG2      THR  76   4.071  -1.371   5.998
  573   2HG2  THR  76          2HG2      THR  76   5.236  -1.790   7.260
  574   3HG2  THR  76          3HG2      THR  76   3.583  -2.410   7.356
  575    H    ILE  77           H        ILE  77   1.096  -3.726   5.122
  576    HA   ILE  77           HA       ILE  77   1.021  -2.082   2.658
  577    HB   ILE  77           HB       ILE  77  -1.079  -3.691   4.140
  578   1HG1  ILE  77          1HG1      ILE  77   0.177  -4.158   1.402
  579   2HG1  ILE  77          2HG1      ILE  77   0.680  -5.000   2.871
  580   1HG2  ILE  77          1HG2      ILE  77  -2.063  -1.678   3.039
  581   2HG2  ILE  77          2HG2      ILE  77  -2.553  -3.155   2.232
  582   3HG2  ILE  77          3HG2      ILE  77  -1.267  -2.143   1.522
  583   1HD1  ILE  77          1HD1      ILE  77  -1.635  -5.893   3.141
  584   2HD1  ILE  77          2HD1      ILE  77  -0.791  -6.443   1.680
  585   3HD1  ILE  77          3HD1      ILE  77  -2.046  -5.205   1.550
  586    H    MET  78           H        MET  78   1.283   0.054   3.242
  587    HA   MET  78           HA       MET  78   0.019   1.003   5.775
  588   1HB   MET  78          2HB       MET  78   1.725   2.546   3.858
  589   2HB   MET  78          1HB       MET  78   1.132   3.076   5.422
  590   1HG   MET  78          2HG       MET  78   2.370   1.117   6.454
  591   2HG   MET  78          1HG       MET  78   3.200   0.911   4.914
  592   1HE   MET  78          1HE       MET  78   4.919   3.000   8.246
  593   2HE   MET  78          2HE       MET  78   4.646   1.314   7.745
  594   3HE   MET  78          3HE       MET  78   3.292   2.309   8.327
  595    H    VAL  79           H        VAL  79  -1.410   2.668   5.744
  596    HA   VAL  79           HA       VAL  79  -3.021   3.079   3.250
  597    HB   VAL  79           HB       VAL  79  -3.931   2.837   6.143
  598   1HG1  VAL  79          1HG1      VAL  79  -3.650   0.687   4.955
  599   2HG1  VAL  79          2HG1      VAL  79  -4.678   1.285   3.636
  600   3HG1  VAL  79          3HG1      VAL  79  -5.361   1.030   5.255
  601   1HG2  VAL  79          1HG2      VAL  79  -6.219   3.363   5.289
  602   2HG2  VAL  79          2HG2      VAL  79  -5.513   3.789   3.712
  603   3HG2  VAL  79          3HG2      VAL  79  -5.144   4.739   5.151
  604    H    PHE  80           H        PHE  80  -3.459   5.171   2.780
  605    HA   PHE  80           HA       PHE  80  -2.841   7.311   4.739
  606   1HB   PHE  80          1HB       PHE  80  -2.297   7.487   1.767
  607   2HB   PHE  80          2HB       PHE  80  -1.887   8.670   2.971
  608    HD1  PHE  80           HD1      PHE  80   0.310   8.680   3.932
  609    HD2  PHE  80           HD2      PHE  80  -1.074   5.151   1.879
  610    HE1  PHE  80           HE1      PHE  80   2.424   7.536   4.474
  611    HE2  PHE  80           HE2      PHE  80   1.055   4.037   2.367
  612    HZ   PHE  80           HZ       PHE  80   2.804   5.189   3.728
  613    H    LYS  81           HN       LYS  81  -4.317   8.975   4.608
  614    HA   LYS  81           HA       LYS  81  -6.849   8.312   3.117
  615   1HB   LYS  81          1HB       LYS  81  -8.071   9.515   4.686
  616   2HB   LYS  81          2HB       LYS  81  -7.032   8.401   5.564
  617   1HG   LYS  81          1HG       LYS  81  -6.628  11.422   5.284
  618   2HG   LYS  81          2HG       LYS  81  -7.293  10.556   6.672
  619   1HD   LYS  81          1HD       LYS  81  -5.070   9.250   6.756
  620   2HD   LYS  81          2HD       LYS  81  -4.440  10.502   5.668
  621   1HE   LYS  81          2HE       LYS  81  -5.632  10.992   8.422
  622   2HE   LYS  81          1HE       LYS  81  -3.912  10.997   8.010
  623   1HZ   LYS  81          1HZ       LYS  81  -4.335  12.823   6.516
  624   2HZ   LYS  81          2HZ       LYS  81  -5.931  12.836   6.927
  625   3HZ   LYS  81          3HZ       LYS  81  -4.788  13.200   8.055
  626    H    GLY  82           H        GLY  82  -4.329  10.715   3.442
  627   1HA   GLY  82          2HA       GLY  82  -4.925  12.012   0.985
  628   2HA   GLY  82          1HA       GLY  82  -5.571  12.975   2.342
  629    H    GLY  83           H        GLY  83  -2.648  11.655   0.840
  630   1HA   GLY  83          1HA       GLY  83  -0.497  12.225   1.028
  631   2HA   GLY  83          2HA       GLY  83  -0.882  13.602   1.994
  632    H    LYS  84           HN       LYS  84  -1.813  12.746   4.279
  633    HA   LYS  84           HA       LYS  84   0.511  11.472   5.535
  634   1HB   LYS  84          2HB       LYS  84  -2.049  12.344   6.893
  635   2HB   LYS  84          1HB       LYS  84  -0.451  12.153   7.611
  636   1HG   LYS  84          2HG       LYS  84  -1.325  14.311   5.637
  637   2HG   LYS  84          1HG       LYS  84  -0.962  14.514   7.349
  638   1HD   LYS  84          1HD       LYS  84   1.397  13.885   6.972
  639   2HD   LYS  84          2HD       LYS  84   1.093  13.658   5.243
  640   1HE   LYS  84          2HE       LYS  84   0.717  16.296   6.723
  641   2HE   LYS  84          1HE       LYS  84   2.135  15.849   5.761
  642   1HZ   LYS  84          1HZ       LYS  84  -0.603  16.086   4.733
  643   2HZ   LYS  84          2HZ       LYS  84   0.714  15.632   3.854
  644   3HZ   LYS  84          3HZ       LYS  84   0.629  17.149   4.488
  645    H    LYS  85           HN       LYS  85   0.373   9.763   7.017
  646    HA   LYS  85           HA       LYS  85  -0.964   7.452   5.924
  647   1HB   LYS  85          2HB       LYS  85   1.385   7.631   7.007
  648   2HB   LYS  85          1HB       LYS  85   0.517   7.604   8.557
  649   1HG   LYS  85          2HG       LYS  85  -0.437   5.370   7.945
  650   2HG   LYS  85          1HG       LYS  85   0.304   5.507   6.347
  651   1HD   LYS  85          2HD       LYS  85   1.556   3.995   7.656
  652   2HD   LYS  85          1HD       LYS  85   2.564   5.411   7.375
  653   1HE   LYS  85          1HE       LYS  85   0.923   5.081   9.938
  654   2HE   LYS  85          2HE       LYS  85   2.482   4.275   9.741
  655   1HZ   LYS  85          1HZ       LYS  85   3.520   6.360   9.391
  656   2HZ   LYS  85          2HZ       LYS  85   2.099   7.171   9.566
  657   3HZ   LYS  85          3HZ       LYS  85   2.735   6.343  10.837
  658    H    CYS  86           H        CYS  86  -2.340   6.038   7.157
  659    HA   CYS  86           HA       CYS  86  -3.969   7.336   9.312
  660   1HB   CYS  86          2HB       CYS  86  -5.091   7.115   6.957
  661   2HB   CYS  86          1HB       CYS  86  -5.129   5.391   7.286
  662    HG   CYS  86           HG       CYS  86  -6.084   5.881   9.855
  663    H    GLU  87           HN       GLU  87  -3.252   4.194   7.700
  664    HA   GLU  87           HA       GLU  87  -3.028   2.838  10.329
  665   1HB   GLU  87          2HB       GLU  87  -4.782   1.766   8.080
  666   2HB   GLU  87          1HB       GLU  87  -4.631   1.132   9.717
  667   1HG   GLU  87          1HG       GLU  87  -5.980   3.755   8.892
  668   2HG   GLU  87          2HG       GLU  87  -6.753   2.291   9.376
  669    H    THR  88           H        THR  88  -2.459   0.371   9.783
  670    HA   THR  88           HA       THR  88  -1.054  -0.049   7.302
  671    HB   THR  88           HB       THR  88   0.460   0.098   9.954
  672    HG1  THR  88           HG1      THR  88   0.068   1.897   8.035
  673   1HG2  THR  88          1HG2      THR  88   1.379  -0.864   7.204
  674   2HG2  THR  88          2HG2      THR  88   2.474  -0.459   8.547
  675   3HG2  THR  88          3HG2      THR  88   1.339  -1.804   8.708
  676    H    ILE  89           H        ILE  89  -1.080  -2.194   6.800
  677    HA   ILE  89           HA       ILE  89  -1.951  -4.161   8.880
  678    HB   ILE  89           HB       ILE  89  -2.261  -4.373   5.857
  679   1HG1  ILE  89          2HG1      ILE  89  -4.417  -3.554   7.853
  680   2HG1  ILE  89          1HG1      ILE  89  -3.633  -2.463   6.701
  681   1HG2  ILE  89          1HG2      ILE  89  -2.212  -6.514   7.137
  682   2HG2  ILE  89          2HG2      ILE  89  -3.539  -5.922   8.157
  683   3HG2  ILE  89          3HG2      ILE  89  -3.790  -6.227   6.427
  684   1HD1  ILE  89          1HD1      ILE  89  -5.680  -3.060   5.709
  685   2HD1  ILE  89          2HD1      ILE  89  -5.433  -4.790   5.988
  686   3HD1  ILE  89          3HD1      ILE  89  -4.416  -3.918   4.814
  687    H    ILE  90           H        ILE  90  -0.617  -6.131   8.927
  688    HA   ILE  90           HA       ILE  90   1.848  -6.060   7.262
  689    HB   ILE  90           HB       ILE  90   1.737  -6.570  10.267
  690   1HG1  ILE  90          2HG1      ILE  90   2.824  -4.212   8.660
  691   2HG1  ILE  90          1HG1      ILE  90   1.464  -4.180   9.794
  692   1HG2  ILE  90          1HG2      ILE  90   3.461  -7.928   9.064
  693   2HG2  ILE  90          2HG2      ILE  90   4.200  -6.720  10.090
  694   3HG2  ILE  90          3HG2      ILE  90   4.108  -6.441   8.338
  695   1HD1  ILE  90          1HD1      ILE  90   4.390  -4.536  10.494
  696   2HD1  ILE  90          2HD1      ILE  90   3.299  -3.214  10.920
  697   3HD1  ILE  90          3HD1      ILE  90   3.051  -4.818  11.639
  698    H    GLY  91           H        GLY  91   2.518  -8.048   6.587
  699   1HA   GLY  91          2HA       GLY  91   2.628 -10.346   6.408
  700   2HA   GLY  91          1HA       GLY  91   1.493 -10.531   7.754
  701    H    ALA  92           H        ALA  92   1.102 -12.255   5.810
  702    HA   ALA  92           HA       ALA  92  -0.570 -11.398   3.630
  703   1HB   ALA  92          1HB       ALA  92  -0.251 -14.119   4.983
  704   2HB   ALA  92          2HB       ALA  92  -1.050 -13.838   3.425
  705   3HB   ALA  92          3HB       ALA  92   0.688 -13.524   3.594
  706    H    VAL  93           H        VAL  93  -2.904 -11.870   3.390
  707    HA   VAL  93           HA       VAL  93  -4.462 -12.142   5.859
  708    HB   VAL  93           HB       VAL  93  -5.557 -10.078   4.214
  709   1HG1  VAL  93          1HG1      VAL  93  -2.881  -9.282   5.480
  710   2HG1  VAL  93          2HG1      VAL  93  -3.190  -9.339   3.725
  711   3HG1  VAL  93          3HG1      VAL  93  -4.032  -8.168   4.742
  712   1HG2  VAL  93          1HG2      VAL  93  -5.959  -8.802   6.056
  713   2HG2  VAL  93          2HG2      VAL  93  -6.378 -10.484   6.342
  714   3HG2  VAL  93          3HG2      VAL  93  -4.893  -9.826   7.068
  715    HA   PRO  94           HA       PRO  94  -7.151 -13.780   2.570
  716   1HB   PRO  94          1HB       PRO  94  -9.504 -13.575   4.297
  717   2HB   PRO  94          2HB       PRO  94  -8.687 -15.046   3.711
  718   1HG   PRO  94          2HG       PRO  94  -8.587 -14.291   6.378
  719   2HG   PRO  94          1HG       PRO  94  -7.199 -15.079   5.563
  720   1HD   PRO  94          2HD       PRO  94  -7.719 -12.128   5.888
  721   2HD   PRO  94          1HD       PRO  94  -6.250 -12.977   6.378
  722    H    LYS  95           HN       LYS  95  -8.354 -12.764   1.034
  723    HA   LYS  95           HA       LYS  95  -8.410 -10.082   0.845
  724   1HB   LYS  95          2HB       LYS  95  -8.792 -11.824  -1.036
  725   2HB   LYS  95          1HB       LYS  95 -10.406 -12.106  -0.390
  726   1HG   LYS  95          2HG       LYS  95 -10.879  -9.604  -0.929
  727   2HG   LYS  95          1HG       LYS  95  -9.396  -9.691  -1.901
  728   1HD   LYS  95          1HD       LYS  95 -10.338 -11.593  -3.172
  729   2HD   LYS  95          2HD       LYS  95 -11.845 -11.470  -2.248
  730   1HE   LYS  95          2HE       LYS  95 -10.650  -9.267  -3.997
  731   2HE   LYS  95          1HE       LYS  95 -11.971 -10.345  -4.472
  732   1HZ   LYS  95          1HZ       LYS  95 -12.785  -8.254  -3.716
  733   2HZ   LYS  95          2HZ       LYS  95 -13.266  -9.438  -2.677
  734   3HZ   LYS  95          3HZ       LYS  95 -12.039  -8.417  -2.261
  735    H    ALA  96           H        ALA  96 -11.159 -12.064   1.981
  736    HA   ALA  96           HA       ALA  96 -13.140 -10.072   2.129
  737   1HB   ALA  96          1HB       ALA  96 -12.613 -12.390   4.049
  738   2HB   ALA  96          2HB       ALA  96 -13.560 -12.468   2.546
  739   3HB   ALA  96          3HB       ALA  96 -14.133 -11.481   3.905
  740    H    THR  97           H        THR  97 -10.514 -10.872   4.475
  741    HA   THR  97           HA       THR  97 -11.402  -9.011   6.474
  742    HB   THR  97           HB       THR  97  -8.596 -10.062   6.004
  743    HG1  THR  97           HG1      THR  97 -10.833 -11.331   7.217
  744   1HG2  THR  97          1HG2      THR  97  -8.481 -10.024   8.475
  745   2HG2  THR  97          2HG2      THR  97  -8.822  -8.410   7.829
  746   3HG2  THR  97          3HG2      THR  97 -10.130  -9.370   8.553
  747    H    ILE  98           H        ILE  98  -9.007  -8.931   3.780
  748    HA   ILE  98           HA       ILE  98  -7.966  -6.340   4.340
  749    HB   ILE  98           HB       ILE  98  -8.296  -7.695   1.624
  750   1HG1  ILE  98          2HG1      ILE  98  -6.021  -7.762   3.614
  751   2HG1  ILE  98          1HG1      ILE  98  -7.083  -9.090   3.103
  752   1HG2  ILE  98          1HG2      ILE  98  -6.437  -5.442   2.602
  753   2HG2  ILE  98          2HG2      ILE  98  -7.819  -5.185   1.527
  754   3HG2  ILE  98          3HG2      ILE  98  -6.436  -6.110   0.965
  755   1HD1  ILE  98          1HD1      ILE  98  -6.224  -8.796   0.745
  756   2HD1  ILE  98          2HD1      ILE  98  -4.968  -7.726   1.416
  757   3HD1  ILE  98          3HD1      ILE  98  -5.055  -9.416   1.922
  758    H    VAL  99           H        VAL  99 -10.661  -7.315   2.177
  759    HA   VAL  99           HA       VAL  99 -11.550  -4.812   1.292
  760    HB   VAL  99           HB       VAL  99 -12.894  -7.469   1.883
  761   1HG1  VAL  99          1HG1      VAL  99 -14.721  -5.992   2.412
  762   2HG1  VAL  99          2HG1      VAL  99 -14.978  -6.625   0.795
  763   3HG1  VAL  99          3HG1      VAL  99 -14.368  -4.969   1.004
  764   1HG2  VAL  99          1HG2      VAL  99 -12.513  -5.876  -0.681
  765   2HG2  VAL  99          2HG2      VAL  99 -13.172  -7.518  -0.536
  766   3HG2  VAL  99          3HG2      VAL  99 -11.476  -7.209  -0.127
  767    H    GLN 100           H        GLN 100 -12.738  -6.624   4.176
  768    HA   GLN 100           HA       GLN 100 -14.421  -4.559   5.042
  769   1HB   GLN 100          2HB       GLN 100 -14.115  -7.062   5.758
  770   2HB   GLN 100          1HB       GLN 100 -13.057  -6.438   7.019
  771   1HG   GLN 100          1HG       GLN 100 -15.843  -5.244   6.596
  772   2HG   GLN 100          2HG       GLN 100 -15.654  -6.822   7.329
  773   1HE2  GLN 100          2HE2      GLN 100 -14.324  -3.426   7.680
  774   2HE2  GLN 100          1HE2      GLN 100 -14.298  -3.531   9.428
  775    H    THR 101           H        THR 101 -11.082  -5.261   5.975
  776    HA   THR 101           HA       THR 101 -10.657  -3.211   7.861
  777    HB   THR 101           HB       THR 101  -8.654  -4.456   5.937
  778    HG1  THR 101           HG1      THR 101  -9.686  -5.986   7.212
  779   1HG2  THR 101          1HG2      THR 101  -8.312  -2.982   8.583
  780   2HG2  THR 101          2HG2      THR 101  -7.699  -2.477   6.988
  781   3HG2  THR 101          3HG2      THR 101  -7.042  -3.921   7.780
  782    H    VAL 102           H        VAL 102 -10.312  -3.108   4.245
  783    HA   VAL 102           HA       VAL 102  -9.416  -0.368   4.207
  784    HB   VAL 102           HB       VAL 102 -10.718  -2.178   2.140
  785   1HG1  VAL 102          1HG1      VAL 102  -7.916  -0.980   2.340
  786   2HG1  VAL 102          2HG1      VAL 102  -8.486  -2.137   1.123
  787   3HG1  VAL 102          3HG1      VAL 102  -8.330  -2.635   2.815
  788   1HG2  VAL 102          1HG2      VAL 102 -10.104  -0.463   0.445
  789   2HG2  VAL 102          2HG2      VAL 102 -11.396   0.091   1.510
  790   3HG2  VAL 102          3HG2      VAL 102  -9.733   0.677   1.752
  791    H    GLU 103           HN       GLU 103 -12.646  -1.849   3.778
  792    HA   GLU 103           HA       GLU 103 -14.096   0.481   3.357
  793   1HB   GLU 103          2HB       GLU 103 -14.876  -2.134   4.713
  794   2HB   GLU 103          1HB       GLU 103 -16.028  -0.849   4.320
  795   1HG   GLU 103          1HG       GLU 103 -15.485  -0.923   1.980
  796   2HG   GLU 103          2HG       GLU 103 -14.243  -2.151   2.231
  797    H    LYS 104           HN       LYS 104 -13.394  -0.998   6.535
  798    HA   LYS 104           HA       LYS 104 -14.904   0.951   8.002
  799   1HB   LYS 104          1HB       LYS 104 -13.538   0.335   9.963
  800   2HB   LYS 104          2HB       LYS 104 -14.210  -1.065   9.117
  801   1HG   LYS 104          1HG       LYS 104 -12.126  -1.671   8.228
  802   2HG   LYS 104          2HG       LYS 104 -11.416  -0.081   8.496
  803   1HD   LYS 104          1HD       LYS 104 -10.437  -1.592  10.028
  804   2HD   LYS 104          2HD       LYS 104 -11.431  -0.419  10.911
  805   1HE   LYS 104          2HE       LYS 104 -13.251  -2.135  11.096
  806   2HE   LYS 104          1HE       LYS 104 -12.239  -3.287  10.191
  807   1HZ   LYS 104          1HZ       LYS 104 -11.577  -2.103  12.791
  808   2HZ   LYS 104          2HZ       LYS 104 -12.115  -3.639  12.532
  809   3HZ   LYS 104          3HZ       LYS 104 -10.646  -3.175  11.952
  810    H    TYR 105           H        TYR 105 -11.795   1.332   6.389
  811    HA   TYR 105           HA       TYR 105 -11.163   3.788   7.950
  812   1HB   TYR 105          2HB       TYR 105  -9.661   2.487   5.669
  813   2HB   TYR 105          1HB       TYR 105  -9.091   3.785   6.714
  814    HD1  TYR 105           HD1      TYR 105  -7.710   1.163   6.010
  815    HD2  TYR 105           HD2      TYR 105 -10.182   2.300   9.362
  816    HE1  TYR 105           HE1      TYR 105  -6.533  -0.474   7.450
  817    HE2  TYR 105           HE2      TYR 105  -9.073   0.602  10.755
  818    HH   TYR 105           HH       TYR 105  -7.363  -0.944  10.885
  819    H    LEU 106           H        LEU 106 -12.029   2.713   4.637
  820    HA   LEU 106           HA       LEU 106 -12.441   5.550   3.783
  821   1HB   LEU 106          2HB       LEU 106 -12.284   2.903   2.291
  822   2HB   LEU 106          1HB       LEU 106 -12.993   4.361   1.583
  823    HG   LEU 106           HG       LEU 106 -10.886   5.599   1.937
  824   1HD1  LEU 106          1HD1      LEU 106  -9.753   4.528   0.014
  825   2HD1  LEU 106          2HD1      LEU 106 -11.499   4.591  -0.234
  826   3HD1  LEU 106          3HD1      LEU 106 -10.740   3.065   0.244
  827   1HD2  LEU 106          1HD2      LEU 106  -9.806   2.862   2.730
  828   2HD2  LEU 106          2HD2      LEU 106  -8.793   4.238   2.242
  829   3HD2  LEU 106          3HD2      LEU 106  -9.782   4.352   3.698
  830    H    ASN 107           H        ASN 107 -14.395   2.888   2.523
  831    HA   ASN 107           HA       ASN 107 -16.636   3.089   4.198
  832   1HB   ASN 107          1HB       ASN 107 -16.757   5.303   2.836
  833   2HB   ASN 107          2HB       ASN 107 -16.962   4.287   1.406
  834   1HD2  ASN 107          2HD2      ASN 107 -18.695   2.246   2.697
  835   2HD2  ASN 107          1HD2      ASN 107 -20.224   3.075   3.012
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1  -0.072  -2.000 -10.996
    2   2H    MET   1          2H        MET   1   0.612  -3.428 -11.520
    3   3H    MET   1          3H        MET   1  -0.927  -3.381 -10.899
    4    HA   MET   1           HA       MET   1  -0.037  -2.141 -13.390
    5   1HB   MET   1          2HB       MET   1  -0.321  -4.565 -13.595
    6   2HB   MET   1          1HB       MET   1  -1.918  -4.506 -12.843
    7   1HG   MET   1          2HG       MET   1  -2.036  -4.720 -15.297
    8   2HG   MET   1          1HG       MET   1  -2.803  -3.233 -14.745
    9   1HE   MET   1          1HE       MET   1  -2.869  -1.934 -16.938
   10   2HE   MET   1          2HE       MET   1  -2.394  -3.476 -17.699
   11   3HE   MET   1          3HE       MET   1  -1.553  -1.969 -18.135
   12    H    GLU   2           HN       GLU   2  -3.162  -3.104 -11.885
   13    HA   GLU   2           HA       GLU   2  -4.475  -0.606 -12.658
   14   1HB   GLU   2          2HB       GLU   2  -5.243  -2.810 -10.701
   15   2HB   GLU   2          1HB       GLU   2  -6.304  -1.494 -11.219
   16   1HG   GLU   2          1HG       GLU   2  -6.279  -2.314 -13.523
   17   2HG   GLU   2          2HG       GLU   2  -5.101  -3.572 -13.115
   18    H    ALA   3           H        ALA   3  -3.069  -2.162  -9.813
   19    HA   ALA   3           HA       ALA   3  -3.161   0.264  -8.144
   20   1HB   ALA   3          1HB       ALA   3  -3.300  -1.969  -7.100
   21   2HB   ALA   3          2HB       ALA   3  -1.746  -2.420  -7.827
   22   3HB   ALA   3          3HB       ALA   3  -1.810  -1.138  -6.595
   23    H    GLY   4           H        GLY   4  -1.374   1.714  -8.011
   24   1HA   GLY   4          2HA       GLY   4   0.443   1.672 -10.279
   25   2HA   GLY   4          1HA       GLY   4   0.448   2.824  -8.941
   26    H    ALA   5           H        ALA   5   2.849   2.013  -9.920
   27    HA   ALA   5           HA       ALA   5   3.975   0.174  -7.852
   28   1HB   ALA   5          1HB       ALA   5   4.963   0.734 -10.678
   29   2HB   ALA   5          2HB       ALA   5   4.232  -0.781 -10.103
   30   3HB   ALA   5          3HB       ALA   5   5.795  -0.247  -9.453
   31    H    VAL   6           H        VAL   6   5.347   1.299  -6.457
   32    HA   VAL   6           HA       VAL   6   6.375   3.953  -7.363
   33    HB   VAL   6           HB       VAL   6   5.958   4.687  -4.918
   34   1HG1  VAL   6          1HG1      VAL   6   4.012   3.753  -3.796
   35   2HG1  VAL   6          2HG1      VAL   6   3.815   2.519  -5.051
   36   3HG1  VAL   6          3HG1      VAL   6   5.238   2.507  -4.006
   37   1HG2  VAL   6          1HG2      VAL   6   4.816   5.717  -6.776
   38   2HG2  VAL   6          2HG2      VAL   6   3.698   5.467  -5.427
   39   3HG2  VAL   6          3HG2      VAL   6   3.638   4.389  -6.842
   40    H    ASN   7           H        ASN   7   7.992   4.832  -5.977
   41    HA   ASN   7           HA       ASN   7   9.767   2.991  -4.544
   42   1HB   ASN   7          1HB       ASN   7  10.684   2.892  -6.799
   43   2HB   ASN   7          2HB       ASN   7  10.523   4.649  -7.011
   44   1HD2  ASN   7          1HD2      ASN   7  12.151   2.163  -5.014
   45   2HD2  ASN   7          2HD2      ASN   7  13.605   3.079  -4.700
   46    H    ASP   8           HN       ASP   8  11.515   4.484  -3.613
   47    HA   ASP   8           HA       ASP   8  10.610   6.260  -1.800
   48   1HB   ASP   8          1HB       ASP   8  12.965   5.409  -2.067
   49   2HB   ASP   8          2HB       ASP   8  13.238   6.587  -3.339
   50    H    ASP   9           HN       ASP   9  11.806   7.207  -4.963
   51    HA   ASP   9           HA       ASP   9  11.259  10.016  -4.776
   52   1HB   ASP   9          2HB       ASP   9  12.751   9.149  -6.471
   53   2HB   ASP   9          1HB       ASP   9  11.495   8.148  -7.186
   54    H    THR  10           H        THR  10   9.494   7.767  -6.913
   55    HA   THR  10           HA       THR  10   7.351   9.430  -7.493
   56    HB   THR  10           HB       THR  10   6.192   7.231  -8.091
   57    HG1  THR  10           HG1      THR  10   7.753   5.456  -8.030
   58   1HG2  THR  10          1HG2      THR  10   7.769   6.732  -9.912
   59   2HG2  THR  10          2HG2      THR  10   7.641   8.484  -9.679
   60   3HG2  THR  10          3HG2      THR  10   9.063   7.612  -9.076
   61    H    PHE  11           H        PHE  11   7.608   7.119  -4.838
   62    HA   PHE  11           HA       PHE  11   5.169   6.989  -3.623
   63   1HB   PHE  11          1HB       PHE  11   7.273   6.047  -2.772
   64   2HB   PHE  11          2HB       PHE  11   7.853   7.622  -2.339
   65    HD1  PHE  11           HD1      PHE  11   5.143   5.147  -1.576
   66    HD2  PHE  11           HD2      PHE  11   7.432   8.521  -0.170
   67    HE1  PHE  11           HE1      PHE  11   4.271   4.790   0.718
   68    HE2  PHE  11           HE2      PHE  11   6.496   8.202   2.103
   69    HZ   PHE  11           HZ       PHE  11   4.946   6.310   2.560
   70    H    LYS  12           HN       LYS  12   7.447   9.674  -3.485
   71    HA   LYS  12           HA       LYS  12   5.943  11.240  -1.608
   72   1HB   LYS  12          1HB       LYS  12   7.867  12.249  -3.760
   73   2HB   LYS  12          2HB       LYS  12   7.212  13.114  -2.369
   74   1HG   LYS  12          2HG       LYS  12   8.129  10.824  -1.134
   75   2HG   LYS  12          1HG       LYS  12   9.207  10.845  -2.528
   76   1HD   LYS  12          2HD       LYS  12  10.197  12.929  -1.824
   77   2HD   LYS  12          1HD       LYS  12   8.910  13.215  -0.636
   78   1HE   LYS  12          2HE       LYS  12  10.889  12.358   0.532
   79   2HE   LYS  12          1HE       LYS  12   9.577  11.185   0.631
   80   1HZ   LYS  12          1HZ       LYS  12  11.834  11.065  -1.252
   81   2HZ   LYS  12          2HZ       LYS  12  10.602   9.976  -1.191
   82   3HZ   LYS  12          3HZ       LYS  12  11.632  10.117   0.078
   83    H    ASN  13           H        ASN  13   6.114  11.596  -5.167
   84    HA   ASN  13           HA       ASN  13   4.093  13.619  -5.367
   85   1HB   ASN  13          1HB       ASN  13   4.945  11.530  -7.407
   86   2HB   ASN  13          2HB       ASN  13   4.118  13.053  -7.729
   87   1HD2  ASN  13          2HD2      ASN  13   6.073  14.396  -5.568
   88   2HD2  ASN  13          1HD2      ASN  13   7.494  14.617  -6.570
   89    H    VAL  14           H        VAL  14   4.034  10.155  -5.230
   90    HA   VAL  14           HA       VAL  14   1.243   9.974  -6.251
   91    HB   VAL  14           HB       VAL  14   3.371   7.904  -5.583
   92   1HG1  VAL  14          1HG1      VAL  14   3.797   9.316  -7.633
   93   2HG1  VAL  14          2HG1      VAL  14   3.473   7.628  -8.036
   94   3HG1  VAL  14          3HG1      VAL  14   2.205   8.849  -8.247
   95   1HG2  VAL  14          1HG2      VAL  14   0.594   7.525  -6.752
   96   2HG2  VAL  14          2HG2      VAL  14   1.261   6.772  -5.279
   97   3HG2  VAL  14          3HG2      VAL  14   1.892   6.323  -6.869
   98    H    VAL  15           H        VAL  15   2.914   9.632  -3.154
   99    HA   VAL  15           HA       VAL  15   0.371   8.725  -1.881
  100    HB   VAL  15           HB       VAL  15   3.186   8.235  -0.830
  101   1HG1  VAL  15          1HG1      VAL  15   2.110   6.631   0.599
  102   2HG1  VAL  15          2HG1      VAL  15   0.517   7.027  -0.068
  103   3HG1  VAL  15          3HG1      VAL  15   1.422   8.236   0.857
  104   1HG2  VAL  15          1HG2      VAL  15   1.419   6.412  -2.509
  105   2HG2  VAL  15          2HG2      VAL  15   2.995   7.060  -2.973
  106   3HG2  VAL  15          3HG2      VAL  15   2.883   5.920  -1.642
  107    H    LEU  16           H        LEU  16   3.406  10.307  -0.797
  108    HA   LEU  16           HA       LEU  16   2.368  11.616   1.432
  109   1HB   LEU  16          2HB       LEU  16   4.531  12.566  -0.498
  110   2HB   LEU  16          1HB       LEU  16   4.185  13.318   1.018
  111    HG   LEU  16           HG       LEU  16   5.227  10.473   0.560
  112   1HD1  LEU  16          1HD2      LEU  16   7.288  11.321   1.559
  113   2HD1  LEU  16          2HD2      LEU  16   6.828  12.394   0.222
  114   3HD1  LEU  16          3HD2      LEU  16   6.530  12.892   1.892
  115   1HD2  LEU  16          1HD1      LEU  16   5.595  10.409   3.034
  116   2HD2  LEU  16          2HD1      LEU  16   4.629  11.889   3.192
  117   3HD2  LEU  16          3HD1      LEU  16   3.884  10.382   2.592
  118    H    GLU  17           HN       GLU  17   2.871  13.065  -1.735
  119    HA   GLU  17           HA       GLU  17   1.327  15.456  -1.147
  120   1HB   GLU  17          1HB       GLU  17   2.450  14.369  -3.758
  121   2HB   GLU  17          2HB       GLU  17   1.867  16.017  -3.500
  122   1HG   GLU  17          2HG       GLU  17   3.625  16.460  -1.863
  123   2HG   GLU  17          1HG       GLU  17   4.214  14.797  -1.957
  124    H    SER  18           H        SER  18  -0.053  12.480  -1.530
  125    HA   SER  18           HA       SER  18  -1.856  13.000  -3.738
  126   1HB   SER  18          2HB       SER  18  -1.281  10.718  -2.928
  127   2HB   SER  18          1HB       SER  18  -2.174  11.049  -1.426
  128    HG   SER  18           HG       SER  18  -4.004  10.768  -2.497
  129    H    SER  19           H        SER  19  -3.989  13.721  -3.687
  130    HA   SER  19           HA       SER  19  -4.834  15.398  -1.442
  131   1HB   SER  19          2HB       SER  19  -6.765  15.724  -3.138
  132   2HB   SER  19          1HB       SER  19  -5.150  16.281  -3.631
  133    HG   SER  19           HG       SER  19  -6.103  15.004  -5.279
  134    H    VAL  20           H        VAL  20  -6.232  12.803  -3.405
  135    HA   VAL  20           HA       VAL  20  -8.219  12.090  -1.404
  136    HB   VAL  20           HB       VAL  20  -8.918  10.395  -3.038
  137   1HG1  VAL  20          1HG2      VAL  20  -7.756  10.113  -5.196
  138   2HG1  VAL  20          2HG2      VAL  20  -6.785   9.537  -3.843
  139   3HG1  VAL  20          3HG2      VAL  20  -6.403  11.093  -4.611
  140   1HG2  VAL  20          1HG1      VAL  20  -9.592  12.758  -3.376
  141   2HG2  VAL  20          2HG1      VAL  20  -8.220  12.976  -4.485
  142   3HG2  VAL  20          3HG1      VAL  20  -9.508  11.825  -4.880
  143    HA   PRO  21           HA       PRO  21  -6.184   8.941   0.884
  144   1HB   PRO  21          1HB       PRO  21  -8.289   7.005  -0.128
  145   2HB   PRO  21          2HB       PRO  21  -7.641   7.143   1.529
  146   1HG   PRO  21          1HG       PRO  21  -9.982   8.255   0.849
  147   2HG   PRO  21          2HG       PRO  21  -8.860   9.175   1.883
  148   1HD   PRO  21          1HD       PRO  21  -9.474   9.573  -1.023
  149   2HD   PRO  21          2HD       PRO  21  -9.010  10.764   0.220
  150    H    VAL  22           H        VAL  22  -5.067   6.877   0.792
  151    HA   VAL  22           HA       VAL  22  -4.400   5.803  -1.867
  152    HB   VAL  22           HB       VAL  22  -2.217   6.799  -0.004
  153   1HG1  VAL  22          1HG1      VAL  22  -1.503   5.035  -1.529
  154   2HG1  VAL  22          2HG1      VAL  22  -0.731   6.581  -1.873
  155   3HG1  VAL  22          3HG1      VAL  22  -2.016   6.021  -2.916
  156   1HG2  VAL  22          1HG2      VAL  22  -1.834   8.654  -1.611
  157   2HG2  VAL  22          2HG2      VAL  22  -3.340   8.828  -0.720
  158   3HG2  VAL  22          3HG2      VAL  22  -3.365   8.264  -2.407
  159    H    LEU  23           H        LEU  23  -3.524   3.720  -1.729
  160    HA   LEU  23           HA       LEU  23  -3.229   2.485   0.992
  161   1HB   LEU  23          2HB       LEU  23  -5.363   1.819  -0.047
  162   2HB   LEU  23          1HB       LEU  23  -4.542   1.161  -1.438
  163    HG   LEU  23           HG       LEU  23  -3.824   0.225   1.365
  164   1HD1  LEU  23          1HD2      LEU  23  -2.315  -0.660  -0.356
  165   2HD1  LEU  23          2HD2      LEU  23  -3.399  -1.949   0.125
  166   3HD1  LEU  23          3HD2      LEU  23  -3.693  -1.088  -1.392
  167   1HD2  LEU  23          1HD1      LEU  23  -6.103  -0.826  -0.355
  168   2HD2  LEU  23          2HD1      LEU  23  -6.243  -0.007   1.223
  169   3HD2  LEU  23          3HD1      LEU  23  -5.480  -1.599   1.117
  170    H    VAL  24           H        VAL  24  -1.013   2.013   1.090
  171    HA   VAL  24           HA       VAL  24   0.271   1.196  -1.507
  172    HB   VAL  24           HB       VAL  24   2.289   2.010  -0.909
  173   1HG1  VAL  24          1HG2      VAL  24   1.983   4.375  -0.281
  174   2HG1  VAL  24          2HG2      VAL  24   0.280   4.070   0.080
  175   3HG1  VAL  24          3HG2      VAL  24   0.893   3.829  -1.562
  176   1HG2  VAL  24          1HG1      VAL  24   1.387   2.070   1.958
  177   2HG2  VAL  24          2HG1      VAL  24   2.816   2.967   1.388
  178   3HG2  VAL  24          3HG1      VAL  24   2.737   1.213   1.206
  179    H    ASP  25           HN       ASP  25   1.148  -0.804  -1.578
  180    HA   ASP  25           HA       ASP  25   1.357  -2.390   0.966
  181   1HB   ASP  25          1HB       ASP  25  -0.156  -3.465  -0.569
  182   2HB   ASP  25          2HB       ASP  25   0.992  -3.284  -1.903
  183    H    PHE  26           H        PHE  26   3.409  -2.603   1.695
  184    HA   PHE  26           HA       PHE  26   5.703  -1.886  -0.041
  185   1HB   PHE  26          1HB       PHE  26   5.406  -2.801   2.838
  186   2HB   PHE  26          2HB       PHE  26   6.958  -2.683   2.034
  187    HD1  PHE  26           HD1      PHE  26   3.914  -0.553   2.770
  188    HD2  PHE  26           HD2      PHE  26   8.168  -0.686   2.058
  189    HE1  PHE  26           HE1      PHE  26   4.091   1.855   3.305
  190    HE2  PHE  26           HE2      PHE  26   8.343   1.692   2.695
  191    HZ   PHE  26           HZ       PHE  26   6.293   2.976   3.322
  192    H    TRP  27           H        TRP  27   6.411  -3.398  -1.475
  193    HA   TRP  27           HA       TRP  27   6.186  -6.283  -0.737
  194   1HB   TRP  27          2HB       TRP  27   5.436  -6.854  -2.902
  195   2HB   TRP  27          1HB       TRP  27   4.400  -5.542  -2.385
  196    HD1  TRP  27           HD1      TRP  27   5.261  -3.064  -3.393
  197    HE1  TRP  27           HE1      TRP  27   6.486  -2.426  -5.595
  198    HE3  TRP  27           HE3      TRP  27   6.554  -7.749  -4.988
  199    HZ2  TRP  27           HZ2      TRP  27   8.096  -3.798  -7.566
  200    HZ3  TRP  27           HZ3      TRP  27   7.717  -8.041  -7.132
  201    HH2  TRP  27           HH2      TRP  27   8.545  -6.083  -8.405
  202    H    ALA  28           H        ALA  28   7.414  -7.433  -2.768
  203    HA   ALA  28           HA       ALA  28   9.636  -6.107  -3.892
  204   1HB   ALA  28          1HB       ALA  28  11.470  -7.360  -2.759
  205   2HB   ALA  28          2HB       ALA  28  10.649  -6.286  -1.616
  206   3HB   ALA  28          3HB       ALA  28  10.298  -8.033  -1.614
  207    HA   PRO  29           HA       PRO  29   9.019  -9.659  -6.523
  208   1HB   PRO  29          1HB       PRO  29  11.585 -10.307  -7.335
  209   2HB   PRO  29          2HB       PRO  29  10.506  -9.017  -7.981
  210   1HG   PRO  29          1HG       PRO  29  12.692  -8.693  -5.893
  211   2HG   PRO  29          2HG       PRO  29  12.431  -7.713  -7.369
  212   1HD   PRO  29          2HD       PRO  29  11.436  -6.770  -5.068
  213   2HD   PRO  29          1HD       PRO  29  10.383  -6.814  -6.481
  214    H    TRP  30           H        TRP  30  11.692 -10.116  -4.133
  215    HA   TRP  30           HA       TRP  30  11.329 -12.980  -4.058
  216   1HB   TRP  30          2HB       TRP  30  12.677 -12.754  -1.936
  217   2HB   TRP  30          1HB       TRP  30  13.411 -12.159  -3.415
  218    HD1  TRP  30           HD1      TRP  30  14.350  -9.802  -3.409
  219    HE1  TRP  30           HE1      TRP  30  14.453  -7.842  -1.741
  220    HE3  TRP  30           HE3      TRP  30  11.096 -11.581   0.129
  221    HZ2  TRP  30           HZ2      TRP  30  13.189  -7.103   0.732
  222    HZ3  TRP  30           HZ3      TRP  30  10.563 -10.221   2.121
  223    HH2  TRP  30           HH2      TRP  30  11.511  -7.949   2.386
  224    H    CYS  31           H        CYS  31   9.268 -10.494  -2.864
  225    HA   CYS  31           HA       CYS  31   8.489 -11.872  -0.408
  226   1HB   CYS  31          1HB       CYS  31   8.422  -9.409  -0.613
  227   2HB   CYS  31          2HB       CYS  31   7.158  -9.564  -1.824
  228    H    GLY  32           H        GLY  32   8.042 -13.945  -1.478
  229   1HA   GLY  32          2HA       GLY  32   6.052 -14.716  -3.161
  230   2HA   GLY  32          1HA       GLY  32   6.309 -15.544  -1.619
  231    HA   PRO  33           HA       PRO  33   2.475 -14.303   0.075
  232   1HB   PRO  33          2HB       PRO  33   2.809 -12.486   2.150
  233   2HB   PRO  33          1HB       PRO  33   3.022 -14.257   2.240
  234   1HG   PRO  33          2HG       PRO  33   5.179 -12.181   1.848
  235   2HG   PRO  33          1HG       PRO  33   5.178 -13.582   2.948
  236   1HD   PRO  33          2HD       PRO  33   6.446 -13.679   0.601
  237   2HD   PRO  33          1HD       PRO  33   5.482 -15.075   1.135
  238    H    CYS  34           H        CYS  34   4.519 -11.569  -0.864
  239    HA   CYS  34           HA       CYS  34   2.358  -9.604  -1.020
  240   1HB   CYS  34          2HB       CYS  34   5.006  -9.502  -2.424
  241   2HB   CYS  34          1HB       CYS  34   3.805  -8.243  -2.189
  242    H    ARG  35           HN       ARG  35   4.230 -11.701  -3.222
  243    HA   ARG  35           HA       ARG  35   3.084 -11.043  -5.659
  244   1HB   ARG  35          2HB       ARG  35   5.002 -12.756  -4.987
  245   2HB   ARG  35          1HB       ARG  35   3.726 -13.937  -4.920
  246   1HG   ARG  35          1HG       ARG  35   4.910 -13.961  -7.068
  247   2HG   ARG  35          2HG       ARG  35   3.176 -13.705  -7.244
  248   1HD   ARG  35          1HD       ARG  35   4.830 -12.273  -8.705
  249   2HD   ARG  35          2HD       ARG  35   3.410 -11.522  -7.983
  250    HE   ARG  35           HE       ARG  35   4.721 -10.153  -6.778
  251   1HH1  ARG  35          1HH1      ARG  35   6.848 -12.806  -7.755
  252   2HH1  ARG  35          2HH1      ARG  35   8.062 -12.412  -6.545
  253   1HH2  ARG  35          1HH2      ARG  35   6.195  -9.823  -5.079
  254   2HH2  ARG  35          2HH2      ARG  35   7.685 -10.718  -5.030
  255    H    ILE  36           H        ILE  36   1.946 -13.544  -3.377
  256    HA   ILE  36           HA       ILE  36  -0.271 -14.212  -5.125
  257    HB   ILE  36           HB       ILE  36  -1.094 -15.623  -3.264
  258   1HG1  ILE  36          2HG1      ILE  36   0.601 -16.123  -1.440
  259   2HG1  ILE  36          1HG1      ILE  36   1.344 -14.565  -1.772
  260   1HG2  ILE  36          1HG2      ILE  36   0.510 -16.361  -5.016
  261   2HG2  ILE  36          2HG2      ILE  36   1.863 -15.903  -3.961
  262   3HG2  ILE  36          3HG2      ILE  36   0.756 -17.204  -3.484
  263   1HD1  ILE  36          1HD1      ILE  36  -0.846 -13.485  -1.176
  264   2HD1  ILE  36          2HD1      ILE  36  -0.241 -14.496   0.142
  265   3HD1  ILE  36          3HD1      ILE  36  -1.549 -15.089  -0.903
  266    H    ILE  37           H        ILE  37  -0.028 -11.526  -2.841
  267    HA   ILE  37           HA       ILE  37  -3.012 -11.278  -2.936
  268    HB   ILE  37           HB       ILE  37  -2.746  -9.285  -1.588
  269   1HG1  ILE  37          2HG1      ILE  37   0.178 -10.004  -1.296
  270   2HG1  ILE  37          1HG1      ILE  37  -0.414  -8.649  -2.279
  271   1HG2  ILE  37          1HG2      ILE  37  -1.259 -11.552  -0.219
  272   2HG2  ILE  37          2HG2      ILE  37  -2.433 -10.428   0.471
  273   3HG2  ILE  37          3HG2      ILE  37  -2.980 -11.681  -0.647
  274   1HD1  ILE  37          1HD1      ILE  37  -1.446  -7.668  -0.233
  275   2HD1  ILE  37          2HD1      ILE  37   0.323  -7.809  -0.159
  276   3HD1  ILE  37          3HD1      ILE  37  -0.685  -8.961   0.730
  277    H    ALA  38           H        ALA  38  -0.086  -9.959  -4.399
  278    HA   ALA  38           HA       ALA  38  -0.722  -7.592  -5.393
  279   1HB   ALA  38          1HB       ALA  38   1.368  -8.781  -5.867
  280   2HB   ALA  38          2HB       ALA  38   0.559  -9.791  -7.078
  281   3HB   ALA  38          3HB       ALA  38   0.697  -8.054  -7.336
  282    HA   PRO  39           HA       PRO  39  -3.306  -9.061  -9.199
  283   1HB   PRO  39          2HB       PRO  39  -4.685 -11.506  -8.134
  284   2HB   PRO  39          1HB       PRO  39  -4.068 -11.197  -9.780
  285   1HG   PRO  39          2HG       PRO  39  -2.734 -12.878  -8.103
  286   2HG   PRO  39          1HG       PRO  39  -1.819 -11.699  -9.096
  287   1HD   PRO  39          2HD       PRO  39  -2.738 -11.383  -6.225
  288   2HD   PRO  39          1HD       PRO  39  -1.105 -11.180  -6.861
  289    H    VAL  40           H        VAL  40  -4.320  -9.839  -5.887
  290    HA   VAL  40           HA       VAL  40  -7.066  -8.917  -6.202
  291    HB   VAL  40           HB       VAL  40  -5.495  -9.196  -3.610
  292   1HG1  VAL  40          1HG2      VAL  40  -8.484  -9.095  -4.273
  293   2HG1  VAL  40          2HG2      VAL  40  -7.558  -7.833  -3.436
  294   3HG1  VAL  40          3HG2      VAL  40  -7.811  -9.405  -2.665
  295   1HG2  VAL  40          1HG1      VAL  40  -7.284 -11.106  -5.103
  296   2HG2  VAL  40          2HG1      VAL  40  -5.528 -11.303  -4.781
  297   3HG2  VAL  40          3HG1      VAL  40  -6.689 -11.319  -3.424
  298    H    VAL  41           H        VAL  41  -3.967  -7.669  -4.898
  299    HA   VAL  41           HA       VAL  41  -4.957  -5.257  -3.980
  300    HB   VAL  41           HB       VAL  41  -2.203  -5.746  -5.245
  301   1HG1  VAL  41          1HG1      VAL  41  -2.982  -5.754  -2.299
  302   2HG1  VAL  41          2HG1      VAL  41  -1.381  -6.100  -2.979
  303   3HG1  VAL  41          3HG1      VAL  41  -2.716  -7.217  -3.247
  304   1HG2  VAL  41          1HG2      VAL  41  -1.424  -3.832  -3.842
  305   2HG2  VAL  41          2HG2      VAL  41  -2.572  -3.333  -5.083
  306   3HG2  VAL  41          3HG2      VAL  41  -3.102  -3.502  -3.392
  307    H    ASP  42           HN       ASP  42  -3.870  -6.198  -7.225
  308    HA   ASP  42           HA       ASP  42  -4.351  -3.691  -8.530
  309   1HB   ASP  42          1HB       ASP  42  -4.080  -6.567  -9.451
  310   2HB   ASP  42          2HB       ASP  42  -4.560  -5.310 -10.589
  311    H    GLU  43           HN       GLU  43  -6.499  -6.698  -8.743
  312    HA   GLU  43           HA       GLU  43  -8.470  -5.233 -10.139
  313   1HB   GLU  43          1HB       GLU  43  -9.972  -7.038  -9.590
  314   2HB   GLU  43          2HB       GLU  43  -8.426  -7.617 -10.191
  315   1HG   GLU  43          1HG       GLU  43  -8.141  -8.913  -8.389
  316   2HG   GLU  43          2HG       GLU  43  -8.284  -7.521  -7.314
  317    H    ILE  44           H        ILE  44  -8.133  -5.691  -6.567
  318    HA   ILE  44           HA       ILE  44 -10.589  -4.287  -6.030
  319    HB   ILE  44           HB       ILE  44  -8.127  -4.772  -4.304
  320   1HG1  ILE  44          2HG1      ILE  44 -10.874  -6.069  -4.717
  321   2HG1  ILE  44          1HG1      ILE  44  -9.286  -6.809  -4.910
  322   1HG2  ILE  44          1HG2      ILE  44 -10.835  -3.633  -3.530
  323   2HG2  ILE  44          2HG2      ILE  44  -9.277  -2.768  -3.475
  324   3HG2  ILE  44          3HG2      ILE  44  -9.549  -4.112  -2.393
  325   1HD1  ILE  44          1HD1      ILE  44 -10.211  -7.663  -2.896
  326   2HD1  ILE  44          2HD1      ILE  44  -8.999  -6.466  -2.375
  327   3HD1  ILE  44          3HD1      ILE  44 -10.737  -6.065  -2.356
  328    H    ALA  45           H        ALA  45  -7.413  -3.046  -7.037
  329    HA   ALA  45           HA       ALA  45  -7.786  -0.355  -6.125
  330   1HB   ALA  45          1HB       ALA  45  -6.196   0.259  -7.812
  331   2HB   ALA  45          2HB       ALA  45  -6.481  -1.188  -8.755
  332   3HB   ALA  45          3HB       ALA  45  -5.666  -1.328  -7.185
  333    H    GLY  46           H        GLY  46  -8.866  -2.202  -8.985
  334   1HA   GLY  46          1HA       GLY  46 -10.099  -0.054 -10.428
  335   2HA   GLY  46          2HA       GLY  46 -10.469  -1.786 -10.569
  336    H    GLU  47           HN       GLU  47 -11.338  -2.476  -8.038
  337    HA   GLU  47           HA       GLU  47 -14.003  -1.583  -8.057
  338   1HB   GLU  47          1HB       GLU  47 -12.424  -2.786  -5.731
  339   2HB   GLU  47          2HB       GLU  47 -14.169  -2.730  -5.879
  340   1HG   GLU  47          2HG       GLU  47 -12.317  -4.282  -7.751
  341   2HG   GLU  47          1HG       GLU  47 -13.254  -4.960  -6.429
  342    H    TYR  48           H        TYR  48 -11.379  -0.592  -5.861
  343    HA   TYR  48           HA       TYR  48 -13.139   1.575  -4.747
  344   1HB   TYR  48          2HB       TYR  48 -10.385   0.682  -3.851
  345   2HB   TYR  48          1HB       TYR  48 -11.506   1.728  -2.983
  346    HD1  TYR  48           HD1      TYR  48 -14.059  -0.074  -3.507
  347    HD2  TYR  48           HD2      TYR  48 -10.090  -0.793  -1.965
  348    HE1  TYR  48           HE1      TYR  48 -14.908  -1.982  -2.202
  349    HE2  TYR  48           HE2      TYR  48 -10.960  -2.707  -0.654
  350    HH   TYR  48           HH       TYR  48 -14.357  -3.483  -0.377
  351    H    LYS  49           HN       LYS  49 -12.098   1.804  -7.469
  352    HA   LYS  49           HA       LYS  49  -9.896   3.544  -7.596
  353   1HB   LYS  49          2HB       LYS  49 -10.809   4.190  -9.814
  354   2HB   LYS  49          1HB       LYS  49 -10.800   2.457  -9.546
  355   1HG   LYS  49          2HG       LYS  49 -13.274   2.600  -8.948
  356   2HG   LYS  49          1HG       LYS  49 -13.223   4.324  -9.342
  357   1HD   LYS  49          2HD       LYS  49 -12.554   3.774 -11.666
  358   2HD   LYS  49          1HD       LYS  49 -12.517   2.046 -11.247
  359   1HE   LYS  49          2HE       LYS  49 -14.935   2.126 -10.672
  360   2HE   LYS  49          1HE       LYS  49 -14.988   3.840 -11.131
  361   1HZ   LYS  49          1HZ       LYS  49 -14.314   1.599 -12.908
  362   2HZ   LYS  49          2HZ       LYS  49 -15.742   2.420 -12.883
  363   3HZ   LYS  49          3HZ       LYS  49 -14.360   3.188 -13.346
  364    H    ASP  50           HN       ASP  50 -10.029   5.752  -8.384
  365    HA   ASP  50           HA       ASP  50 -10.440   7.980  -8.236
  366   1HB   ASP  50          2HB       ASP  50 -12.810   7.423  -8.774
  367   2HB   ASP  50          1HB       ASP  50 -13.186   7.278  -7.065
  368    H    LYS  51           HN       LYS  51 -11.902   6.420  -5.435
  369    HA   LYS  51           HA       LYS  51 -11.081   8.609  -3.654
  370   1HB   LYS  51          1HB       LYS  51 -12.294   5.906  -2.982
  371   2HB   LYS  51          2HB       LYS  51 -12.142   7.290  -1.889
  372   1HG   LYS  51          1HG       LYS  51 -13.530   8.628  -3.580
  373   2HG   LYS  51          2HG       LYS  51 -13.865   7.105  -4.409
  374   1HD   LYS  51          2HD       LYS  51 -14.543   7.766  -1.501
  375   2HD   LYS  51          1HD       LYS  51 -15.678   7.737  -2.860
  376   1HE   LYS  51          1HE       LYS  51 -15.187   5.298  -3.192
  377   2HE   LYS  51          2HE       LYS  51 -14.140   5.333  -1.760
  378   1HZ   LYS  51          1HZ       LYS  51 -16.018   5.986  -0.460
  379   2HZ   LYS  51          2HZ       LYS  51 -16.306   4.559  -1.229
  380   3HZ   LYS  51          3HZ       LYS  51 -17.004   5.946  -1.781
  381    H    LEU  52           H        LEU  52 -10.187   5.175  -3.982
  382    HA   LEU  52           HA       LEU  52  -7.964   5.609  -2.036
  383   1HB   LEU  52          1HB       LEU  52  -9.799   3.927  -1.549
  384   2HB   LEU  52          2HB       LEU  52  -9.220   3.010  -2.946
  385    HG   LEU  52           HG       LEU  52  -6.905   3.015  -1.791
  386   1HD1  LEU  52          1HD1      LEU  52  -8.671   3.926   0.533
  387   2HD1  LEU  52          2HD1      LEU  52  -7.053   3.235   0.728
  388   3HD1  LEU  52          3HD1      LEU  52  -7.249   4.771  -0.115
  389   1HD2  LEU  52          1HD2      LEU  52  -8.357   1.037  -1.915
  390   2HD2  LEU  52          2HD2      LEU  52  -7.635   1.120  -0.301
  391   3HD2  LEU  52          3HD2      LEU  52  -9.319   1.614  -0.535
  392    H    LYS  53           HN       LYS  53  -6.185   6.208  -3.160
  393    HA   LYS  53           HA       LYS  53  -5.637   5.128  -5.818
  394   1HB   LYS  53          1HB       LYS  53  -5.101   7.439  -4.804
  395   2HB   LYS  53          2HB       LYS  53  -3.714   6.694  -4.062
  396   1HG   LYS  53          2HG       LYS  53  -4.367   6.677  -7.056
  397   2HG   LYS  53          1HG       LYS  53  -3.295   7.839  -6.267
  398   1HD   LYS  53          1HD       LYS  53  -1.739   6.098  -5.609
  399   2HD   LYS  53          2HD       LYS  53  -2.759   4.827  -6.312
  400   1HE   LYS  53          1HE       LYS  53  -1.553   7.102  -7.931
  401   2HE   LYS  53          2HE       LYS  53  -0.828   5.494  -7.748
  402   1HZ   LYS  53          1HZ       LYS  53  -2.100   5.632  -9.735
  403   2HZ   LYS  53          2HZ       LYS  53  -3.465   6.037  -8.909
  404   3HZ   LYS  53          3HZ       LYS  53  -2.791   4.546  -8.706
  405    H    CYS  54           H        CYS  54  -5.369   2.904  -5.684
  406    HA   CYS  54           HA       CYS  54  -3.848   1.677  -3.546
  407   1HB   CYS  54          1HB       CYS  54  -5.792   0.609  -4.737
  408   2HB   CYS  54          2HB       CYS  54  -4.725   0.475  -6.166
  409    HG   CYS  54           HG       CYS  54  -4.783  -1.835  -5.058
  410    H    VAL  55           H        VAL  55  -1.733   0.943  -3.542
  411    HA   VAL  55           HA       VAL  55  -0.141   1.070  -6.008
  412    HB   VAL  55           HB       VAL  55   1.344   2.486  -3.928
  413   1HG1  VAL  55          1HG1      VAL  55   0.226   4.614  -3.875
  414   2HG1  VAL  55          2HG1      VAL  55  -1.146   3.977  -4.787
  415   3HG1  VAL  55          3HG1      VAL  55  -0.817   3.391  -3.140
  416   1HG2  VAL  55          1HG2      VAL  55   1.896   2.510  -6.314
  417   2HG2  VAL  55          2HG2      VAL  55   0.355   3.330  -6.673
  418   3HG2  VAL  55          3HG2      VAL  55   1.603   4.150  -5.718
  419    H    LYS  56           HN       LYS  56   2.027   0.287  -5.785
  420    HA   LYS  56           HA       LYS  56   2.562  -1.408  -3.400
  421   1HB   LYS  56          1HB       LYS  56   2.310  -2.055  -6.314
  422   2HB   LYS  56          2HB       LYS  56   3.645  -2.833  -5.475
  423   1HG   LYS  56          1HG       LYS  56   2.209  -3.768  -3.792
  424   2HG   LYS  56          2HG       LYS  56   0.795  -2.894  -4.409
  425   1HD   LYS  56          1HD       LYS  56   2.343  -5.003  -5.993
  426   2HD   LYS  56          2HD       LYS  56   0.925  -5.346  -4.987
  427   1HE   LYS  56          1HE       LYS  56  -0.407  -3.706  -6.344
  428   2HE   LYS  56          2HE       LYS  56   0.977  -3.525  -7.437
  429   1HZ   LYS  56          1HZ       LYS  56   0.835  -5.892  -7.849
  430   2HZ   LYS  56          2HZ       LYS  56  -0.563  -5.134  -8.269
  431   3HZ   LYS  56          3HZ       LYS  56  -0.497  -6.006  -6.884
  432    H    LEU  57           H        LEU  57   4.460  -0.875  -2.456
  433    HA   LEU  57           HA       LEU  57   6.448   0.720  -4.022
  434   1HB   LEU  57          1HB       LEU  57   5.584   1.750  -1.927
  435   2HB   LEU  57          2HB       LEU  57   6.176   0.348  -1.033
  436    HG   LEU  57           HG       LEU  57   8.487   1.159  -2.370
  437   1HD1  LEU  57          1HD2      LEU  57   8.337   0.655  -0.013
  438   2HD1  LEU  57          2HD2      LEU  57   7.365   2.134   0.262
  439   3HD1  LEU  57          3HD2      LEU  57   9.068   2.257  -0.204
  440   1HD2  LEU  57          1HD1      LEU  57   7.317   3.169  -3.300
  441   2HD2  LEU  57          2HD1      LEU  57   6.967   3.686  -1.641
  442   3HD2  LEU  57          3HD1      LEU  57   8.641   3.584  -2.201
  443    H    ASN  58           H        ASN  58   8.285  -0.222  -4.677
  444    HA   ASN  58           HA       ASN  58   8.900  -2.952  -3.761
  445   1HB   ASN  58          1HB       ASN  58   9.330  -2.259  -6.085
  446   2HB   ASN  58          2HB       ASN  58  10.540  -1.107  -5.519
  447   1HD2  ASN  58          2HD2      ASN  58  10.232  -4.152  -6.795
  448   2HD2  ASN  58          1HD2      ASN  58  11.710  -4.856  -6.159
  449    H    THR  59           H        THR  59   9.655  -3.250  -1.849
  450    HA   THR  59           HA       THR  59  10.694  -1.183  -0.151
  451    HB   THR  59           HB       THR  59  10.757  -4.205   0.259
  452    HG1  THR  59           HG1      THR  59   8.676  -3.639  -0.274
  453   1HG2  THR  59          1HG2      THR  59  10.503  -3.647   2.631
  454   2HG2  THR  59          2HG2      THR  59  11.950  -2.836   2.004
  455   3HG2  THR  59          3HG2      THR  59  10.444  -1.919   2.249
  456    H    ASP  60           HN       ASP  60  12.199  -3.689  -2.132
  457    HA   ASP  60           HA       ASP  60  14.812  -3.657  -0.901
  458   1HB   ASP  60          1HB       ASP  60  13.590  -5.425  -2.404
  459   2HB   ASP  60          2HB       ASP  60  14.166  -4.469  -3.761
  460    H    GLU  61           HN       GLU  61  13.227  -2.114  -3.598
  461    HA   GLU  61           HA       GLU  61  15.497  -0.541  -4.517
  462   1HB   GLU  61          2HB       GLU  61  13.513  -1.521  -5.868
  463   2HB   GLU  61          1HB       GLU  61  12.551  -0.210  -5.162
  464   1HG   GLU  61          1HG       GLU  61  13.211   0.511  -7.297
  465   2HG   GLU  61          2HG       GLU  61  14.254   1.412  -6.203
  466    H    SER  62           H        SER  62  12.812  -0.082  -2.282
  467    HA   SER  62           HA       SER  62  13.545   2.786  -1.844
  468   1HB   SER  62          2HB       SER  62  11.319   2.237  -2.916
  469   2HB   SER  62          1HB       SER  62  10.869   1.421  -1.417
  470    HG   SER  62           HG       SER  62  11.222   3.348  -0.320
  471    HA   PRO  63           HA       PRO  63  14.094   0.163   2.109
  472   1HB   PRO  63          1HB       PRO  63  16.764   0.660   2.534
  473   2HB   PRO  63          2HB       PRO  63  16.154  -0.724   1.572
  474   1HG   PRO  63          1HG       PRO  63  17.125   1.967   0.563
  475   2HG   PRO  63          2HG       PRO  63  17.575   0.340  -0.035
  476   1HD   PRO  63          1HD       PRO  63  15.666   1.780  -1.287
  477   2HD   PRO  63          2HD       PRO  63  15.428   0.027  -1.026
  478    H    ASN  64           H        ASN  64  15.044   3.280   0.887
  479    HA   ASN  64           HA       ASN  64  15.601   4.738   3.255
  480   1HB   ASN  64          1HB       ASN  64  14.211   5.647   0.693
  481   2HB   ASN  64          2HB       ASN  64  14.797   6.733   1.961
  482   1HD2  ASN  64          1HD2      ASN  64  15.723   7.124  -0.602
  483   2HD2  ASN  64          2HD2      ASN  64  17.409   6.617  -0.673
  484    H    VAL  65           H        VAL  65  12.505   4.631   1.515
  485    HA   VAL  65           HA       VAL  65  10.890   5.788   3.514
  486    HB   VAL  65           HB       VAL  65  10.173   3.723   1.383
  487   1HG1  VAL  65          1HG2      VAL  65   7.913   4.570   1.541
  488   2HG1  VAL  65          2HG2      VAL  65   8.402   5.738   2.795
  489   3HG1  VAL  65          3HG2      VAL  65   8.420   3.996   3.137
  490   1HG2  VAL  65          1HG1      VAL  65  11.222   5.675   0.368
  491   2HG2  VAL  65          2HG1      VAL  65  10.238   6.775   1.351
  492   3HG2  VAL  65          3HG1      VAL  65   9.472   5.768   0.101
  493    H    ALA  66           H        ALA  66  11.461   2.389   2.704
  494    HA   ALA  66           HA       ALA  66   9.991   1.105   4.628
  495   1HB   ALA  66          1HB       ALA  66  11.461   0.058   2.826
  496   2HB   ALA  66          2HB       ALA  66  12.820   0.221   3.961
  497   3HB   ALA  66          3HB       ALA  66  11.439  -0.789   4.389
  498    H    SER  67           H        SER  67  13.305   2.383   5.099
  499    HA   SER  67           HA       SER  67  13.522   1.617   7.855
  500   1HB   SER  67          1HB       SER  67  14.998   3.814   6.328
  501   2HB   SER  67          2HB       SER  67  15.478   3.080   7.869
  502    HG   SER  67           HG       SER  67  15.270   1.806   5.336
  503    H    GLU  68           HN       GLU  68  12.682   4.688   6.250
  504    HA   GLU  68           HA       GLU  68  12.409   6.324   8.546
  505   1HB   GLU  68          1HB       GLU  68  10.944   6.352   5.878
  506   2HB   GLU  68          2HB       GLU  68  10.809   7.642   7.073
  507   1HG   GLU  68          1HG       GLU  68  13.057   8.310   6.830
  508   2HG   GLU  68          2HG       GLU  68  13.548   6.797   6.070
  509    H    TYR  69           H        TYR  69   9.948   4.297   6.913
  510    HA   TYR  69           HA       TYR  69   7.880   4.956   8.886
  511   1HB   TYR  69          2HB       TYR  69   8.090   3.168   6.451
  512   2HB   TYR  69          1HB       TYR  69   6.772   2.984   7.584
  513    HD1  TYR  69           HD1      TYR  69   8.452   5.488   5.349
  514    HD2  TYR  69           HD2      TYR  69   4.933   4.569   7.659
  515    HE1  TYR  69           HE1      TYR  69   7.301   7.447   4.376
  516    HE2  TYR  69           HE2      TYR  69   3.774   6.515   6.660
  517    HH   TYR  69           HH       TYR  69   4.048   8.442   5.383
  518    H    GLY  70           H        GLY  70  10.183   2.292   8.370
  519   1HA   GLY  70          2HA       GLY  70  11.005   0.899  10.066
  520   2HA   GLY  70          1HA       GLY  70   9.669   1.350  11.137
  521    H    ILE  71           H        ILE  71   9.926   0.059   7.814
  522    HA   ILE  71           HA       ILE  71   7.626  -1.689   8.140
  523    HB   ILE  71           HB       ILE  71   9.717  -1.472   5.941
  524   1HG1  ILE  71          1HG1      ILE  71   8.470   0.656   6.338
  525   2HG1  ILE  71          2HG1      ILE  71   8.147  -0.106   4.794
  526   1HG2  ILE  71          1HG2      ILE  71   8.616  -3.586   5.664
  527   2HG2  ILE  71          2HG2      ILE  71   7.834  -2.474   4.540
  528   3HG2  ILE  71          3HG2      ILE  71   7.036  -2.902   6.073
  529   1HD1  ILE  71          1HD1      ILE  71   6.136   0.861   5.792
  530   2HD1  ILE  71          2HD1      ILE  71   6.283  -0.204   7.193
  531   3HD1  ILE  71          3HD1      ILE  71   5.963  -0.883   5.572
  532    H    ARG  72           HN       ARG  72   8.283  -2.797  10.017
  533    HA   ARG  72           HA       ARG  72  10.511  -4.644   9.963
  534   1HB   ARG  72          1HB       ARG  72   9.677  -3.666  12.004
  535   2HB   ARG  72          2HB       ARG  72   8.089  -4.420  11.803
  536   1HG   ARG  72          1HG       ARG  72   8.885  -6.574  12.292
  537   2HG   ARG  72          2HG       ARG  72  10.550  -6.183  11.859
  538   1HD   ARG  72          1HD       ARG  72   9.031  -5.077  14.272
  539   2HD   ARG  72          2HD       ARG  72  10.124  -6.453  14.357
  540    HE   ARG  72           HE       ARG  72  10.804  -3.634  14.245
  541   1HH1  ARG  72          2HH2      ARG  72  12.013  -6.855  13.458
  542   2HH1  ARG  72          1HH2      ARG  72  13.695  -6.406  13.546
  543   1HH2  ARG  72          1HH1      ARG  72  12.989  -3.021  14.349
  544   2HH2  ARG  72          2HH1      ARG  72  14.257  -4.179  14.052
  545    H    SER  73           H        SER  73   9.911  -5.444   7.828
  546    HA   SER  73           HA       SER  73   9.802  -7.536   6.795
  547   1HB   SER  73          1HB       SER  73   7.422  -8.323   8.525
  548   2HB   SER  73          2HB       SER  73   8.409  -9.356   7.484
  549    HG   SER  73           HG       SER  73   9.043  -8.151   9.937
  550    H    ILE  74           H        ILE  74   8.078  -8.525   5.259
  551    HA   ILE  74           HA       ILE  74   5.915  -6.643   4.657
  552    HB   ILE  74           HB       ILE  74   6.560  -6.781   2.216
  553   1HG1  ILE  74          1HG1      ILE  74   9.291  -7.638   3.192
  554   2HG1  ILE  74          2HG1      ILE  74   8.121  -8.692   2.377
  555   1HG2  ILE  74          1HG2      ILE  74   8.040  -4.882   2.371
  556   2HG2  ILE  74          2HG2      ILE  74   8.613  -5.377   3.973
  557   3HG2  ILE  74          3HG2      ILE  74   6.946  -4.801   3.747
  558   1HD1  ILE  74          1HD1      ILE  74   8.025  -6.985   0.491
  559   2HD1  ILE  74          2HD1      ILE  74   9.532  -7.870   0.637
  560   3HD1  ILE  74          3HD1      ILE  74   9.447  -6.207   1.223
  561    HA   PRO  75           HA       PRO  75   4.373  -6.846   2.481
  562   1HB   PRO  75          2HB       PRO  75   1.697  -7.301   2.671
  563   2HB   PRO  75          1HB       PRO  75   2.738  -8.033   1.432
  564   1HG   PRO  75          1HG       PRO  75   1.898  -9.184   4.112
  565   2HG   PRO  75          2HG       PRO  75   1.745  -9.991   2.514
  566   1HD   PRO  75          1HD       PRO  75   3.848 -10.515   4.167
  567   2HD   PRO  75          2HD       PRO  75   4.115 -10.354   2.411
  568    H    THR  76           H        THR  76   3.554  -5.040   3.215
  569    HA   THR  76           HA       THR  76   2.384  -4.773   5.874
  570    HB   THR  76           HB       THR  76   4.966  -3.374   5.073
  571    HG1  THR  76           HG1      THR  76   5.610  -4.935   6.394
  572   1HG2  THR  76          1HG2      THR  76   2.898  -2.623   7.184
  573   2HG2  THR  76          2HG2      THR  76   3.556  -1.596   5.896
  574   3HG2  THR  76          3HG2      THR  76   4.588  -2.091   7.250
  575    H    ILE  77           H        ILE  77   0.586  -3.708   5.432
  576    HA   ILE  77           HA       ILE  77   0.424  -2.062   2.948
  577    HB   ILE  77           HB       ILE  77  -1.089  -3.862   2.825
  578   1HG1  ILE  77          1HG1      ILE  77  -1.921  -1.455   2.328
  579   2HG1  ILE  77          2HG1      ILE  77  -3.047  -2.807   2.358
  580   1HG2  ILE  77          1HG2      ILE  77  -2.019  -3.155   5.640
  581   2HG2  ILE  77          2HG2      ILE  77  -1.201  -4.647   5.122
  582   3HG2  ILE  77          3HG2      ILE  77  -2.823  -4.299   4.548
  583   1HD1  ILE  77          1HD1      ILE  77  -2.755  -0.834   4.665
  584   2HD1  ILE  77          2HD1      ILE  77  -3.907  -2.175   4.547
  585   3HD1  ILE  77          3HD1      ILE  77  -4.007  -0.827   3.423
  586    H    MET  78           H        MET  78  -0.125   0.098   3.157
  587    HA   MET  78           HA       MET  78  -0.849   1.075   5.867
  588   1HB   MET  78          2HB       MET  78   0.983   2.694   4.126
  589   2HB   MET  78          1HB       MET  78   0.557   2.921   5.814
  590   1HG   MET  78          2HG       MET  78   1.741   0.713   6.273
  591   2HG   MET  78          1HG       MET  78   2.344   0.787   4.629
  592   1HE   MET  78          1HE       MET  78   4.679   1.981   8.033
  593   2HE   MET  78          2HE       MET  78   2.946   1.707   8.297
  594   3HE   MET  78          3HE       MET  78   3.912   0.499   7.420
  595    H    VAL  79           H        VAL  79  -2.148   2.763   5.863
  596    HA   VAL  79           HA       VAL  79  -3.665   3.385   3.353
  597    HB   VAL  79           HB       VAL  79  -4.564   3.257   6.265
  598   1HG1  VAL  79          1HG1      VAL  79  -5.492   1.747   3.784
  599   2HG1  VAL  79          2HG1      VAL  79  -6.200   1.613   5.408
  600   3HG1  VAL  79          3HG1      VAL  79  -4.536   1.078   5.126
  601   1HG2  VAL  79          1HG2      VAL  79  -6.785   4.001   5.459
  602   2HG2  VAL  79          2HG2      VAL  79  -6.098   4.307   3.844
  603   3HG2  VAL  79          3HG2      VAL  79  -5.593   5.264   5.238
  604    H    PHE  80           H        PHE  80  -3.860   5.523   2.873
  605    HA   PHE  80           HA       PHE  80  -2.989   7.571   4.837
  606   1HB   PHE  80          1HB       PHE  80  -2.536   7.719   1.847
  607   2HB   PHE  80          2HB       PHE  80  -1.984   8.860   3.038
  608    HD1  PHE  80           HD1      PHE  80  -1.556   5.280   1.950
  609    HD2  PHE  80           HD2      PHE  80   0.272   8.684   3.857
  610    HE1  PHE  80           HE1      PHE  80   0.465   3.974   2.355
  611    HE2  PHE  80           HE2      PHE  80   2.360   7.403   4.132
  612    HZ   PHE  80           HZ       PHE  80   2.457   5.010   3.452
  613    H    LYS  81           HN       LYS  81  -4.491   9.181   4.967
  614    HA   LYS  81           HA       LYS  81  -7.042   8.693   3.460
  615   1HB   LYS  81          2HB       LYS  81  -8.211   9.638   5.233
  616   2HB   LYS  81          1HB       LYS  81  -7.042   8.545   5.960
  617   1HG   LYS  81          2HG       LYS  81  -6.970  11.598   5.902
  618   2HG   LYS  81          1HG       LYS  81  -7.260  10.536   7.280
  619   1HD   LYS  81          2HD       LYS  81  -4.891   9.593   6.859
  620   2HD   LYS  81          1HD       LYS  81  -4.635  11.003   5.825
  621   1HE   LYS  81          1HE       LYS  81  -5.382  11.091   8.770
  622   2HE   LYS  81          2HE       LYS  81  -3.780  11.390   8.080
  623   1HZ   LYS  81          1HZ       LYS  81  -4.698  13.242   6.880
  624   2HZ   LYS  81          2HZ       LYS  81  -4.931  13.421   8.501
  625   3HZ   LYS  81          3HZ       LYS  81  -6.189  12.980   7.534
  626    H    GLY  82           H        GLY  82  -4.506  11.035   3.904
  627   1HA   GLY  82          1HA       GLY  82  -5.581  12.733   1.865
  628   2HA   GLY  82          2HA       GLY  82  -5.645  13.494   3.470
  629    H    GLY  83           H        GLY  83  -3.481  11.665   1.296
  630   1HA   GLY  83          1HA       GLY  83  -1.290  11.897   0.789
  631   2HA   GLY  83          2HA       GLY  83  -1.210  13.420   1.659
  632    H    LYS  84           HN       LYS  84  -1.726  12.844   4.190
  633    HA   LYS  84           HA       LYS  84   0.576  11.263   5.074
  634   1HB   LYS  84          2HB       LYS  84  -1.549  12.664   6.730
  635   2HB   LYS  84          1HB       LYS  84   0.009  12.090   7.306
  636   1HG   LYS  84          2HG       LYS  84  -0.489  14.359   5.328
  637   2HG   LYS  84          1HG       LYS  84   0.086  14.507   6.979
  638   1HD   LYS  84          1HD       LYS  84   1.585  13.260   4.619
  639   2HD   LYS  84          2HD       LYS  84   1.921  14.804   5.385
  640   1HE   LYS  84          1HE       LYS  84   2.265  12.061   6.687
  641   2HE   LYS  84          2HE       LYS  84   3.542  13.132   6.105
  642   1HZ   LYS  84          1HZ       LYS  84   2.853  14.748   7.725
  643   2HZ   LYS  84          2HZ       LYS  84   3.264  13.324   8.445
  644   3HZ   LYS  84          3HZ       LYS  84   1.678  13.737   8.286
  645    H    LYS  85           HN       LYS  85   0.434   9.730   6.749
  646    HA   LYS  85           HA       LYS  85  -1.093   7.470   5.949
  647   1HB   LYS  85          2HB       LYS  85   1.293   7.757   7.100
  648   2HB   LYS  85          1HB       LYS  85   0.352   7.611   8.583
  649   1HG   LYS  85          2HG       LYS  85  -0.601   5.403   7.379
  650   2HG   LYS  85          1HG       LYS  85   0.747   5.660   6.286
  651   1HD   LYS  85          1HD       LYS  85   1.802   4.304   7.789
  652   2HD   LYS  85          2HD       LYS  85   2.103   5.821   8.639
  653   1HE   LYS  85          1HE       LYS  85  -0.147   3.808   9.145
  654   2HE   LYS  85          2HE       LYS  85   1.255   4.098  10.186
  655   1HZ   LYS  85          1HZ       LYS  85  -0.721   5.171  10.994
  656   2HZ   LYS  85          2HZ       LYS  85  -0.873   6.038   9.607
  657   3HZ   LYS  85          3HZ       LYS  85   0.418   6.294  10.596
  658    H    CYS  86           H        CYS  86  -2.466   6.171   7.314
  659    HA   CYS  86           HA       CYS  86  -3.969   7.587   9.479
  660   1HB   CYS  86          1HB       CYS  86  -5.226   7.450   7.281
  661   2HB   CYS  86          2HB       CYS  86  -5.161   5.695   7.400
  662    HG   CYS  86           HG       CYS  86  -6.218   7.738   9.762
  663    H    GLU  87           HN       GLU  87  -3.681   4.332   7.973
  664    HA   GLU  87           HA       GLU  87  -3.010   3.118  10.599
  665   1HB   GLU  87          1HB       GLU  87  -5.233   2.143   8.744
  666   2HB   GLU  87          2HB       GLU  87  -4.706   1.346  10.230
  667   1HG   GLU  87          1HG       GLU  87  -6.080   4.060  10.030
  668   2HG   GLU  87          2HG       GLU  87  -6.796   2.575  10.590
  669    H    THR  88           H        THR  88  -2.487   0.660  10.197
  670    HA   THR  88           HA       THR  88  -1.579  -0.045   7.584
  671    HB   THR  88           HB       THR  88   0.312   1.404   8.123
  672    HG1  THR  88           HG1      THR  88   0.788  -0.796   7.395
  673   1HG2  THR  88          1HG2      THR  88   0.480  -0.054  10.806
  674   2HG2  THR  88          2HG2      THR  88   1.648   1.128  10.204
  675   3HG2  THR  88          3HG2      THR  88  -0.003   1.639  10.575
  676    H    ILE  89           H        ILE  89  -0.778  -2.270   7.531
  677    HA   ILE  89           HA       ILE  89  -1.056  -3.834  10.018
  678    HB   ILE  89           HB       ILE  89  -2.497  -4.513   7.413
  679   1HG1  ILE  89          1HG1      ILE  89  -3.766  -2.920   8.828
  680   2HG1  ILE  89          2HG1      ILE  89  -4.522  -4.499   8.649
  681   1HG2  ILE  89          1HG2      ILE  89  -3.290  -6.540   8.708
  682   2HG2  ILE  89          2HG2      ILE  89  -2.048  -6.178   9.922
  683   3HG2  ILE  89          3HG2      ILE  89  -1.587  -6.571   8.254
  684   1HD1  ILE  89          1HD1      ILE  89  -4.725  -3.595  10.946
  685   2HD1  ILE  89          2HD1      ILE  89  -3.902  -5.158  10.906
  686   3HD1  ILE  89          3HD1      ILE  89  -2.974  -3.663  11.140
  687    H    ILE  90           H        ILE  90   0.229  -5.678   9.947
  688    HA   ILE  90           HA       ILE  90   2.342  -5.798   7.835
  689    HB   ILE  90           HB       ILE  90   2.645  -5.934  10.880
  690   1HG1  ILE  90          1HG1      ILE  90   3.725  -3.861   8.930
  691   2HG1  ILE  90          2HG1      ILE  90   2.348  -3.611  10.008
  692   1HG2  ILE  90          1HG2      ILE  90   5.087  -6.152  10.419
  693   2HG2  ILE  90          2HG2      ILE  90   4.748  -6.223   8.681
  694   3HG2  ILE  90          3HG2      ILE  90   4.193  -7.506   9.770
  695   1HD1  ILE  90          1HD1      ILE  90   4.210  -2.581  11.032
  696   2HD1  ILE  90          2HD1      ILE  90   3.873  -4.052  11.964
  697   3HD1  ILE  90          3HD1      ILE  90   5.243  -3.997  10.825
  698    H    GLY  91           H        GLY  91   2.846  -7.865   7.214
  699   1HA   GLY  91          1HA       GLY  91   3.303 -10.145   7.879
  700   2HA   GLY  91          2HA       GLY  91   1.862 -10.160   8.898
  701    H    ALA  92           H        ALA  92   2.471 -12.044   6.882
  702    HA   ALA  92           HA       ALA  92   1.053 -11.529   4.426
  703   1HB   ALA  92          1HB       ALA  92   2.980 -13.068   4.630
  704   2HB   ALA  92          2HB       ALA  92   1.537 -13.907   4.018
  705   3HB   ALA  92          3HB       ALA  92   2.034 -14.117   5.708
  706    H    VAL  93           H        VAL  93  -0.860 -10.787   6.158
  707    HA   VAL  93           HA       VAL  93  -2.666 -13.062   6.710
  708    HB   VAL  93           HB       VAL  93  -4.237 -11.389   7.497
  709   1HG1  VAL  93          1HG2      VAL  93  -2.131  -9.289   6.809
  710   2HG1  VAL  93          2HG2      VAL  93  -3.622  -9.030   7.730
  711   3HG1  VAL  93          3HG2      VAL  93  -3.714  -9.493   6.026
  712   1HG2  VAL  93          1HG1      VAL  93  -2.509 -12.316   9.019
  713   2HG2  VAL  93          2HG1      VAL  93  -1.442 -10.947   8.637
  714   3HG2  VAL  93          3HG1      VAL  93  -2.985 -10.668   9.465
  715    HA   PRO  94           HA       PRO  94  -4.240 -13.021   2.589
  716   1HB   PRO  94          2HB       PRO  94  -7.021 -13.224   3.675
  717   2HB   PRO  94          1HB       PRO  94  -6.239 -14.248   2.448
  718   1HG   PRO  94          1HG       PRO  94  -6.542 -15.165   5.009
  719   2HG   PRO  94          2HG       PRO  94  -5.048 -15.486   4.081
  720   1HD   PRO  94          2HD       PRO  94  -5.478 -13.437   6.250
  721   2HD   PRO  94          1HD       PRO  94  -4.076 -14.482   5.912
  722    H    LYS  95           HN       LYS  95  -5.151 -11.581   1.095
  723    HA   LYS  95           HA       LYS  95  -5.332  -8.909   1.869
  724   1HB   LYS  95          2HB       LYS  95  -4.751  -9.736  -0.424
  725   2HB   LYS  95          1HB       LYS  95  -6.444 -10.179  -0.668
  726   1HG   LYS  95          2HG       LYS  95  -5.995  -8.066  -1.747
  727   2HG   LYS  95          1HG       LYS  95  -7.086  -7.781  -0.397
  728   1HD   LYS  95          1HD       LYS  95  -5.028  -6.971   0.908
  729   2HD   LYS  95          2HD       LYS  95  -4.087  -7.208  -0.570
  730   1HE   LYS  95          1HE       LYS  95  -5.602  -5.601  -1.748
  731   2HE   LYS  95          2HE       LYS  95  -6.541  -5.400  -0.260
  732   1HZ   LYS  95          1HZ       LYS  95  -4.967  -3.651  -0.560
  733   2HZ   LYS  95          2HZ       LYS  95  -3.707  -4.712  -0.569
  734   3HZ   LYS  95          3HZ       LYS  95  -4.610  -4.516   0.794
  735    H    ALA  96           H        ALA  96  -7.921 -11.342   1.450
  736    HA   ALA  96           HA       ALA  96 -10.195  -9.730   1.642
  737   1HB   ALA  96          1HB       ALA  96 -10.260 -12.184   1.395
  738   2HB   ALA  96          2HB       ALA  96  -9.674 -12.383   3.062
  739   3HB   ALA  96          3HB       ALA  96 -11.267 -11.659   2.759
  740    H    THR  97           H        THR  97  -8.076 -10.841   4.339
  741    HA   THR  97           HA       THR  97  -9.526  -9.731   6.484
  742    HB   THR  97           HB       THR  97  -6.502  -9.812   6.564
  743    HG1  THR  97           HG1      THR  97  -6.643 -11.544   5.391
  744   1HG2  THR  97          1HG2      THR  97  -8.659 -11.101   8.295
  745   2HG2  THR  97          2HG2      THR  97  -7.877  -9.534   8.628
  746   3HG2  THR  97          3HG2      THR  97  -6.920 -11.031   8.642
  747    H    ILE  98           H        ILE  98  -6.862  -8.488   4.469
  748    HA   ILE  98           HA       ILE  98  -6.569  -5.947   5.744
  749    HB   ILE  98           HB       ILE  98  -5.951  -6.893   2.903
  750   1HG1  ILE  98          1HG1      ILE  98  -4.625  -8.143   4.386
  751   2HG1  ILE  98          2HG1      ILE  98  -3.597  -6.875   3.735
  752   1HG2  ILE  98          1HG2      ILE  98  -6.128  -4.485   2.809
  753   2HG2  ILE  98          2HG2      ILE  98  -4.414  -4.890   2.860
  754   3HG2  ILE  98          3HG2      ILE  98  -5.230  -4.296   4.324
  755   1HD1  ILE  98          1HD1      ILE  98  -4.122  -5.559   5.922
  756   2HD1  ILE  98          2HD1      ILE  98  -3.066  -6.975   6.034
  757   3HD1  ILE  98          3HD1      ILE  98  -4.762  -7.096   6.531
  758    H    VAL  99           H        VAL  99  -8.535  -6.932   2.904
  759    HA   VAL  99           HA       VAL  99  -9.629  -4.430   2.249
  760    HB   VAL  99           HB       VAL  99 -10.677  -7.279   2.032
  761   1HG1  VAL  99          1HG1      VAL  99 -12.702  -5.990   2.105
  762   2HG1  VAL  99          2HG1      VAL  99 -12.364  -6.321   0.405
  763   3HG1  VAL  99          3HG1      VAL  99 -11.993  -4.719   1.085
  764   1HG2  VAL  99          1HG2      VAL  99  -8.690  -6.464   0.650
  765   2HG2  VAL  99          2HG2      VAL  99  -9.801  -5.319  -0.116
  766   3HG2  VAL  99          3HG2      VAL  99 -10.082  -7.075  -0.257
  767    H    GLN 100           H        GLN 100 -10.947  -6.956   4.481
  768    HA   GLN 100           HA       GLN 100 -13.169  -5.454   5.322
  769   1HB   GLN 100          1HB       GLN 100 -12.441  -7.895   5.810
  770   2HB   GLN 100          2HB       GLN 100 -11.593  -7.275   7.213
  771   1HG   GLN 100          2HG       GLN 100 -14.529  -6.589   6.743
  772   2HG   GLN 100          1HG       GLN 100 -14.073  -8.189   7.324
  773   1HE2  GLN 100          1HE2      GLN 100 -13.482  -4.677   8.180
  774   2HE2  GLN 100          2HE2      GLN 100 -13.426  -5.057   9.890
  775    H    THR 101           H        THR 101  -9.885  -5.595   6.682
  776    HA   THR 101           HA       THR 101 -10.281  -3.740   8.802
  777    HB   THR 101           HB       THR 101  -7.688  -4.329   7.298
  778    HG1  THR 101           HG1      THR 101  -8.635  -6.250   7.998
  779   1HG2  THR 101          1HG2      THR 101  -7.421  -2.479   8.845
  780   2HG2  THR 101          2HG2      THR 101  -8.275  -3.362  10.132
  781   3HG2  THR 101          3HG2      THR 101  -6.694  -3.925   9.559
  782    H    VAL 102           H        VAL 102  -9.427  -3.175   5.371
  783    HA   VAL 102           HA       VAL 102  -8.870  -0.358   5.709
  784    HB   VAL 102           HB       VAL 102  -9.472  -2.130   3.314
  785   1HG1  VAL 102          1HG1      VAL 102  -6.931  -0.633   4.097
  786   2HG1  VAL 102          2HG1      VAL 102  -7.122  -1.879   2.845
  787   3HG1  VAL 102          3HG1      VAL 102  -7.227  -2.310   4.557
  788   1HG2  VAL 102          1HG2      VAL 102  -8.749  -0.244   1.883
  789   2HG2  VAL 102          2HG2      VAL 102  -8.723   0.819   3.303
  790   3HG2  VAL 102          3HG2      VAL 102 -10.259   0.136   2.717
  791    H    GLU 103           HN       GLU 103 -11.688  -2.176   4.478
  792    HA   GLU 103           HA       GLU 103 -13.429  -0.011   4.026
  793   1HB   GLU 103          2HB       GLU 103 -13.931  -2.904   4.851
  794   2HB   GLU 103          1HB       GLU 103 -15.216  -1.775   4.403
  795   1HG   GLU 103          1HG       GLU 103 -14.223  -1.419   2.193
  796   2HG   GLU 103          2HG       GLU 103 -12.892  -2.517   2.565
  797    H    LYS 104           HN       LYS 104 -12.862  -1.878   6.994
  798    HA   LYS 104           HA       LYS 104 -14.736  -0.744   8.735
  799   1HB   LYS 104          1HB       LYS 104 -13.232  -2.548   9.398
  800   2HB   LYS 104          2HB       LYS 104 -11.836  -1.511   9.131
  801   1HG   LYS 104          2HG       LYS 104 -12.766  -0.015  11.044
  802   2HG   LYS 104          1HG       LYS 104 -13.787  -1.418  11.415
  803   1HD   LYS 104          2HD       LYS 104 -11.596  -2.786  11.375
  804   2HD   LYS 104          1HD       LYS 104 -10.736  -1.253  11.215
  805   1HE   LYS 104          2HE       LYS 104 -12.541  -2.080  13.548
  806   2HE   LYS 104          1HE       LYS 104 -10.772  -2.008  13.571
  807   1HZ   LYS 104          1HZ       LYS 104 -12.585   0.273  13.200
  808   2HZ   LYS 104          2HZ       LYS 104 -10.940   0.355  13.167
  809   3HZ   LYS 104          3HZ       LYS 104 -11.717  -0.076  14.555
  810    H    TYR 105           H        TYR 105 -11.556   0.609   7.713
  811    HA   TYR 105           HA       TYR 105 -11.863   2.974   9.432
  812   1HB   TYR 105          2HB       TYR 105  -9.899   2.327   7.232
  813   2HB   TYR 105          1HB       TYR 105  -9.734   3.646   8.397
  814    HD1  TYR 105           HD1      TYR 105 -10.391   2.016  10.944
  815    HD2  TYR 105           HD2      TYR 105  -7.905   1.204   7.509
  816    HE1  TYR 105           HE1      TYR 105  -8.962   0.535  12.315
  817    HE2  TYR 105           HE2      TYR 105  -6.498  -0.289   8.885
  818    HH   TYR 105           HH       TYR 105  -7.102  -0.837  12.356
  819    H    LEU 106           H        LEU 106 -11.757   2.336   5.886
  820    HA   LEU 106           HA       LEU 106 -12.894   5.013   5.291
  821   1HB   LEU 106          2HB       LEU 106 -11.915   2.736   3.520
  822   2HB   LEU 106          1HB       LEU 106 -12.678   4.218   2.937
  823    HG   LEU 106           HG       LEU 106 -10.708   5.179   4.712
  824   1HD1  LEU 106          1HD1      LEU 106 -10.671   4.889   1.686
  825   2HD1  LEU 106          2HD1      LEU 106  -9.657   6.000   2.644
  826   3HD1  LEU 106          3HD1      LEU 106 -11.420   6.206   2.617
  827   1HD2  LEU 106          1HD2      LEU 106  -8.644   4.127   3.951
  828   2HD2  LEU 106          2HD2      LEU 106  -9.683   2.927   4.749
  829   3HD2  LEU 106          3HD2      LEU 106  -9.567   2.967   2.971
  830    H    ASN 107           H        ASN 107 -14.600   4.300   6.662
  831    HA   ASN 107           HA       ASN 107 -16.731   2.644   5.364
  832   1HB   ASN 107          1HB       ASN 107 -16.001   2.402   7.840
  833   2HB   ASN 107          2HB       ASN 107 -16.861   3.919   8.117
  834   1HD2  ASN 107          2HD2      ASN 107 -19.099   3.388   6.264
  835   2HD2  ASN 107          1HD2      ASN 107 -20.027   2.075   7.003
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1  -3.290  -3.281 -11.534
    2   2H    MET   1          2H        MET   1  -2.938  -3.446 -13.129
    3   3H    MET   1          3H        MET   1  -2.219  -2.241 -12.240
    4    HA   MET   1           HA       MET   1  -3.951  -1.461 -13.721
    5   1HB   MET   1          2HB       MET   1  -5.449  -3.430 -13.348
    6   2HB   MET   1          1HB       MET   1  -5.761  -2.903 -11.698
    7   1HG   MET   1          1HG       MET   1  -7.584  -2.235 -13.171
    8   2HG   MET   1          2HG       MET   1  -6.761  -0.781 -12.624
    9   1HE   MET   1          1HE       MET   1  -7.566   0.903 -14.373
   10   2HE   MET   1          2HE       MET   1  -8.721  -0.384 -14.808
   11   3HE   MET   1          3HE       MET   1  -7.813   0.468 -16.079
   12    H    GLU   2           HN       GLU   2  -5.615  -1.235 -10.611
   13    HA   GLU   2           HA       GLU   2  -4.886   1.539 -10.407
   14   1HB   GLU   2          1HB       GLU   2  -6.119  -0.350  -8.358
   15   2HB   GLU   2          2HB       GLU   2  -6.083   1.418  -8.246
   16   1HG   GLU   2          2HG       GLU   2  -7.596  -0.246 -10.315
   17   2HG   GLU   2          1HG       GLU   2  -8.270   0.684  -8.974
   18    H    ALA   3           H        ALA   3  -3.788  -1.421  -8.810
   19    HA   ALA   3           HA       ALA   3  -2.017  -0.234  -6.924
   20   1HB   ALA   3          1HB       ALA   3  -1.868  -2.951  -8.276
   21   2HB   ALA   3          2HB       ALA   3  -2.765  -2.555  -6.792
   22   3HB   ALA   3          3HB       ALA   3  -0.999  -2.453  -6.809
   23    H    GLY   4           H        GLY   4  -0.850   1.454  -7.915
   24   1HA   GLY   4          1HA       GLY   4   0.885   0.995 -10.219
   25   2HA   GLY   4          2HA       GLY   4   0.877   2.402  -9.142
   26    H    ALA   5           H        ALA   5   3.346   1.857  -9.727
   27    HA   ALA   5           HA       ALA   5   4.481   0.218  -7.500
   28   1HB   ALA   5          1HB       ALA   5   5.597   0.637 -10.300
   29   2HB   ALA   5          2HB       ALA   5   4.908  -0.874  -9.662
   30   3HB   ALA   5          3HB       ALA   5   6.402  -0.215  -8.965
   31    H    VAL   6           H        VAL   6   5.982   1.362  -6.230
   32    HA   VAL   6           HA       VAL   6   6.888   4.003  -7.209
   33    HB   VAL   6           HB       VAL   6   6.374   4.920  -4.844
   34   1HG1  VAL   6          1HG1      VAL   6   5.709   2.910  -3.688
   35   2HG1  VAL   6          2HG1      VAL   6   4.358   4.034  -3.748
   36   3HG1  VAL   6          3HG1      VAL   6   4.374   2.621  -4.817
   37   1HG2  VAL   6          1HG2      VAL   6   4.135   5.624  -5.476
   38   2HG2  VAL   6          2HG2      VAL   6   5.303   5.788  -6.791
   39   3HG2  VAL   6          3HG2      VAL   6   4.141   4.454  -6.820
   40    H    ASN   7           H        ASN   7   8.385   5.025  -5.791
   41    HA   ASN   7           HA       ASN   7  10.125   3.416  -4.096
   42   1HB   ASN   7          2HB       ASN   7  11.256   2.958  -6.183
   43   2HB   ASN   7          1HB       ASN   7  10.855   4.576  -6.801
   44   1HD2  ASN   7          1HD2      ASN   7  13.137   2.822  -4.709
   45   2HD2  ASN   7          2HD2      ASN   7  14.286   4.127  -4.645
   46    H    ASP   8           HN       ASP   8  11.782   5.023  -3.305
   47    HA   ASP   8           HA       ASP   8  10.928   7.112  -1.839
   48   1HB   ASP   8          2HB       ASP   8  13.258   6.240  -1.932
   49   2HB   ASP   8          1HB       ASP   8  13.531   7.064  -3.453
   50    H    ASP   9           HN       ASP   9  12.138   7.480  -5.131
   51    HA   ASP   9           HA       ASP   9  11.733  10.277  -5.451
   52   1HB   ASP   9          2HB       ASP   9  13.050   8.973  -7.017
   53   2HB   ASP   9          1HB       ASP   9  11.658   8.025  -7.516
   54    H    THR  10           H        THR  10   9.682   7.796  -6.994
   55    HA   THR  10           HA       THR  10   7.602   9.562  -7.722
   56    HB   THR  10           HB       THR  10   6.385   7.320  -8.062
   57    HG1  THR  10           HG1      THR  10   7.997   5.563  -7.975
   58   1HG2  THR  10          1HG2      THR  10   7.698   8.459  -9.831
   59   2HG2  THR  10          2HG2      THR  10   9.168   7.638  -9.274
   60   3HG2  THR  10          3HG2      THR  10   7.824   6.697  -9.950
   61    H    PHE  11           H        PHE  11   8.051   7.657  -4.808
   62    HA   PHE  11           HA       PHE  11   5.645   7.526  -3.554
   63   1HB   PHE  11          2HB       PHE  11   7.918   6.870  -2.679
   64   2HB   PHE  11          1HB       PHE  11   8.212   8.538  -2.258
   65    HD1  PHE  11           HD1      PHE  11   7.798   9.142  -0.020
   66    HD2  PHE  11           HD2      PHE  11   5.775   5.736  -1.714
   67    HE1  PHE  11           HE1      PHE  11   7.001   8.492   2.229
   68    HE2  PHE  11           HE2      PHE  11   4.878   5.157   0.526
   69    HZ   PHE  11           HZ       PHE  11   5.487   6.535   2.502
   70    H    LYS  12           HN       LYS  12   7.736  10.301  -3.767
   71    HA   LYS  12           HA       LYS  12   6.366  12.132  -2.091
   72   1HB   LYS  12          2HB       LYS  12   7.928  12.773  -4.631
   73   2HB   LYS  12          1HB       LYS  12   7.505  13.908  -3.339
   74   1HG   LYS  12          1HG       LYS  12   8.798  12.435  -1.719
   75   2HG   LYS  12          2HG       LYS  12   9.292  11.452  -3.103
   76   1HD   LYS  12          2HD       LYS  12  10.301  13.502  -4.161
   77   2HD   LYS  12          1HD       LYS  12   9.912  14.403  -2.683
   78   1HE   LYS  12          1HE       LYS  12  12.229  13.687  -2.548
   79   2HE   LYS  12          2HE       LYS  12  11.302  12.739  -1.373
   80   1HZ   LYS  12          1HZ       LYS  12  12.790  11.355  -2.625
   81   2HZ   LYS  12          2HZ       LYS  12  12.138  11.860  -4.050
   82   3HZ   LYS  12          3HZ       LYS  12  11.248  10.953  -3.004
   83    H    ASN  13           H        ASN  13   6.031  11.695  -5.636
   84    HA   ASN  13           HA       ASN  13   3.873  13.628  -5.863
   85   1HB   ASN  13          1HB       ASN  13   4.873  11.473  -7.770
   86   2HB   ASN  13          2HB       ASN  13   3.794  12.800  -8.174
   87   1HD2  ASN  13          2HD2      ASN  13   5.631  14.671  -6.319
   88   2HD2  ASN  13          1HD2      ASN  13   6.942  14.976  -7.439
   89    H    VAL  14           H        VAL  14   4.110  10.089  -5.885
   90    HA   VAL  14           HA       VAL  14   1.264   9.748  -6.436
   91    HB   VAL  14           HB       VAL  14   3.617   7.859  -5.963
   92   1HG1  VAL  14          1HG1      VAL  14   3.846   9.223  -8.019
   93   2HG1  VAL  14          2HG1      VAL  14   3.525   7.537  -8.421
   94   3HG1  VAL  14          3HG1      VAL  14   2.218   8.733  -8.528
   95   1HG2  VAL  14          1HG2      VAL  14   2.200   6.132  -7.110
   96   2HG2  VAL  14          2HG2      VAL  14   1.658   6.550  -5.482
   97   3HG2  VAL  14          3HG2      VAL  14   0.802   7.206  -6.901
   98    H    VAL  15           H        VAL  15   3.136   9.834  -3.462
   99    HA   VAL  15           HA       VAL  15   0.773   8.665  -2.023
  100    HB   VAL  15           HB       VAL  15   3.667   8.396  -1.150
  101   1HG1  VAL  15          1HG1      VAL  15   1.125   6.914  -0.381
  102   2HG1  VAL  15          2HG1      VAL  15   1.929   8.176   0.581
  103   3HG1  VAL  15          3HG1      VAL  15   2.750   6.643   0.278
  104   1HG2  VAL  15          1HG2      VAL  15   1.994   6.471  -2.807
  105   2HG2  VAL  15          2HG2      VAL  15   3.496   6.039  -1.973
  106   3HG2  VAL  15          3HG2      VAL  15   3.521   7.220  -3.285
  107    H    LEU  16           H        LEU  16   3.643  10.836  -1.592
  108    HA   LEU  16           HA       LEU  16   2.534  11.895   0.867
  109   1HB   LEU  16          1HB       LEU  16   4.660  13.164  -0.893
  110   2HB   LEU  16          2HB       LEU  16   4.275  13.563   0.768
  111    HG   LEU  16           HG       LEU  16   5.467  10.928  -0.211
  112   1HD1  LEU  16          1HD1      LEU  16   6.586  13.107   1.613
  113   2HD1  LEU  16          2HD1      LEU  16   6.985  12.964  -0.104
  114   3HD1  LEU  16          3HD1      LEU  16   7.441  11.668   1.020
  115   1HD2  LEU  16          1HD2      LEU  16   5.711  10.435   2.244
  116   2HD2  LEU  16          2HD2      LEU  16   4.703  11.845   2.585
  117   3HD2  LEU  16          3HD2      LEU  16   4.024  10.438   1.719
  118    H    GLU  17           HN       GLU  17   2.791  13.348  -2.416
  119    HA   GLU  17           HA       GLU  17   1.275  15.698  -1.623
  120   1HB   GLU  17          1HB       GLU  17   2.184  14.622  -4.320
  121   2HB   GLU  17          2HB       GLU  17   1.459  16.216  -4.073
  122   1HG   GLU  17          1HG       GLU  17   3.283  16.938  -2.656
  123   2HG   GLU  17          2HG       GLU  17   4.007  15.329  -2.636
  124    H    SER  18           H        SER  18   0.213  12.532  -2.526
  125    HA   SER  18           HA       SER  18  -1.923  12.926  -4.155
  126   1HB   SER  18          1HB       SER  18  -1.860  11.018  -1.790
  127   2HB   SER  18          2HB       SER  18  -2.594  10.770  -3.399
  128    HG   SER  18           HG       SER  18  -0.581   9.842  -3.566
  129    H    SER  19           H        SER  19  -4.035  13.640  -3.972
  130    HA   SER  19           HA       SER  19  -4.906  15.081  -1.609
  131   1HB   SER  19          1HB       SER  19  -6.932  15.329  -3.217
  132   2HB   SER  19          2HB       SER  19  -5.383  16.032  -3.731
  133    HG   SER  19           HG       SER  19  -6.304  14.754  -5.405
  134    H    VAL  20           H        VAL  20  -6.288  12.475  -3.605
  135    HA   VAL  20           HA       VAL  20  -8.098  11.619  -1.475
  136    HB   VAL  20           HB       VAL  20  -8.947  10.049  -3.036
  137   1HG1  VAL  20          1HG2      VAL  20  -7.989   9.675  -5.285
  138   2HG1  VAL  20          2HG2      VAL  20  -6.904   9.102  -4.019
  139   3HG1  VAL  20          3HG2      VAL  20  -6.563  10.638  -4.847
  140   1HG2  VAL  20          1HG1      VAL  20  -8.287  12.565  -4.602
  141   2HG2  VAL  20          2HG1      VAL  20  -9.554  12.424  -3.362
  142   3HG2  VAL  20          3HG1      VAL  20  -9.650  11.460  -4.846
  143    HA   PRO  21           HA       PRO  21  -5.620   8.724   0.612
  144   1HB   PRO  21          1HB       PRO  21  -7.755   6.644   0.081
  145   2HB   PRO  21          2HB       PRO  21  -6.871   6.958   1.610
  146   1HG   PRO  21          2HG       PRO  21  -9.321   7.922   1.254
  147   2HG   PRO  21          1HG       PRO  21  -8.076   9.029   1.905
  148   1HD   PRO  21          1HD       PRO  21  -9.120   8.885  -0.949
  149   2HD   PRO  21          2HD       PRO  21  -8.760  10.302   0.079
  150    H    VAL  22           H        VAL  22  -4.351   6.863   0.508
  151    HA   VAL  22           HA       VAL  22  -3.949   5.579  -2.159
  152    HB   VAL  22           HB       VAL  22  -1.825   7.025  -0.519
  153   1HG1  VAL  22          1HG1      VAL  22  -1.680   5.553  -3.172
  154   2HG1  VAL  22          2HG1      VAL  22  -0.865   5.096  -1.653
  155   3HG1  VAL  22          3HG1      VAL  22  -0.384   6.564  -2.508
  156   1HG2  VAL  22          1HG2      VAL  22  -1.655   8.508  -2.495
  157   2HG2  VAL  22          2HG2      VAL  22  -3.138   7.795  -3.147
  158   3HG2  VAL  22          3HG2      VAL  22  -3.167   8.694  -1.613
  159    H    LEU  23           H        LEU  23  -3.909   3.404  -1.817
  160    HA   LEU  23           HA       LEU  23  -3.096   2.289   0.795
  161   1HB   LEU  23          2HB       LEU  23  -5.188   1.702  -0.489
  162   2HB   LEU  23          1HB       LEU  23  -4.230   0.896  -1.689
  163    HG   LEU  23           HG       LEU  23  -3.779   0.163   1.212
  164   1HD1  LEU  23          1HD2      LEU  23  -3.875  -1.401  -1.415
  165   2HD1  LEU  23          2HD2      LEU  23  -3.570  -2.144   0.160
  166   3HD1  LEU  23          3HD2      LEU  23  -2.405  -0.995  -0.504
  167   1HD2  LEU  23          1HD1      LEU  23  -6.171  -0.762  -0.401
  168   2HD2  LEU  23          2HD1      LEU  23  -6.190   0.229   1.085
  169   3HD2  LEU  23          3HD1      LEU  23  -5.628  -1.449   1.150
  170    H    VAL  24           H        VAL  24  -0.796   2.435   0.785
  171    HA   VAL  24           HA       VAL  24   0.602   1.374  -1.667
  172    HB   VAL  24           HB       VAL  24   1.385   3.498  -1.330
  173   1HG1  VAL  24          1HG2      VAL  24   2.302   4.350   0.800
  174   2HG1  VAL  24          2HG2      VAL  24   0.553   4.086   0.821
  175   3HG1  VAL  24          3HG2      VAL  24   1.641   2.922   1.625
  176   1HG2  VAL  24          1HG1      VAL  24   3.721   3.211  -0.863
  177   2HG2  VAL  24          2HG1      VAL  24   3.429   1.744   0.085
  178   3HG2  VAL  24          3HG1      VAL  24   3.134   1.746  -1.670
  179    H    ASP  25           HN       ASP  25   1.394  -0.639  -1.579
  180    HA   ASP  25           HA       ASP  25   1.741  -1.959   1.068
  181   1HB   ASP  25          1HB       ASP  25   0.329  -3.167  -0.555
  182   2HB   ASP  25          2HB       ASP  25   1.658  -3.133  -1.724
  183    H    PHE  26           H        PHE  26   3.739  -2.088   1.898
  184    HA   PHE  26           HA       PHE  26   6.077  -1.437   0.197
  185   1HB   PHE  26          1HB       PHE  26   5.821  -2.253   3.107
  186   2HB   PHE  26          2HB       PHE  26   7.329  -1.931   2.258
  187    HD1  PHE  26           HD1      PHE  26   8.293   0.130   2.852
  188    HD2  PHE  26           HD2      PHE  26   3.988  -0.051   2.508
  189    HE1  PHE  26           HE1      PHE  26   8.066   2.198   4.203
  190    HE2  PHE  26           HE2      PHE  26   3.833   2.177   3.484
  191    HZ   PHE  26           HZ       PHE  26   5.820   3.167   4.604
  192    H    TRP  27           H        TRP  27   6.934  -3.032  -1.066
  193    HA   TRP  27           HA       TRP  27   6.666  -5.868  -0.175
  194   1HB   TRP  27          2HB       TRP  27   5.911  -6.541  -2.330
  195   2HB   TRP  27          1HB       TRP  27   4.870  -5.218  -1.844
  196    HD1  TRP  27           HD1      TRP  27   5.755  -2.762  -2.927
  197    HE1  TRP  27           HE1      TRP  27   6.904  -2.203  -5.189
  198    HE3  TRP  27           HE3      TRP  27   6.977  -7.501  -4.370
  199    HZ2  TRP  27           HZ2      TRP  27   8.434  -3.659  -7.167
  200    HZ3  TRP  27           HZ3      TRP  27   8.092  -7.877  -6.550
  201    HH2  TRP  27           HH2      TRP  27   8.841  -5.976  -7.937
  202    H    ALA  28           H        ALA  28   7.869  -7.137  -2.185
  203    HA   ALA  28           HA       ALA  28  10.079  -5.846  -3.383
  204   1HB   ALA  28          1HB       ALA  28  11.139  -5.988  -1.150
  205   2HB   ALA  28          2HB       ALA  28  10.749  -7.725  -1.071
  206   3HB   ALA  28          3HB       ALA  28  11.910  -7.122  -2.270
  207    HA   PRO  29           HA       PRO  29   9.273  -9.506  -5.870
  208   1HB   PRO  29          1HB       PRO  29  11.805 -10.160  -6.840
  209   2HB   PRO  29          2HB       PRO  29  10.697  -8.908  -7.489
  210   1HG   PRO  29          2HG       PRO  29  12.979  -8.517  -5.534
  211   2HG   PRO  29          1HG       PRO  29  12.628  -7.564  -7.008
  212   1HD   PRO  29          2HD       PRO  29  11.809  -6.584  -4.649
  213   2HD   PRO  29          1HD       PRO  29  10.662  -6.623  -5.981
  214    H    TRP  30           H        TRP  30  12.055  -9.866  -3.605
  215    HA   TRP  30           HA       TRP  30  11.771 -12.742  -3.496
  216   1HB   TRP  30          2HB       TRP  30  13.158 -12.530  -1.451
  217   2HB   TRP  30          1HB       TRP  30  13.844 -11.769  -2.878
  218    HD1  TRP  30           HD1      TRP  30  14.634  -9.377  -2.654
  219    HE1  TRP  30           HE1      TRP  30  14.578  -7.551  -0.862
  220    HE3  TRP  30           HE3      TRP  30  11.472 -11.630   0.703
  221    HZ2  TRP  30           HZ2      TRP  30  13.217  -7.064   1.635
  222    HZ3  TRP  30           HZ3      TRP  30  10.754 -10.421   2.731
  223    HH2  TRP  30           HH2      TRP  30  11.558  -8.121   3.179
  224    H    CYS  31           H        CYS  31   9.754 -10.212  -2.250
  225    HA   CYS  31           HA       CYS  31   8.982 -11.623   0.199
  226   1HB   CYS  31          1HB       CYS  31   8.979  -9.118   0.018
  227   2HB   CYS  31          2HB       CYS  31   7.679  -9.252  -1.143
  228    H    GLY  32           H        GLY  32   8.478 -13.651  -0.994
  229   1HA   GLY  32          1HA       GLY  32   6.429 -14.205  -2.726
  230   2HA   GLY  32          2HA       GLY  32   6.722 -15.192  -1.288
  231    HA   PRO  33           HA       PRO  33   3.066 -13.840   0.912
  232   1HB   PRO  33          1HB       PRO  33   4.843 -11.894   2.438
  233   2HB   PRO  33          2HB       PRO  33   3.465 -12.832   3.090
  234   1HG   PRO  33          2HG       PRO  33   5.941 -13.769   3.437
  235   2HG   PRO  33          1HG       PRO  33   4.675 -14.864   2.801
  236   1HD   PRO  33          1HD       PRO  33   6.834 -13.345   1.286
  237   2HD   PRO  33          2HD       PRO  33   6.336 -15.048   1.070
  238    H    CYS  34           H        CYS  34   5.085 -11.177  -0.305
  239    HA   CYS  34           HA       CYS  34   2.890  -9.210  -0.264
  240   1HB   CYS  34          2HB       CYS  34   5.532  -8.972  -1.696
  241   2HB   CYS  34          1HB       CYS  34   4.333  -7.742  -1.316
  242    H    ARG  35           HN       ARG  35   4.892 -10.956  -2.636
  243    HA   ARG  35           HA       ARG  35   3.761 -10.139  -5.014
  244   1HB   ARG  35          1HB       ARG  35   5.756 -11.577  -4.798
  245   2HB   ARG  35          2HB       ARG  35   4.790 -12.916  -4.234
  246   1HG   ARG  35          1HG       ARG  35   5.401 -13.208  -6.591
  247   2HG   ARG  35          2HG       ARG  35   3.662 -13.190  -6.333
  248   1HD   ARG  35          1HD       ARG  35   3.696 -10.708  -7.096
  249   2HD   ARG  35          2HD       ARG  35   5.392 -10.968  -7.494
  250    HE   ARG  35           HE       ARG  35   4.753 -12.168  -9.350
  251   1HH1  ARG  35          1HH1      ARG  35   1.904 -11.813  -7.217
  252   2HH1  ARG  35          2HH1      ARG  35   0.802 -12.422  -8.412
  253   1HH2  ARG  35          1HH2      ARG  35   3.279 -12.956 -10.881
  254   2HH2  ARG  35          2HH2      ARG  35   1.581 -13.077 -10.515
  255    H    ILE  36           H        ILE  36   2.835 -12.917  -3.044
  256    HA   ILE  36           HA       ILE  36   0.658 -13.682  -4.773
  257    HB   ILE  36           HB       ILE  36  -0.025 -15.249  -3.043
  258   1HG1  ILE  36          2HG1      ILE  36   1.822 -15.285  -1.049
  259   2HG1  ILE  36          1HG1      ILE  36   1.671 -13.541  -1.265
  260   1HG2  ILE  36          1HG2      ILE  36   2.021 -16.559  -3.034
  261   2HG2  ILE  36          2HG2      ILE  36   3.002 -15.130  -3.397
  262   3HG2  ILE  36          3HG2      ILE  36   1.840 -15.737  -4.589
  263   1HD1  ILE  36          1HD1      ILE  36  -0.579 -15.531  -0.715
  264   2HD1  ILE  36          2HD1      ILE  36  -0.828 -13.793  -0.968
  265   3HD1  ILE  36          3HD1      ILE  36   0.103 -14.365   0.431
  266    H    ILE  37           H        ILE  37   0.643 -11.171  -2.198
  267    HA   ILE  37           HA       ILE  37  -2.340 -11.201  -2.318
  268    HB   ILE  37           HB       ILE  37  -2.305  -9.401  -0.730
  269   1HG1  ILE  37          2HG1      ILE  37   0.702  -9.715  -0.536
  270   2HG1  ILE  37          1HG1      ILE  37  -0.085  -8.382  -1.398
  271   1HG2  ILE  37          1HG2      ILE  37  -0.536 -11.701   0.197
  272   2HG2  ILE  37          2HG2      ILE  37  -1.653 -10.737   1.184
  273   3HG2  ILE  37          3HG2      ILE  37  -2.289 -11.821  -0.051
  274   1HD1  ILE  37          1HD1      ILE  37   0.522  -7.609   0.765
  275   2HD1  ILE  37          2HD1      ILE  37  -1.247  -7.755   0.718
  276   3HD1  ILE  37          3HD1      ILE  37  -0.268  -8.977   1.569
  277    H    ALA  38           H        ALA  38   0.420  -9.420  -3.639
  278    HA   ALA  38           HA       ALA  38  -0.518  -7.084  -4.465
  279   1HB   ALA  38          1HB       ALA  38   0.849  -7.214  -6.461
  280   2HB   ALA  38          2HB       ALA  38   1.667  -8.022  -5.112
  281   3HB   ALA  38          3HB       ALA  38   0.895  -8.979  -6.392
  282    HA   PRO  39           HA       PRO  39  -3.171  -8.576  -8.212
  283   1HB   PRO  39          1HB       PRO  39  -4.166 -11.260  -7.348
  284   2HB   PRO  39          2HB       PRO  39  -3.624 -10.737  -8.964
  285   1HG   PRO  39          1HG       PRO  39  -2.077 -12.387  -7.430
  286   2HG   PRO  39          2HG       PRO  39  -1.332 -11.058  -8.376
  287   1HD   PRO  39          1HD       PRO  39  -2.170 -11.001  -5.457
  288   2HD   PRO  39          2HD       PRO  39  -0.575 -10.610  -6.147
  289    H    VAL  40           H        VAL  40  -3.833  -9.822  -4.973
  290    HA   VAL  40           HA       VAL  40  -6.685  -9.443  -4.902
  291    HB   VAL  40           HB       VAL  40  -4.699  -9.668  -2.594
  292   1HG1  VAL  40          1HG1      VAL  40  -6.863  -8.815  -1.945
  293   2HG1  VAL  40          2HG1      VAL  40  -7.660 -10.209  -2.722
  294   3HG1  VAL  40          3HG1      VAL  40  -6.555 -10.440  -1.334
  295   1HG2  VAL  40          1HG2      VAL  40  -4.458 -11.643  -4.072
  296   2HG2  VAL  40          2HG2      VAL  40  -5.331 -12.072  -2.599
  297   3HG2  VAL  40          3HG2      VAL  40  -6.225 -11.829  -4.113
  298    H    VAL  41           H        VAL  41  -3.836  -7.681  -3.662
  299    HA   VAL  41           HA       VAL  41  -5.014  -5.375  -2.573
  300    HB   VAL  41           HB       VAL  41  -2.398  -5.762  -4.091
  301   1HG1  VAL  41          1HG1      VAL  41  -2.633  -7.129  -2.000
  302   2HG1  VAL  41          2HG1      VAL  41  -2.838  -5.624  -1.095
  303   3HG1  VAL  41          3HG1      VAL  41  -1.320  -5.958  -1.957
  304   1HG2  VAL  41          1HG2      VAL  41  -1.585  -3.710  -2.877
  305   2HG2  VAL  41          2HG2      VAL  41  -3.277  -3.357  -2.481
  306   3HG2  VAL  41          3HG2      VAL  41  -2.738  -3.440  -4.176
  307    H    ASP  42           HN       ASP  42  -4.018  -6.042  -5.948
  308    HA   ASP  42           HA       ASP  42  -4.803  -3.513  -6.953
  309   1HB   ASP  42          1HB       ASP  42  -3.329  -5.410  -7.879
  310   2HB   ASP  42          2HB       ASP  42  -4.760  -6.057  -8.639
  311    H    GLU  43           HN       GLU  43  -6.555  -6.705  -7.313
  312    HA   GLU  43           HA       GLU  43  -8.732  -5.490  -8.691
  313   1HB   GLU  43          1HB       GLU  43  -9.901  -7.510  -8.328
  314   2HB   GLU  43          2HB       GLU  43  -8.213  -7.927  -8.635
  315   1HG   GLU  43          1HG       GLU  43  -7.885  -8.178  -6.180
  316   2HG   GLU  43          2HG       GLU  43  -9.604  -7.852  -5.902
  317    H    ILE  44           H        ILE  44  -7.896  -5.720  -5.269
  318    HA   ILE  44           HA       ILE  44 -10.577  -4.937  -4.323
  319    HB   ILE  44           HB       ILE  44  -7.833  -4.961  -3.017
  320   1HG1  ILE  44          1HG1      ILE  44 -10.499  -6.371  -2.400
  321   2HG1  ILE  44          2HG1      ILE  44  -9.216  -7.052  -3.377
  322   1HG2  ILE  44          1HG2      ILE  44  -8.928  -4.243  -0.905
  323   2HG2  ILE  44          2HG2      ILE  44 -10.436  -3.980  -1.806
  324   3HG2  ILE  44          3HG2      ILE  44  -8.997  -2.971  -2.108
  325   1HD1  ILE  44          1HD1      ILE  44  -8.969  -7.971  -1.183
  326   2HD1  ILE  44          2HD1      ILE  44  -7.668  -6.767  -1.355
  327   3HD1  ILE  44          3HD1      ILE  44  -9.125  -6.393  -0.407
  328    H    ALA  45           H        ALA  45  -7.486  -3.183  -4.941
  329    HA   ALA  45           HA       ALA  45  -8.514  -0.578  -4.528
  330   1HB   ALA  45          1HB       ALA  45  -6.647   0.126  -5.950
  331   2HB   ALA  45          2HB       ALA  45  -6.169  -1.115  -4.751
  332   3HB   ALA  45          3HB       ALA  45  -6.367  -1.559  -6.455
  333    H    GLY  46           H        GLY  46  -8.748  -2.740  -7.347
  334   1HA   GLY  46          2HA       GLY  46  -9.889  -0.978  -9.248
  335   2HA   GLY  46          1HA       GLY  46 -10.161  -2.727  -9.147
  336    H    GLU  47           HN       GLU  47 -11.521  -3.231  -6.923
  337    HA   GLU  47           HA       GLU  47 -14.168  -2.404  -7.367
  338   1HB   GLU  47          1HB       GLU  47 -12.779  -3.387  -4.827
  339   2HB   GLU  47          2HB       GLU  47 -14.514  -3.181  -4.996
  340   1HG   GLU  47          1HG       GLU  47 -14.626  -4.850  -6.765
  341   2HG   GLU  47          2HG       GLU  47 -12.868  -5.010  -6.799
  342    H    TYR  48           H        TYR  48 -11.711  -1.061  -5.200
  343    HA   TYR  48           HA       TYR  48 -13.514   1.168  -4.358
  344   1HB   TYR  48          1HB       TYR  48 -10.705   0.451  -3.480
  345   2HB   TYR  48          2HB       TYR  48 -11.836   1.520  -2.647
  346    HD1  TYR  48           HD1      TYR  48 -10.284  -0.915  -1.506
  347    HD2  TYR  48           HD2      TYR  48 -14.278  -0.583  -3.121
  348    HE1  TYR  48           HE1      TYR  48 -11.116  -2.548   0.158
  349    HE2  TYR  48           HE2      TYR  48 -15.059  -2.272  -1.527
  350    HH   TYR  48           HH       TYR  48 -14.548  -3.279   0.521
  351    H    LYS  49           HN       LYS  49 -12.219   1.051  -7.158
  352    HA   LYS  49           HA       LYS  49 -10.164   2.932  -7.273
  353   1HB   LYS  49          2HB       LYS  49 -10.749   3.182  -9.658
  354   2HB   LYS  49          1HB       LYS  49 -10.712   1.526  -9.112
  355   1HG   LYS  49          2HG       LYS  49 -12.545   1.605 -10.520
  356   2HG   LYS  49          1HG       LYS  49 -13.301   1.655  -8.930
  357   1HD   LYS  49          2HD       LYS  49 -13.743   4.035  -9.137
  358   2HD   LYS  49          1HD       LYS  49 -12.722   4.153 -10.591
  359   1HE   LYS  49          2HE       LYS  49 -14.314   2.674 -11.800
  360   2HE   LYS  49          1HE       LYS  49 -15.311   2.552 -10.336
  361   1HZ   LYS  49          1HZ       LYS  49 -15.652   4.914 -10.454
  362   2HZ   LYS  49          2HZ       LYS  49 -14.723   5.025 -11.811
  363   3HZ   LYS  49          3HZ       LYS  49 -16.141   4.188 -11.849
  364    H    ASP  50           HN       ASP  50 -10.285   4.999  -8.432
  365    HA   ASP  50           HA       ASP  50 -10.826   7.196  -8.628
  366   1HB   ASP  50          2HB       ASP  50 -13.137   6.396  -9.196
  367   2HB   ASP  50          1HB       ASP  50 -13.610   6.580  -7.523
  368    H    LYS  51           HN       LYS  51 -12.297   5.872  -5.689
  369    HA   LYS  51           HA       LYS  51 -11.604   8.285  -4.142
  370   1HB   LYS  51          1HB       LYS  51 -12.395   5.584  -2.973
  371   2HB   LYS  51          2HB       LYS  51 -12.289   7.104  -2.164
  372   1HG   LYS  51          2HG       LYS  51 -14.576   6.816  -2.459
  373   2HG   LYS  51          1HG       LYS  51 -14.121   8.011  -3.674
  374   1HD   LYS  51          1HD       LYS  51 -15.765   6.401  -4.520
  375   2HD   LYS  51          2HD       LYS  51 -14.276   6.308  -5.436
  376   1HE   LYS  51          1HE       LYS  51 -13.636   4.249  -4.081
  377   2HE   LYS  51          2HE       LYS  51 -15.203   4.370  -3.257
  378   1HZ   LYS  51          1HZ       LYS  51 -14.686   3.962  -6.114
  379   2HZ   LYS  51          2HZ       LYS  51 -15.246   2.830  -5.056
  380   3HZ   LYS  51          3HZ       LYS  51 -16.200   4.115  -5.459
  381    H    LEU  52           H        LEU  52 -10.557   4.882  -4.107
  382    HA   LEU  52           HA       LEU  52  -8.259   5.590  -2.367
  383   1HB   LEU  52          1HB       LEU  52  -9.934   3.875  -1.670
  384   2HB   LEU  52          2HB       LEU  52  -9.502   2.914  -3.094
  385    HG   LEU  52           HG       LEU  52  -7.156   2.747  -2.198
  386   1HD1  LEU  52          1HD1      LEU  52  -8.462   4.197   0.138
  387   2HD1  LEU  52          2HD1      LEU  52  -6.987   4.654  -0.749
  388   3HD1  LEU  52          3HD1      LEU  52  -6.976   3.244   0.317
  389   1HD2  LEU  52          1HD2      LEU  52  -8.800   0.961  -1.876
  390   2HD2  LEU  52          2HD2      LEU  52  -7.789   1.113  -0.432
  391   3HD2  LEU  52          3HD2      LEU  52  -9.438   1.768  -0.424
  392    H    LYS  53           HN       LYS  53  -6.379   5.975  -3.401
  393    HA   LYS  53           HA       LYS  53  -5.758   4.739  -6.020
  394   1HB   LYS  53          2HB       LYS  53  -4.840   7.031  -4.528
  395   2HB   LYS  53          1HB       LYS  53  -3.479   5.928  -4.680
  396   1HG   LYS  53          1HG       LYS  53  -5.160   6.933  -7.011
  397   2HG   LYS  53          2HG       LYS  53  -3.605   7.591  -6.484
  398   1HD   LYS  53          2HD       LYS  53  -2.555   5.306  -6.886
  399   2HD   LYS  53          1HD       LYS  53  -4.103   4.771  -7.566
  400   1HE   LYS  53          1HE       LYS  53  -2.672   5.362  -9.377
  401   2HE   LYS  53          2HE       LYS  53  -3.969   6.564  -9.286
  402   1HZ   LYS  53          1HZ       LYS  53  -1.814   7.546  -9.631
  403   2HZ   LYS  53          2HZ       LYS  53  -2.430   8.031  -8.184
  404   3HZ   LYS  53          3HZ       LYS  53  -1.240   6.892  -8.232
  405    H    CYS  54           H        CYS  54  -3.653   3.350  -6.079
  406    HA   CYS  54           HA       CYS  54  -3.151   1.968  -3.534
  407   1HB   CYS  54          2HB       CYS  54  -5.053   0.785  -4.456
  408   2HB   CYS  54          1HB       CYS  54  -4.225   0.609  -6.022
  409    HG   CYS  54           HG       CYS  54  -4.122  -1.682  -4.841
  410    H    VAL  55           H        VAL  55  -1.129   0.893  -3.536
  411    HA   VAL  55           HA       VAL  55   0.478   1.101  -5.969
  412    HB   VAL  55           HB       VAL  55   1.895   2.600  -3.886
  413   1HG1  VAL  55          1HG1      VAL  55  -0.363   3.455  -3.237
  414   2HG1  VAL  55          2HG1      VAL  55   0.742   4.680  -3.864
  415   3HG1  VAL  55          3HG1      VAL  55  -0.558   4.091  -4.891
  416   1HG2  VAL  55          1HG2      VAL  55   1.018   3.320  -6.713
  417   2HG2  VAL  55          2HG2      VAL  55   2.539   2.518  -6.260
  418   3HG2  VAL  55          3HG2      VAL  55   2.215   4.176  -5.724
  419    H    LYS  56           HN       LYS  56   2.696   0.449  -5.674
  420    HA   LYS  56           HA       LYS  56   3.150  -1.346  -3.342
  421   1HB   LYS  56          2HB       LYS  56   3.600  -1.799  -6.298
  422   2HB   LYS  56          1HB       LYS  56   4.097  -2.899  -4.999
  423   1HG   LYS  56          2HG       LYS  56   1.712  -3.003  -4.220
  424   2HG   LYS  56          1HG       LYS  56   1.233  -2.123  -5.683
  425   1HD   LYS  56          1HD       LYS  56   2.831  -4.709  -5.698
  426   2HD   LYS  56          2HD       LYS  56   1.057  -4.634  -5.769
  427   1HE   LYS  56          1HE       LYS  56   1.200  -3.218  -7.837
  428   2HE   LYS  56          2HE       LYS  56   2.963  -3.359  -7.803
  429   1HZ   LYS  56          1HZ       LYS  56   1.995  -4.921  -9.286
  430   2HZ   LYS  56          2HZ       LYS  56   1.077  -5.584  -8.091
  431   3HZ   LYS  56          3HZ       LYS  56   2.721  -5.723  -8.042
  432    H    LEU  57           H        LEU  57   4.822  -0.542  -2.251
  433    HA   LEU  57           HA       LEU  57   6.902   1.106  -3.624
  434   1HB   LEU  57          1HB       LEU  57   5.960   2.047  -1.557
  435   2HB   LEU  57          2HB       LEU  57   6.488   0.615  -0.669
  436    HG   LEU  57           HG       LEU  57   8.852   1.474  -1.932
  437   1HD1  LEU  57          1HD2      LEU  57   8.615   0.664   0.376
  438   2HD1  LEU  57          2HD2      LEU  57   7.820   2.193   0.830
  439   3HD1  LEU  57          3HD2      LEU  57   9.519   2.184   0.308
  440   1HD2  LEU  57          1HD1      LEU  57   9.029   3.865  -1.468
  441   2HD2  LEU  57          2HD1      LEU  57   7.329   3.917  -0.972
  442   3HD2  LEU  57          3HD1      LEU  57   7.756   3.567  -2.663
  443    H    ASN  58           H        ASN  58   8.668   0.097  -4.394
  444    HA   ASN  58           HA       ASN  58   9.281  -2.630  -3.464
  445   1HB   ASN  58          2HB       ASN  58   9.691  -1.979  -5.786
  446   2HB   ASN  58          1HB       ASN  58  10.925  -0.837  -5.258
  447   1HD2  ASN  58          2HD2      ASN  58  10.526  -3.917  -6.433
  448   2HD2  ASN  58          1HD2      ASN  58  11.985  -4.654  -5.789
  449    H    THR  59           H        THR  59   9.912  -2.820  -1.513
  450    HA   THR  59           HA       THR  59  11.025  -0.920   0.255
  451    HB   THR  59           HB       THR  59  11.097  -3.980   0.225
  452    HG1  THR  59           HG1      THR  59   9.046  -3.300   0.232
  453   1HG2  THR  59          1HG2      THR  59  12.733  -3.272   1.823
  454   2HG2  THR  59          2HG2      THR  59  11.624  -2.053   2.491
  455   3HG2  THR  59          3HG2      THR  59  11.279  -3.793   2.685
  456    H    ASP  60           HN       ASP  60  12.539  -3.364  -1.760
  457    HA   ASP  60           HA       ASP  60  15.137  -3.377  -0.504
  458   1HB   ASP  60          2HB       ASP  60  13.797  -5.214  -1.669
  459   2HB   ASP  60          1HB       ASP  60  14.174  -4.428  -3.187
  460    H    GLU  61           HN       GLU  61  13.618  -1.924  -3.303
  461    HA   GLU  61           HA       GLU  61  15.981  -0.544  -4.322
  462   1HB   GLU  61          2HB       GLU  61  14.114  -1.512  -5.708
  463   2HB   GLU  61          1HB       GLU  61  13.025  -0.313  -4.979
  464   1HG   GLU  61          2HG       GLU  61  14.360   1.515  -6.000
  465   2HG   GLU  61          1HG       GLU  61  15.458   0.309  -6.682
  466    H    SER  62           H        SER  62  13.290   0.143  -2.136
  467    HA   SER  62           HA       SER  62  14.069   3.014  -1.914
  468   1HB   SER  62          2HB       SER  62  11.841   2.322  -2.992
  469   2HB   SER  62          1HB       SER  62  11.321   1.822  -1.382
  470    HG   SER  62           HG       SER  62  11.679   3.907  -0.662
  471    HA   PRO  63           HA       PRO  63  14.589   0.610   2.177
  472   1HB   PRO  63          1HB       PRO  63  17.219   1.342   2.632
  473   2HB   PRO  63          2HB       PRO  63  16.700  -0.166   1.818
  474   1HG   PRO  63          1HG       PRO  63  17.559   2.443   0.547
  475   2HG   PRO  63          2HG       PRO  63  18.073   0.784   0.112
  476   1HD   PRO  63          1HD       PRO  63  16.150   2.039  -1.278
  477   2HD   PRO  63          2HD       PRO  63  15.931   0.304  -0.867
  478    H    ASN  64           H        ASN  64  15.325   3.752   0.872
  479    HA   ASN  64           HA       ASN  64  15.701   5.378   3.145
  480   1HB   ASN  64          1HB       ASN  64  14.199   5.922   0.543
  481   2HB   ASN  64          2HB       ASN  64  14.526   7.153   1.772
  482   1HD2  ASN  64          2HD2      ASN  64  15.439   8.084  -0.270
  483   2HD2  ASN  64          1HD2      ASN  64  17.162   7.790  -0.560
  484    H    VAL  65           H        VAL  65  12.602   5.100   1.445
  485    HA   VAL  65           HA       VAL  65  10.939   6.087   3.470
  486    HB   VAL  65           HB       VAL  65  10.453   4.155   1.163
  487   1HG1  VAL  65          1HG2      VAL  65   8.617   3.886   2.728
  488   2HG1  VAL  65          2HG2      VAL  65   8.427   5.648   2.869
  489   3HG1  VAL  65          3HG2      VAL  65   8.072   4.816   1.333
  490   1HG2  VAL  65          1HG1      VAL  65   9.592   6.192   0.039
  491   2HG2  VAL  65          2HG1      VAL  65  10.036   7.162   1.461
  492   3HG2  VAL  65          3HG1      VAL  65  11.294   6.382   0.485
  493    H    ALA  66           H        ALA  66  11.760   2.744   2.637
  494    HA   ALA  66           HA       ALA  66  10.244   1.357   4.479
  495   1HB   ALA  66          1HB       ALA  66  11.901  -0.439   4.319
  496   2HB   ALA  66          2HB       ALA  66  13.114   0.694   3.739
  497   3HB   ALA  66          3HB       ALA  66  11.699   0.331   2.723
  498    H    SER  67           H        SER  67  13.552   2.645   5.046
  499    HA   SER  67           HA       SER  67  13.655   1.788   7.799
  500   1HB   SER  67          1HB       SER  67  15.720   3.131   7.878
  501   2HB   SER  67          2HB       SER  67  15.692   2.034   6.487
  502    HG   SER  67           HG       SER  67  15.074   3.829   5.187
  503    H    GLU  68           HN       GLU  68  13.020   4.906   6.210
  504    HA   GLU  68           HA       GLU  68  12.755   6.561   8.463
  505   1HB   GLU  68          1HB       GLU  68  11.240   6.524   5.827
  506   2HB   GLU  68          2HB       GLU  68  11.064   7.825   7.008
  507   1HG   GLU  68          2HG       GLU  68  13.294   8.556   6.767
  508   2HG   GLU  68          1HG       GLU  68  13.826   7.053   6.016
  509    H    TYR  69           H        TYR  69  10.218   4.522   6.919
  510    HA   TYR  69           HA       TYR  69   8.303   5.129   9.070
  511   1HB   TYR  69          2HB       TYR  69   8.309   3.437   6.563
  512   2HB   TYR  69          1HB       TYR  69   7.124   3.150   7.822
  513    HD1  TYR  69           HD1      TYR  69   5.351   4.737   8.316
  514    HD2  TYR  69           HD2      TYR  69   8.422   5.757   5.472
  515    HE1  TYR  69           HE1      TYR  69   4.255   6.924   7.906
  516    HE2  TYR  69           HE2      TYR  69   7.336   7.938   5.076
  517    HH   TYR  69           HH       TYR  69   5.645   9.390   5.734
  518    H    GLY  70           H        GLY  70  10.594   2.525   8.315
  519   1HA   GLY  70          2HA       GLY  70  11.629   1.141   9.850
  520   2HA   GLY  70          1HA       GLY  70  10.543   1.701  11.129
  521    H    ILE  71           H        ILE  71   9.971   0.175   7.911
  522    HA   ILE  71           HA       ILE  71   7.949  -1.599   9.048
  523    HB   ILE  71           HB       ILE  71   8.085  -2.607   6.709
  524   1HG1  ILE  71          2HG1      ILE  71   9.304  -0.005   5.873
  525   2HG1  ILE  71          1HG1      ILE  71  10.421  -1.312   6.307
  526   1HG2  ILE  71          1HG2      ILE  71   6.332  -1.069   7.519
  527   2HG2  ILE  71          2HG2      ILE  71   6.699  -0.741   5.821
  528   3HG2  ILE  71          3HG2      ILE  71   7.330   0.330   7.090
  529   1HD1  ILE  71          1HD1      ILE  71   9.571  -2.761   4.650
  530   2HD1  ILE  71          2HD1      ILE  71   8.152  -1.740   4.357
  531   3HD1  ILE  71          3HD1      ILE  71   9.768  -1.197   3.848
  532    H    ARG  72           HN       ARG  72   8.791  -2.911  10.537
  533    HA   ARG  72           HA       ARG  72  11.226  -4.449  10.137
  534   1HB   ARG  72          1HB       ARG  72  10.866  -5.249  12.320
  535   2HB   ARG  72          2HB       ARG  72  10.540  -3.525  12.301
  536   1HG   ARG  72          2HG       ARG  72   8.588  -5.808  12.727
  537   2HG   ARG  72          1HG       ARG  72   9.054  -4.517  13.810
  538   1HD   ARG  72          2HD       ARG  72   6.835  -4.077  13.100
  539   2HD   ARG  72          1HD       ARG  72   7.873  -2.867  12.328
  540    HE   ARG  72           HE       ARG  72   7.456  -5.297  10.754
  541   1HH1  ARG  72          2HH1      ARG  72   5.778  -2.318  11.612
  542   2HH1  ARG  72          1HH1      ARG  72   5.054  -2.108  10.037
  543   1HH2  ARG  72          1HH2      ARG  72   6.761  -4.864   8.590
  544   2HH2  ARG  72          2HH2      ARG  72   5.464  -3.754   8.347
  545    H    SER  73           H        SER  73  10.298  -5.114   8.056
  546    HA   SER  73           HA       SER  73  10.218  -7.143   6.880
  547   1HB   SER  73          1HB       SER  73   9.799  -8.565   8.930
  548   2HB   SER  73          2HB       SER  73   8.065  -8.175   8.776
  549    HG   SER  73           HG       SER  73   8.640 -10.114   7.680
  550    H    ILE  74           H        ILE  74   8.197  -8.179   5.771
  551    HA   ILE  74           HA       ILE  74   6.113  -6.206   5.162
  552    HB   ILE  74           HB       ILE  74   6.812  -6.392   2.642
  553   1HG1  ILE  74          1HG1      ILE  74   9.565  -6.909   3.765
  554   2HG1  ILE  74          2HG1      ILE  74   8.544  -8.171   3.049
  555   1HG2  ILE  74          1HG2      ILE  74   8.609  -4.792   4.490
  556   2HG2  ILE  74          2HG2      ILE  74   8.129  -4.372   2.836
  557   3HG2  ILE  74          3HG2      ILE  74   6.930  -4.345   4.126
  558   1HD1  ILE  74          1HD1      ILE  74   8.362  -6.820   0.963
  559   2HD1  ILE  74          2HD1      ILE  74   9.506  -5.640   1.640
  560   3HD1  ILE  74          3HD1      ILE  74  10.013  -7.295   1.314
  561    HA   PRO  75           HA       PRO  75   4.686  -6.366   2.715
  562   1HB   PRO  75          1HB       PRO  75   2.000  -6.798   2.681
  563   2HB   PRO  75          2HB       PRO  75   3.121  -7.586   1.550
  564   1HG   PRO  75          1HG       PRO  75   2.044  -8.659   4.153
  565   2HG   PRO  75          2HG       PRO  75   2.047  -9.493   2.566
  566   1HD   PRO  75          1HD       PRO  75   3.988 -10.030   4.379
  567   2HD   PRO  75          2HD       PRO  75   4.407  -9.797   2.659
  568    H    THR  76           H        THR  76   3.509  -4.542   3.225
  569    HA   THR  76           HA       THR  76   2.153  -4.262   5.757
  570    HB   THR  76           HB       THR  76   4.799  -2.836   5.345
  571    HG1  THR  76           HG1      THR  76   4.269  -5.026   6.526
  572   1HG2  THR  76          1HG2      THR  76   2.506  -2.312   7.294
  573   2HG2  THR  76          2HG2      THR  76   4.145  -1.688   7.520
  574   3HG2  THR  76          3HG2      THR  76   3.190  -1.167   6.123
  575    H    ILE  77           H        ILE  77   0.410  -3.579   4.804
  576    HA   ILE  77           HA       ILE  77   0.350  -1.673   2.554
  577    HB   ILE  77           HB       ILE  77  -1.762  -3.065   4.230
  578   1HG1  ILE  77          2HG1      ILE  77  -1.103  -3.368   1.268
  579   2HG1  ILE  77          1HG1      ILE  77  -0.410  -4.412   2.515
  580   1HG2  ILE  77          1HG2      ILE  77  -2.028  -1.110   1.926
  581   2HG2  ILE  77          2HG2      ILE  77  -2.630  -0.876   3.580
  582   3HG2  ILE  77          3HG2      ILE  77  -3.379  -2.088   2.557
  583   1HD1  ILE  77          1HD1      ILE  77  -3.372  -4.189   1.851
  584   2HD1  ILE  77          2HD1      ILE  77  -2.282  -5.541   1.522
  585   3HD1  ILE  77          3HD1      ILE  77  -2.687  -5.130   3.197
  586    H    MET  78           H        MET  78   0.195   0.537   2.934
  587    HA   MET  78           HA       MET  78  -0.633   1.446   5.660
  588   1HB   MET  78          1HB       MET  78   1.504   2.640   3.882
  589   2HB   MET  78          2HB       MET  78   0.823   3.404   5.333
  590   1HG   MET  78          1HG       MET  78   1.559   1.312   6.612
  591   2HG   MET  78          2HG       MET  78   2.475   0.891   5.171
  592   1HE   MET  78          1HE       MET  78   5.178   1.933   7.773
  593   2HE   MET  78          2HE       MET  78   3.723   0.925   7.915
  594   3HE   MET  78          3HE       MET  78   4.765   0.792   6.472
  595    H    VAL  79           H        VAL  79  -2.111   2.992   5.652
  596    HA   VAL  79           HA       VAL  79  -3.312   3.751   3.014
  597    HB   VAL  79           HB       VAL  79  -4.447   3.899   5.836
  598   1HG1  VAL  79          1HG1      VAL  79  -4.366   1.612   4.934
  599   2HG1  VAL  79          2HG1      VAL  79  -5.116   2.164   3.420
  600   3HG1  VAL  79          3HG1      VAL  79  -6.033   2.215   4.943
  601   1HG2  VAL  79          1HG2      VAL  79  -5.259   5.803   4.505
  602   2HG2  VAL  79          2HG2      VAL  79  -5.574   4.741   3.123
  603   3HG2  VAL  79          3HG2      VAL  79  -6.535   4.592   4.614
  604    H    PHE  80           H        PHE  80  -2.172   5.462   2.307
  605    HA   PHE  80           HA       PHE  80  -1.440   7.683   4.159
  606   1HB   PHE  80          1HB       PHE  80  -0.667   6.841   1.392
  607   2HB   PHE  80          2HB       PHE  80  -0.486   8.529   1.871
  608    HD1  PHE  80           HD1      PHE  80   1.305   9.249   3.263
  609    HD2  PHE  80           HD2      PHE  80   0.452   5.037   2.944
  610    HE1  PHE  80           HE1      PHE  80   3.470   8.732   4.339
  611    HE2  PHE  80           HE2      PHE  80   2.688   4.528   3.931
  612    HZ   PHE  80           HZ       PHE  80   4.164   6.352   4.661
  613    H    LYS  81           HN       LYS  81  -2.230   9.721   3.899
  614    HA   LYS  81           HA       LYS  81  -4.513  10.148   2.042
  615   1HB   LYS  81          2HB       LYS  81  -6.083  10.600   3.731
  616   2HB   LYS  81          1HB       LYS  81  -5.342   9.073   4.183
  617   1HG   LYS  81          1HG       LYS  81  -5.070  11.789   5.490
  618   2HG   LYS  81          2HG       LYS  81  -5.628  10.269   6.176
  619   1HD   LYS  81          1HD       LYS  81  -3.257   9.386   6.017
  620   2HD   LYS  81          2HD       LYS  81  -2.768  10.979   5.400
  621   1HE   LYS  81          1HE       LYS  81  -2.220  10.943   7.707
  622   2HE   LYS  81          2HE       LYS  81  -3.558  12.076   7.461
  623   1HZ   LYS  81          1HZ       LYS  81  -3.729   9.337   8.499
  624   2HZ   LYS  81          2HZ       LYS  81  -3.907  10.719   9.368
  625   3HZ   LYS  81          3HZ       LYS  81  -5.035  10.312   8.238
  626    H    GLY  82           H        GLY  82  -1.849  11.176   2.074
  627   1HA   GLY  82          2HA       GLY  82  -1.329  13.420   1.325
  628   2HA   GLY  82          1HA       GLY  82  -2.400  14.078   2.569
  629    H    GLY  83           H        GLY  83   0.778  13.201   1.855
  630   1HA   GLY  83          2HA       GLY  83   2.729  13.409   2.996
  631   2HA   GLY  83          1HA       GLY  83   1.839  14.178   4.306
  632    H    LYS  84           HN       LYS  84   0.477  12.522   5.601
  633    HA   LYS  84           HA       LYS  84   2.409  10.396   6.483
  634   1HB   LYS  84          2HB       LYS  84   0.224  11.880   7.996
  635   2HB   LYS  84          1HB       LYS  84   1.251  10.597   8.658
  636   1HG   LYS  84          1HG       LYS  84   3.277  11.964   8.203
  637   2HG   LYS  84          2HG       LYS  84   2.262  13.247   7.535
  638   1HD   LYS  84          1HD       LYS  84   2.867  13.841   9.776
  639   2HD   LYS  84          2HD       LYS  84   1.127  13.522   9.722
  640   1HE   LYS  84          2HE       LYS  84   1.463  11.318  10.772
  641   2HE   LYS  84          1HE       LYS  84   3.226  11.508  10.671
  642   1HZ   LYS  84          1HZ       LYS  84   1.402  13.186  12.243
  643   2HZ   LYS  84          2HZ       LYS  84   2.387  12.004  12.834
  644   3HZ   LYS  84          3HZ       LYS  84   3.040  13.359  12.162
  645    H    LYS  85           HN       LYS  85   1.407   8.607   7.647
  646    HA   LYS  85           HA       LYS  85  -0.622   7.264   6.013
  647   1HB   LYS  85          2HB       LYS  85  -0.077   5.312   7.237
  648   2HB   LYS  85          1HB       LYS  85   1.418   6.063   6.667
  649   1HG   LYS  85          2HG       LYS  85   1.819   7.019   8.916
  650   2HG   LYS  85          1HG       LYS  85   0.320   6.320   9.520
  651   1HD   LYS  85          1HD       LYS  85   2.740   4.791   8.470
  652   2HD   LYS  85          2HD       LYS  85   2.291   4.995  10.165
  653   1HE   LYS  85          1HE       LYS  85   0.767   3.422   8.041
  654   2HE   LYS  85          2HE       LYS  85   1.632   2.789   9.443
  655   1HZ   LYS  85          1HZ       LYS  85   0.052   3.936  10.848
  656   2HZ   LYS  85          2HZ       LYS  85  -0.698   2.863   9.847
  657   3HZ   LYS  85          3HZ       LYS  85  -0.773   4.473   9.525
  658    H    CYS  86           H        CYS  86  -2.393   6.159   7.098
  659    HA   CYS  86           HA       CYS  86  -3.493   7.577   9.505
  660   1HB   CYS  86          2HB       CYS  86  -4.716   7.875   7.264
  661   2HB   CYS  86          1HB       CYS  86  -5.087   6.155   7.316
  662    HG   CYS  86           HG       CYS  86  -5.895   6.441   9.993
  663    H    GLU  87           HN       GLU  87  -3.667   4.518   7.676
  664    HA   GLU  87           HA       GLU  87  -3.596   2.943  10.203
  665   1HB   GLU  87          1HB       GLU  87  -5.453   2.352   7.867
  666   2HB   GLU  87          2HB       GLU  87  -5.385   1.561   9.453
  667   1HG   GLU  87          1HG       GLU  87  -6.368   4.385   8.891
  668   2HG   GLU  87          2HG       GLU  87  -7.348   2.993   9.298
  669    H    THR  88           H        THR  88  -3.351   0.451   9.460
  670    HA   THR  88           HA       THR  88  -1.879   0.098   7.029
  671    HB   THR  88           HB       THR  88  -0.119   1.148   8.375
  672    HG1  THR  88           HG1      THR  88   0.469  -0.756   7.186
  673   1HG2  THR  88          1HG2      THR  88  -1.036   0.755  10.660
  674   2HG2  THR  88          2HG2      THR  88   0.640   0.206  10.532
  675   3HG2  THR  88          3HG2      THR  88  -0.677  -0.978  10.501
  676    H    ILE  89           H        ILE  89  -1.136  -2.211   6.794
  677    HA   ILE  89           HA       ILE  89  -2.454  -4.153   8.600
  678    HB   ILE  89           HB       ILE  89  -2.676  -4.514   5.586
  679   1HG1  ILE  89          2HG1      ILE  89  -4.780  -3.230   7.357
  680   2HG1  ILE  89          1HG1      ILE  89  -3.896  -2.425   6.049
  681   1HG2  ILE  89          1HG2      ILE  89  -2.860  -6.448   7.184
  682   2HG2  ILE  89          2HG2      ILE  89  -4.300  -6.198   6.205
  683   3HG2  ILE  89          3HG2      ILE  89  -4.283  -5.664   7.900
  684   1HD1  ILE  89          1HD1      ILE  89  -4.844  -4.012   4.401
  685   2HD1  ILE  89          2HD1      ILE  89  -6.056  -3.003   5.212
  686   3HD1  ILE  89          3HD1      ILE  89  -5.869  -4.698   5.683
  687    H    ILE  90           H        ILE  90  -0.878  -5.672   9.087
  688    HA   ILE  90           HA       ILE  90   1.581  -5.741   7.391
  689    HB   ILE  90           HB       ILE  90   1.186  -6.378  10.339
  690   1HG1  ILE  90          1HG1      ILE  90   2.541  -3.983   9.011
  691   2HG1  ILE  90          2HG1      ILE  90   0.960  -3.933   9.795
  692   1HG2  ILE  90          1HG2      ILE  90   3.026  -7.691   9.281
  693   2HG2  ILE  90          2HG2      ILE  90   3.727  -6.190   8.643
  694   3HG2  ILE  90          3HG2      ILE  90   3.670  -6.499  10.389
  695   1HD1  ILE  90          1HD1      ILE  90   3.596  -4.462  11.195
  696   2HD1  ILE  90          2HD1      ILE  90   1.992  -4.628  11.946
  697   3HD1  ILE  90          3HD1      ILE  90   2.537  -3.055  11.334
  698    H    GLY  91           H        GLY  91   2.286  -7.689   6.604
  699   1HA   GLY  91          2HA       GLY  91   2.489  -9.983   6.413
  700   2HA   GLY  91          1HA       GLY  91   1.296 -10.232   7.690
  701    H    ALA  92           H        ALA  92   1.485 -11.706   5.190
  702    HA   ALA  92           HA       ALA  92  -0.513 -10.742   3.335
  703   1HB   ALA  92          1HB       ALA  92  -0.183 -12.959   2.307
  704   2HB   ALA  92          2HB       ALA  92   1.350 -12.135   2.642
  705   3HB   ALA  92          3HB       ALA  92   0.811 -13.466   3.690
  706    H    VAL  93           H        VAL  93  -2.154 -10.345   5.123
  707    HA   VAL  93           HA       VAL  93  -3.502 -12.700   6.172
  708    HB   VAL  93           HB       VAL  93  -5.170 -11.156   7.026
  709   1HG1  VAL  93          1HG2      VAL  93  -3.703  -8.966   5.482
  710   2HG1  VAL  93          2HG2      VAL  93  -5.371  -9.526   5.231
  711   3HG1  VAL  93          3HG2      VAL  93  -4.936  -8.706   6.730
  712   1HG2  VAL  93          1HG1      VAL  93  -2.359 -10.053   7.435
  713   2HG2  VAL  93          2HG1      VAL  93  -3.029 -11.488   8.239
  714   3HG2  VAL  93          3HG1      VAL  93  -3.742  -9.893   8.528
  715    HA   PRO  94           HA       PRO  94  -5.923 -13.767   2.637
  716   1HB   PRO  94          1HB       PRO  94  -8.296 -13.909   4.508
  717   2HB   PRO  94          2HB       PRO  94  -7.803 -15.088   3.262
  718   1HG   PRO  94          1HG       PRO  94  -7.204 -15.554   5.867
  719   2HG   PRO  94          2HG       PRO  94  -5.975 -15.849   4.601
  720   1HD   PRO  94          2HD       PRO  94  -6.177 -13.501   6.487
  721   2HD   PRO  94          1HD       PRO  94  -4.753 -14.414   5.916
  722    H    LYS  95           HN       LYS  95  -7.555 -13.062   1.164
  723    HA   LYS  95           HA       LYS  95  -7.868 -10.343   0.885
  724   1HB   LYS  95          1HB       LYS  95  -9.546 -10.805  -0.768
  725   2HB   LYS  95          2HB       LYS  95  -8.174 -11.920  -0.951
  726   1HG   LYS  95          1HG       LYS  95  -9.564 -13.702   0.155
  727   2HG   LYS  95          2HG       LYS  95 -10.947 -12.596   0.115
  728   1HD   LYS  95          1HD       LYS  95  -9.371 -13.629  -2.280
  729   2HD   LYS  95          2HD       LYS  95 -10.996 -14.116  -1.799
  730   1HE   LYS  95          1HE       LYS  95 -10.158 -11.364  -2.854
  731   2HE   LYS  95          2HE       LYS  95 -11.123 -12.584  -3.679
  732   1HZ   LYS  95          1HZ       LYS  95 -12.484 -10.891  -2.757
  733   2HZ   LYS  95          2HZ       LYS  95 -12.803 -12.318  -1.997
  734   3HZ   LYS  95          3HZ       LYS  95 -11.907 -11.159  -1.239
  735    H    ALA  96           H        ALA  96 -10.235 -12.591   2.261
  736    HA   ALA  96           HA       ALA  96 -12.371 -10.852   2.758
  737   1HB   ALA  96          1HB       ALA  96 -12.974 -12.386   4.607
  738   2HB   ALA  96          2HB       ALA  96 -11.357 -13.117   4.542
  739   3HB   ALA  96          3HB       ALA  96 -12.467 -13.284   3.164
  740    H    THR  97           H        THR  97  -9.479 -11.449   4.859
  741    HA   THR  97           HA       THR  97 -10.254  -9.606   6.888
  742    HB   THR  97           HB       THR  97  -7.380  -9.851   6.696
  743    HG1  THR  97           HG1      THR  97  -7.598 -11.611   5.405
  744   1HG2  THR  97          1HG2      THR  97  -8.687  -9.688   8.787
  745   2HG2  THR  97          2HG2      THR  97  -7.659 -11.135   8.768
  746   3HG2  THR  97          3HG2      THR  97  -9.403 -11.287   8.464
  747    H    ILE  98           H        ILE  98  -8.124  -9.324   3.976
  748    HA   ILE  98           HA       ILE  98  -7.307  -6.650   4.422
  749    HB   ILE  98           HB       ILE  98  -7.814  -8.064   1.756
  750   1HG1  ILE  98          2HG1      ILE  98  -5.280  -7.652   3.412
  751   2HG1  ILE  98          1HG1      ILE  98  -6.140  -9.176   3.153
  752   1HG2  ILE  98          1HG2      ILE  98  -6.222  -5.524   2.365
  753   2HG2  ILE  98          2HG2      ILE  98  -6.381  -6.301   0.777
  754   3HG2  ILE  98          3HG2      ILE  98  -7.780  -5.556   1.519
  755   1HD1  ILE  98          1HD1      ILE  98  -4.262  -9.208   1.715
  756   2HD1  ILE  98          2HD1      ILE  98  -4.609  -7.605   1.063
  757   3HD1  ILE  98          3HD1      ILE  98  -5.691  -8.972   0.690
  758    H    VAL  99           H        VAL  99 -10.101  -7.797   2.467
  759    HA   VAL  99           HA       VAL  99 -11.271  -5.356   1.804
  760    HB   VAL  99           HB       VAL  99 -12.435  -8.109   2.401
  761   1HG1  VAL  99          1HG2      VAL  99 -13.922  -5.710   1.266
  762   2HG1  VAL  99          2HG2      VAL  99 -14.499  -7.384   1.226
  763   3HG1  VAL  99          3HG2      VAL  99 -14.304  -6.564   2.775
  764   1HG2  VAL  99          1HG1      VAL  99 -10.960  -7.858   0.394
  765   2HG2  VAL  99          2HG1      VAL  99 -12.632  -8.229  -0.046
  766   3HG2  VAL  99          3HG1      VAL  99 -12.021  -6.569  -0.201
  767    H    GLN 100           H        GLN 100 -12.178  -7.396   4.658
  768    HA   GLN 100           HA       GLN 100 -13.960  -5.541   5.812
  769   1HB   GLN 100          1HB       GLN 100 -12.144  -7.663   7.019
  770   2HB   GLN 100          2HB       GLN 100 -13.306  -6.745   7.990
  771   1HG   GLN 100          1HG       GLN 100 -15.175  -7.516   6.731
  772   2HG   GLN 100          2HG       GLN 100 -14.162  -8.275   5.498
  773   1HE2  GLN 100          1HE2      GLN 100 -12.607  -9.947   6.310
  774   2HE2  GLN 100          2HE2      GLN 100 -13.196 -11.070   7.549
  775    H    THR 101           H        THR 101 -10.436  -5.856   6.322
  776    HA   THR 101           HA       THR 101 -10.258  -3.808   8.306
  777    HB   THR 101           HB       THR 101  -8.141  -4.845   6.376
  778    HG1  THR 101           HG1      THR 101  -9.007  -6.500   7.583
  779   1HG2  THR 101          1HG2      THR 101  -7.977  -3.362   9.039
  780   2HG2  THR 101          2HG2      THR 101  -7.359  -2.835   7.451
  781   3HG2  THR 101          3HG2      THR 101  -6.615  -4.215   8.289
  782    H    VAL 102           H        VAL 102  -9.895  -3.658   4.694
  783    HA   VAL 102           HA       VAL 102  -9.194  -0.871   4.697
  784    HB   VAL 102           HB       VAL 102 -10.444  -2.612   2.532
  785   1HG1  VAL 102          1HG1      VAL 102  -8.187  -2.598   1.582
  786   2HG1  VAL 102          2HG1      VAL 102  -7.612  -1.516   2.870
  787   3HG1  VAL 102          3HG1      VAL 102  -8.075  -3.179   3.249
  788   1HG2  VAL 102          1HG2      VAL 102  -9.629  -0.749   0.996
  789   2HG2  VAL 102          2HG2      VAL 102  -9.355   0.249   2.429
  790   3HG2  VAL 102          3HG2      VAL 102 -10.998  -0.276   2.010
  791    H    GLU 103           HN       GLU 103 -12.333  -2.581   4.411
  792    HA   GLU 103           HA       GLU 103 -13.953  -0.287   4.109
  793   1HB   GLU 103          1HB       GLU 103 -14.493  -2.949   5.490
  794   2HB   GLU 103          2HB       GLU 103 -15.736  -1.756   5.137
  795   1HG   GLU 103          2HG       GLU 103 -13.954  -2.925   2.956
  796   2HG   GLU 103          1HG       GLU 103 -15.453  -3.701   3.480
  797    H    LYS 104           HN       LYS 104 -13.055  -2.004   7.094
  798    HA   LYS 104           HA       LYS 104 -14.183  -0.370   9.054
  799   1HB   LYS 104          2HB       LYS 104 -13.051  -2.465   9.559
  800   2HB   LYS 104          1HB       LYS 104 -11.540  -1.841   8.918
  801   1HG   LYS 104          2HG       LYS 104 -11.650  -0.082  10.864
  802   2HG   LYS 104          1HG       LYS 104 -12.843  -1.197  11.553
  803   1HD   LYS 104          2HD       LYS 104 -11.145  -3.047  11.287
  804   2HD   LYS 104          1HD       LYS 104 -10.005  -1.871  10.613
  805   1HE   LYS 104          1HE       LYS 104 -10.068  -0.578  12.744
  806   2HE   LYS 104          2HE       LYS 104 -11.173  -1.783  13.434
  807   1HZ   LYS 104          1HZ       LYS 104  -9.464  -3.424  13.137
  808   2HZ   LYS 104          2HZ       LYS 104  -8.442  -2.310  12.483
  809   3HZ   LYS 104          3HZ       LYS 104  -8.907  -2.175  14.057
  810    H    TYR 105           H        TYR 105 -10.969   0.025   7.474
  811    HA   TYR 105           HA       TYR 105 -10.350   2.504   8.846
  812   1HB   TYR 105          2HB       TYR 105  -9.285   1.215   6.312
  813   2HB   TYR 105          1HB       TYR 105  -8.521   2.579   7.132
  814    HD1  TYR 105           HD1      TYR 105  -9.388   0.841   9.908
  815    HD2  TYR 105           HD2      TYR 105  -6.946   0.358   6.398
  816    HE1  TYR 105           HE1      TYR 105  -7.805  -0.554  11.210
  817    HE2  TYR 105           HE2      TYR 105  -5.316  -0.983   7.723
  818    HH   TYR 105           HH       TYR 105  -4.792  -1.858   9.838
  819    H    LEU 106           H        LEU 106 -12.077   1.797   5.812
  820    HA   LEU 106           HA       LEU 106 -12.473   4.617   5.246
  821   1HB   LEU 106          1HB       LEU 106 -10.671   2.739   3.685
  822   2HB   LEU 106          2HB       LEU 106 -11.604   3.954   2.855
  823    HG   LEU 106           HG       LEU 106  -9.408   4.455   4.881
  824   1HD1  LEU 106          1HD2      LEU 106  -9.765   6.899   4.281
  825   2HD1  LEU 106          2HD2      LEU 106 -11.023   6.244   5.322
  826   3HD1  LEU 106          3HD2      LEU 106 -11.333   6.449   3.581
  827   1HD2  LEU 106          1HD1      LEU 106  -8.383   5.502   2.904
  828   2HD2  LEU 106          2HD1      LEU 106  -8.852   3.821   2.541
  829   3HD2  LEU 106          3HD1      LEU 106  -9.849   5.173   1.952
  830    H    ASN 107           H        ASN 107 -14.505   4.459   5.218
  831    HA   ASN 107           HA       ASN 107 -15.984   3.247   3.069
  832   1HB   ASN 107          1HB       ASN 107 -15.945   1.436   4.829
  833   2HB   ASN 107          2HB       ASN 107 -16.711   2.559   5.962
  834   1HD2  ASN 107          2HD2      ASN 107 -18.526   3.616   3.651
  835   2HD2  ASN 107          1HD2      ASN 107 -19.681   2.296   3.439
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  -9.207   2.086  -7.196
    2   2H    MET   1          2H        MET   1  -8.017   2.845  -6.426
    3   3H    MET   1          3H        MET   1  -9.345   3.710  -6.915
    4    HA   MET   1           HA       MET   1  -8.765   3.189  -9.237
    5   1HB   MET   1          1HB       MET   1  -8.212   5.371  -8.315
    6   2HB   MET   1          2HB       MET   1  -6.762   4.753  -7.549
    7   1HG   MET   1          2HG       MET   1  -6.216   6.017  -9.534
    8   2HG   MET   1          1HG       MET   1  -5.772   4.330  -9.800
    9   1HE   MET   1          1HE       MET   1  -6.018   6.593 -12.079
   10   2HE   MET   1          2HE       MET   1  -5.493   4.913 -12.354
   11   3HE   MET   1          3HE       MET   1  -6.782   5.619 -13.355
   12    H    GLU   2           HN       GLU   2  -7.398   2.099 -10.667
   13    HA   GLU   2           HA       GLU   2  -6.311  -0.305  -9.826
   14   1HB   GLU   2          1HB       GLU   2  -5.132  -0.277 -12.085
   15   2HB   GLU   2          2HB       GLU   2  -6.882  -0.156 -12.099
   16   1HG   GLU   2          1HG       GLU   2  -5.250   2.401 -12.162
   17   2HG   GLU   2          2HG       GLU   2  -5.337   1.391 -13.607
   18    H    ALA   3           H        ALA   3  -4.230  -1.160  -9.943
   19    HA   ALA   3           HA       ALA   3  -2.520   0.008  -8.079
   20   1HB   ALA   3          1HB       ALA   3  -2.858  -2.386  -8.441
   21   2HB   ALA   3          2HB       ALA   3  -1.133  -1.961  -8.491
   22   3HB   ALA   3          3HB       ALA   3  -2.013  -2.292 -10.000
   23    H    GLY   4           H        GLY   4  -0.842   1.391  -8.210
   24   1HA   GLY   4          2HA       GLY   4   0.628   1.765 -10.800
   25   2HA   GLY   4          1HA       GLY   4   0.588   2.887  -9.427
   26    H    ALA   5           H        ALA   5   3.066   2.526  -9.851
   27    HA   ALA   5           HA       ALA   5   4.050   0.499  -7.925
   28   1HB   ALA   5          1HB       ALA   5   5.962   0.033  -9.415
   29   2HB   ALA   5          2HB       ALA   5   4.435  -0.471 -10.169
   30   3HB   ALA   5          3HB       ALA   5   5.231   1.033 -10.690
   31    H    VAL   6           H        VAL   6   5.769   1.382  -6.670
   32    HA   VAL   6           HA       VAL   6   6.683   4.103  -7.351
   33    HB   VAL   6           HB       VAL   6   6.269   4.714  -4.857
   34   1HG1  VAL   6          1HG1      VAL   6   5.634   2.493  -4.036
   35   2HG1  VAL   6          2HG1      VAL   6   4.194   2.504  -5.066
   36   3HG1  VAL   6          3HG1      VAL   6   4.365   3.689  -3.759
   37   1HG2  VAL   6          1HG2      VAL   6   5.153   5.870  -6.599
   38   2HG2  VAL   6          2HG2      VAL   6   3.976   4.560  -6.801
   39   3HG2  VAL   6          3HG2      VAL   6   4.003   5.510  -5.299
   40    H    ASN   7           H        ASN   7   8.218   4.853  -5.693
   41    HA   ASN   7           HA       ASN   7   9.789   2.921  -4.271
   42   1HB   ASN   7          1HB       ASN   7  11.076   2.778  -6.342
   43   2HB   ASN   7          2HB       ASN   7  10.655   4.450  -6.737
   44   1HD2  ASN   7          1HD2      ASN   7  12.639   2.775  -4.227
   45   2HD2  ASN   7          2HD2      ASN   7  13.940   3.939  -4.339
   46    H    ASP   8           HN       ASP   8  11.501   4.348  -3.167
   47    HA   ASP   8           HA       ASP   8  10.474   6.284  -1.501
   48   1HB   ASP   8          2HB       ASP   8  12.807   5.396  -1.375
   49   2HB   ASP   8          1HB       ASP   8  13.269   6.383  -2.749
   50    H    ASP   9           HN       ASP   9  12.188   7.106  -4.494
   51    HA   ASP   9           HA       ASP   9  11.786   9.882  -4.413
   52   1HB   ASP   9          1HB       ASP   9  12.169   7.971  -6.761
   53   2HB   ASP   9          2HB       ASP   9  12.208   9.730  -6.893
   54    H    THR  10           H        THR  10   9.738   7.446  -6.171
   55    HA   THR  10           HA       THR  10   7.981   9.496  -7.228
   56    HB   THR  10           HB       THR  10   6.723   7.388  -7.961
   57    HG1  THR  10           HG1      THR  10   8.179   5.517  -7.755
   58   1HG2  THR  10          1HG2      THR  10   8.443   6.759  -9.610
   59   2HG2  THR  10          2HG2      THR  10   8.427   8.518  -9.395
   60   3HG2  THR  10          3HG2      THR  10   9.704   7.541  -8.640
   61    H    PHE  11           H        PHE  11   7.911   7.273  -4.527
   62    HA   PHE  11           HA       PHE  11   5.385   7.088  -3.578
   63   1HB   PHE  11          1HB       PHE  11   7.392   6.206  -2.491
   64   2HB   PHE  11          2HB       PHE  11   7.920   7.804  -2.064
   65    HD1  PHE  11           HD1      PHE  11   5.349   5.216  -1.325
   66    HD2  PHE  11           HD2      PHE  11   7.271   8.860  -0.053
   67    HE1  PHE  11           HE1      PHE  11   4.431   4.911   0.961
   68    HE2  PHE  11           HE2      PHE  11   6.431   8.499   2.243
   69    HZ   PHE  11           HZ       PHE  11   4.990   6.544   2.753
   70    H    LYS  12           HN       LYS  12   7.539   9.787  -3.065
   71    HA   LYS  12           HA       LYS  12   6.079  11.606  -1.558
   72   1HB   LYS  12          1HB       LYS  12   7.722  12.157  -4.085
   73   2HB   LYS  12          2HB       LYS  12   7.221  13.351  -2.912
   74   1HG   LYS  12          1HG       LYS  12   9.116  10.957  -2.569
   75   2HG   LYS  12          2HG       LYS  12   9.583  12.645  -2.634
   76   1HD   LYS  12          2HD       LYS  12   8.513  13.100  -0.480
   77   2HD   LYS  12          1HD       LYS  12   7.914  11.435  -0.369
   78   1HE   LYS  12          1HE       LYS  12  10.873  12.133  -0.555
   79   2HE   LYS  12          2HE       LYS  12  10.003  11.854   0.962
   80   1HZ   LYS  12          1HZ       LYS  12   9.487   9.659   0.235
   81   2HZ   LYS  12          2HZ       LYS  12  10.246   9.878  -1.206
   82   3HZ   LYS  12          3HZ       LYS  12  11.113   9.879   0.186
   83    H    ASN  13           H        ASN  13   6.057  11.757  -5.109
   84    HA   ASN  13           HA       ASN  13   3.813  13.573  -5.295
   85   1HB   ASN  13          2HB       ASN  13   5.539  11.933  -7.152
   86   2HB   ASN  13          1HB       ASN  13   3.961  12.406  -7.740
   87   1HD2  ASN  13          2HD2      ASN  13   5.512  14.692  -5.449
   88   2HD2  ASN  13          1HD2      ASN  13   6.042  15.787  -6.710
   89    H    VAL  14           H        VAL  14   4.237  10.133  -5.694
   90    HA   VAL  14           HA       VAL  14   1.553   9.821  -6.829
   91    HB   VAL  14           HB       VAL  14   3.616   7.779  -5.908
   92   1HG1  VAL  14          1HG1      VAL  14   4.384   9.221  -7.810
   93   2HG1  VAL  14          2HG1      VAL  14   2.895   8.832  -8.687
   94   3HG1  VAL  14          3HG1      VAL  14   4.083   7.563  -8.336
   95   1HG2  VAL  14          1HG2      VAL  14   2.323   6.241  -7.445
   96   2HG2  VAL  14          2HG2      VAL  14   1.441   6.690  -5.974
   97   3HG2  VAL  14          3HG2      VAL  14   1.050   7.476  -7.524
   98    H    VAL  15           H        VAL  15   2.924   9.310  -3.606
   99    HA   VAL  15           HA       VAL  15   0.323   8.234  -2.640
  100    HB   VAL  15           HB       VAL  15   3.043   8.190  -1.280
  101   1HG1  VAL  15          1HG1      VAL  15   0.543   6.600  -0.675
  102   2HG1  VAL  15          2HG1      VAL  15   1.040   8.053   0.210
  103   3HG1  VAL  15          3HG1      VAL  15   2.079   6.641   0.230
  104   1HG2  VAL  15          1HG2      VAL  15   3.134   6.883  -3.380
  105   2HG2  VAL  15          2HG2      VAL  15   1.676   6.016  -2.888
  106   3HG2  VAL  15          3HG2      VAL  15   3.178   5.849  -1.961
  107    H    LEU  16           H        LEU  16   2.950  10.388  -1.412
  108    HA   LEU  16           HA       LEU  16   1.260  11.350   0.707
  109   1HB   LEU  16          1HB       LEU  16   3.718  12.736  -0.402
  110   2HB   LEU  16          2HB       LEU  16   2.991  12.917   1.188
  111    HG   LEU  16           HG       LEU  16   4.424  10.455   0.079
  112   1HD1  LEU  16          1HD1      LEU  16   5.076  12.335   2.383
  113   2HD1  LEU  16          2HD1      LEU  16   5.829  12.387   0.776
  114   3HD1  LEU  16          3HD1      LEU  16   6.062  10.968   1.818
  115   1HD2  LEU  16          1HD2      LEU  16   3.098  10.829   2.799
  116   2HD2  LEU  16          2HD2      LEU  16   2.589   9.674   1.546
  117   3HD2  LEU  16          3HD2      LEU  16   4.145   9.481   2.351
  118    H    GLU  17           HN       GLU  17   2.417  13.099  -2.275
  119    HA   GLU  17           HA       GLU  17   0.400  15.175  -1.834
  120   1HB   GLU  17          2HB       GLU  17   2.278  14.678  -4.179
  121   2HB   GLU  17          1HB       GLU  17   1.303  16.100  -3.883
  122   1HG   GLU  17          2HG       GLU  17   3.154  16.965  -2.973
  123   2HG   GLU  17          1HG       GLU  17   2.633  16.098  -1.529
  124    H    SER  18           H        SER  18  -0.939  12.711  -2.018
  125    HA   SER  18           HA       SER  18  -2.098  12.581  -4.762
  126   1HB   SER  18          2HB       SER  18  -1.544  10.458  -3.641
  127   2HB   SER  18          1HB       SER  18  -2.643  10.869  -2.304
  128    HG   SER  18           HG       SER  18  -4.184  10.068  -3.538
  129    H    SER  19           H        SER  19  -4.533  12.371  -4.732
  130    HA   SER  19           HA       SER  19  -5.797  14.581  -3.170
  131   1HB   SER  19          1HB       SER  19  -7.561  14.280  -4.986
  132   2HB   SER  19          2HB       SER  19  -5.980  14.870  -5.541
  133    HG   SER  19           HG       SER  19  -6.671  13.171  -6.881
  134    H    VAL  20           H        VAL  20  -6.868  11.567  -4.667
  135    HA   VAL  20           HA       VAL  20  -8.636  10.906  -2.427
  136    HB   VAL  20           HB       VAL  20  -9.221   8.927  -3.767
  137   1HG1  VAL  20          1HG2      VAL  20  -7.106   9.822  -5.768
  138   2HG1  VAL  20          2HG2      VAL  20  -7.055   8.353  -4.769
  139   3HG1  VAL  20          3HG2      VAL  20  -8.309   8.540  -5.997
  140   1HG2  VAL  20          1HG1      VAL  20 -10.217  10.088  -5.671
  141   2HG2  VAL  20          2HG1      VAL  20  -9.103  11.451  -5.476
  142   3HG2  VAL  20          3HG1      VAL  20 -10.316  11.103  -4.224
  143    HA   PRO  21           HA       PRO  21  -5.928   8.448  -0.031
  144   1HB   PRO  21          2HB       PRO  21  -7.868   6.166  -0.411
  145   2HB   PRO  21          1HB       PRO  21  -7.059   6.653   1.105
  146   1HG   PRO  21          1HG       PRO  21  -9.590   7.246   0.488
  147   2HG   PRO  21          2HG       PRO  21  -8.586   8.460   1.361
  148   1HD   PRO  21          1HD       PRO  21  -9.552   8.573  -1.448
  149   2HD   PRO  21          2HD       PRO  21  -8.930   9.869  -0.407
  150    H    VAL  22           H        VAL  22  -4.568   6.600   0.095
  151    HA   VAL  22           HA       VAL  22  -4.079   5.150  -2.463
  152    HB   VAL  22           HB       VAL  22  -1.942   6.779  -1.007
  153   1HG1  VAL  22          1HG1      VAL  22  -0.628   6.293  -3.060
  154   2HG1  VAL  22          2HG1      VAL  22  -1.956   5.305  -3.664
  155   3HG1  VAL  22          3HG1      VAL  22  -1.084   4.828  -2.182
  156   1HG2  VAL  22          1HG2      VAL  22  -3.365   8.424  -2.018
  157   2HG2  VAL  22          2HG2      VAL  22  -3.497   7.489  -3.525
  158   3HG2  VAL  22          3HG2      VAL  22  -1.959   8.225  -3.063
  159    H    LEU  23           H        LEU  23  -3.537   3.096  -2.062
  160    HA   LEU  23           HA       LEU  23  -2.760   2.196   0.686
  161   1HB   LEU  23          1HB       LEU  23  -4.864   1.319  -0.219
  162   2HB   LEU  23          2HB       LEU  23  -4.037   0.653  -1.619
  163    HG   LEU  23           HG       LEU  23  -3.549  -0.128   1.293
  164   1HD1  LEU  23          1HD2      LEU  23  -1.554  -0.767   0.074
  165   2HD1  LEU  23          2HD2      LEU  23  -2.539  -2.215   0.172
  166   3HD1  LEU  23          3HD2      LEU  23  -2.510  -1.279  -1.334
  167   1HD2  LEU  23          1HD1      LEU  23  -5.121  -1.536  -0.903
  168   2HD2  LEU  23          2HD1      LEU  23  -5.809  -0.731   0.523
  169   3HD2  LEU  23          3HD1      LEU  23  -4.810  -2.175   0.727
  170    H    VAL  24           H        VAL  24  -0.534   2.206   0.723
  171    HA   VAL  24           HA       VAL  24   0.981   1.378  -1.711
  172    HB   VAL  24           HB       VAL  24   1.960   2.495   0.946
  173   1HG1  VAL  24          1HG1      VAL  24   3.371   2.018  -1.723
  174   2HG1  VAL  24          2HG1      VAL  24   3.685   1.148  -0.207
  175   3HG1  VAL  24          3HG1      VAL  24   4.074   2.863  -0.332
  176   1HG2  VAL  24          1HG2      VAL  24   1.574   3.861  -1.744
  177   2HG2  VAL  24          2HG2      VAL  24   2.370   4.542  -0.308
  178   3HG2  VAL  24          3HG2      VAL  24   0.638   4.186  -0.264
  179    H    ASP  25           HN       ASP  25   1.691  -0.737  -1.811
  180    HA   ASP  25           HA       ASP  25   1.797  -2.351   0.708
  181   1HB   ASP  25          2HB       ASP  25   0.465  -3.396  -0.992
  182   2HB   ASP  25          1HB       ASP  25   1.705  -3.095  -2.212
  183    H    PHE  26           H        PHE  26   3.801  -2.343   1.651
  184    HA   PHE  26           HA       PHE  26   6.213  -1.679   0.050
  185   1HB   PHE  26          2HB       PHE  26   5.757  -2.477   2.948
  186   2HB   PHE  26          1HB       PHE  26   7.343  -2.307   2.220
  187    HD1  PHE  26           HD1      PHE  26   4.148  -0.226   2.357
  188    HD2  PHE  26           HD2      PHE  26   8.454  -0.339   2.735
  189    HE1  PHE  26           HE1      PHE  26   4.172   2.175   2.886
  190    HE2  PHE  26           HE2      PHE  26   8.442   2.037   3.394
  191    HZ   PHE  26           HZ       PHE  26   6.281   3.297   3.510
  192    H    TRP  27           H        TRP  27   6.972  -3.243  -1.254
  193    HA   TRP  27           HA       TRP  27   6.684  -6.117  -0.396
  194   1HB   TRP  27          2HB       TRP  27   6.036  -6.775  -2.563
  195   2HB   TRP  27          1HB       TRP  27   4.986  -5.436  -2.150
  196    HD1  TRP  27           HD1      TRP  27   5.930  -3.005  -3.198
  197    HE1  TRP  27           HE1      TRP  27   7.200  -2.457  -5.394
  198    HE3  TRP  27           HE3      TRP  27   7.376  -7.791  -4.604
  199    HZ2  TRP  27           HZ2      TRP  27   8.821  -3.910  -7.294
  200    HZ3  TRP  27           HZ3      TRP  27   8.299  -8.106  -6.795
  201    HH2  TRP  27           HH2      TRP  27   9.210  -6.234  -8.079
  202    H    ALA  28           H        ALA  28   7.973  -7.389  -2.199
  203    HA   ALA  28           HA       ALA  28  10.207  -6.163  -3.442
  204   1HB   ALA  28          1HB       ALA  28  10.849  -7.993  -1.108
  205   2HB   ALA  28          2HB       ALA  28  12.002  -7.363  -2.304
  206   3HB   ALA  28          3HB       ALA  28  11.202  -6.239  -1.180
  207    HA   PRO  29           HA       PRO  29   9.184  -9.749  -5.993
  208   1HB   PRO  29          2HB       PRO  29  12.138  -9.802  -5.867
  209   2HB   PRO  29          1HB       PRO  29  11.155 -10.371  -7.251
  210   1HG   PRO  29          1HG       PRO  29  12.306  -7.890  -7.232
  211   2HG   PRO  29          2HG       PRO  29  10.554  -7.960  -7.569
  212   1HD   PRO  29          2HD       PRO  29  11.966  -7.259  -4.973
  213   2HD   PRO  29          1HD       PRO  29  10.490  -6.590  -5.612
  214    H    TRP  30           H        TRP  30  11.974 -10.615  -3.850
  215    HA   TRP  30           HA       TRP  30  11.420 -13.384  -3.850
  216   1HB   TRP  30          2HB       TRP  30  12.797 -13.390  -1.770
  217   2HB   TRP  30          1HB       TRP  30  13.531 -12.541  -3.123
  218    HD1  TRP  30           HD1      TRP  30  14.288 -10.126  -2.745
  219    HE1  TRP  30           HE1      TRP  30  14.172  -8.419  -0.807
  220    HE3  TRP  30           HE3      TRP  30  11.211 -12.685   0.465
  221    HZ2  TRP  30           HZ2      TRP  30  12.846  -8.152   1.701
  222    HZ3  TRP  30           HZ3      TRP  30  10.439 -11.617   2.555
  223    HH2  TRP  30           HH2      TRP  30  11.180  -9.321   3.145
  224    H    CYS  31           H        CYS  31   9.636 -10.859  -2.345
  225    HA   CYS  31           HA       CYS  31   8.795 -12.302   0.057
  226   1HB   CYS  31          2HB       CYS  31   8.931  -9.855   0.007
  227   2HB   CYS  31          1HB       CYS  31   7.690  -9.825  -1.258
  228    H    GLY  32           H        GLY  32   8.087 -14.282  -0.930
  229   1HA   GLY  32          2HA       GLY  32   6.101 -14.874  -2.656
  230   2HA   GLY  32          1HA       GLY  32   6.220 -15.713  -1.110
  231    HA   PRO  33           HA       PRO  33   2.461 -14.105   0.383
  232   1HB   PRO  33          2HB       PRO  33   3.589 -12.113   2.279
  233   2HB   PRO  33          1HB       PRO  33   2.435 -13.427   2.592
  234   1HG   PRO  33          1HG       PRO  33   5.028 -13.686   3.354
  235   2HG   PRO  33          2HG       PRO  33   4.161 -15.060   2.601
  236   1HD   PRO  33          2HD       PRO  33   6.043 -13.099   1.274
  237   2HD   PRO  33          1HD       PRO  33   6.030 -14.874   1.168
  238    H    CYS  34           H        CYS  34   4.778 -11.504  -0.397
  239    HA   CYS  34           HA       CYS  34   2.849  -9.398  -0.855
  240   1HB   CYS  34          1HB       CYS  34   5.510  -9.576  -2.139
  241   2HB   CYS  34          2HB       CYS  34   4.459  -8.229  -1.867
  242    H    ARG  35           HN       ARG  35   4.714 -11.766  -2.897
  243    HA   ARG  35           HA       ARG  35   3.696 -10.971  -5.396
  244   1HB   ARG  35          2HB       ARG  35   4.561 -13.749  -4.440
  245   2HB   ARG  35          1HB       ARG  35   4.208 -13.286  -6.097
  246   1HG   ARG  35          2HG       ARG  35   6.017 -11.467  -5.835
  247   2HG   ARG  35          1HG       ARG  35   6.520 -12.347  -4.386
  248   1HD   ARG  35          1HD       ARG  35   6.303 -13.443  -7.232
  249   2HD   ARG  35          2HD       ARG  35   7.804 -13.073  -6.409
  250    HE   ARG  35           HE       ARG  35   6.140 -15.441  -6.147
  251   1HH1  ARG  35          2HH1      ARG  35   8.529 -13.471  -4.463
  252   2HH1  ARG  35          1HH1      ARG  35   9.041 -14.728  -3.371
  253   1HH2  ARG  35          1HH2      ARG  35   6.899 -17.163  -4.862
  254   2HH2  ARG  35          2HH2      ARG  35   8.169 -16.907  -3.695
  255    H    ILE  36           H        ILE  36   2.399 -13.441  -3.100
  256    HA   ILE  36           HA       ILE  36   0.186 -13.995  -4.929
  257    HB   ILE  36           HB       ILE  36  -0.659 -15.513  -3.241
  258   1HG1  ILE  36          2HG1      ILE  36   1.061 -15.950  -1.281
  259   2HG1  ILE  36          1HG1      ILE  36   1.408 -14.237  -1.468
  260   1HG2  ILE  36          1HG2      ILE  36   1.202 -17.068  -3.330
  261   2HG2  ILE  36          2HG2      ILE  36   2.360 -15.755  -3.604
  262   3HG2  ILE  36          3HG2      ILE  36   1.145 -16.147  -4.838
  263   1HD1  ILE  36          1HD1      ILE  36  -1.315 -15.503  -0.892
  264   2HD1  ILE  36          2HD1      ILE  36  -0.273 -14.697   0.294
  265   3HD1  ILE  36          3HD1      ILE  36  -1.028 -13.757  -0.997
  266    H    ILE  37           H        ILE  37   0.466 -11.799  -2.042
  267    HA   ILE  37           HA       ILE  37  -2.373 -11.334  -2.218
  268    HB   ILE  37           HB       ILE  37  -0.724 -11.254  -0.157
  269   1HG1  ILE  37          1HG1      ILE  37  -2.277  -9.733   1.016
  270   2HG1  ILE  37          2HG1      ILE  37  -3.051  -9.333  -0.527
  271   1HG2  ILE  37          1HG2      ILE  37   0.045  -9.086   0.495
  272   2HG2  ILE  37          2HG2      ILE  37   0.662  -9.378  -1.137
  273   3HG2  ILE  37          3HG2      ILE  37  -0.721  -8.297  -0.891
  274   1HD1  ILE  37          1HD1      ILE  37  -3.857 -11.612  -0.776
  275   2HD1  ILE  37          2HD1      ILE  37  -4.120 -11.191   0.909
  276   3HD1  ILE  37          3HD1      ILE  37  -2.739 -12.207   0.465
  277    H    ALA  38           H        ALA  38   0.476  -9.495  -3.393
  278    HA   ALA  38           HA       ALA  38  -0.487  -7.115  -4.066
  279   1HB   ALA  38          1HB       ALA  38   0.879  -7.230  -6.165
  280   2HB   ALA  38          2HB       ALA  38   1.723  -7.777  -4.707
  281   3HB   ALA  38          3HB       ALA  38   1.124  -8.960  -5.884
  282    HA   PRO  39           HA       PRO  39  -2.892  -8.427  -8.059
  283   1HB   PRO  39          1HB       PRO  39  -3.902 -11.155  -7.379
  284   2HB   PRO  39          2HB       PRO  39  -3.276 -10.552  -8.937
  285   1HG   PRO  39          1HG       PRO  39  -1.798 -12.258  -7.392
  286   2HG   PRO  39          2HG       PRO  39  -1.012 -10.881  -8.229
  287   1HD   PRO  39          1HD       PRO  39  -2.070 -10.939  -5.382
  288   2HD   PRO  39          2HD       PRO  39  -0.414 -10.536  -5.920
  289    H    VAL  40           H        VAL  40  -3.679  -9.665  -4.843
  290    HA   VAL  40           HA       VAL  40  -6.538  -9.261  -5.006
  291    HB   VAL  40           HB       VAL  40  -4.798  -9.621  -2.518
  292   1HG1  VAL  40          1HG1      VAL  40  -6.817 -10.538  -1.562
  293   2HG1  VAL  40          2HG1      VAL  40  -7.698 -10.208  -3.076
  294   3HG1  VAL  40          3HG1      VAL  40  -7.064  -8.863  -2.091
  295   1HG2  VAL  40          1HG2      VAL  40  -4.330 -11.523  -4.033
  296   2HG2  VAL  40          2HG2      VAL  40  -6.068 -11.719  -4.340
  297   3HG2  VAL  40          3HG2      VAL  40  -5.397 -12.048  -2.731
  298    H    VAL  41           H        VAL  41  -3.718  -7.576  -3.590
  299    HA   VAL  41           HA       VAL  41  -5.072  -5.321  -2.502
  300    HB   VAL  41           HB       VAL  41  -2.323  -5.331  -3.856
  301   1HG1  VAL  41          1HG1      VAL  41  -1.366  -5.734  -1.635
  302   2HG1  VAL  41          2HG1      VAL  41  -2.994  -5.964  -0.955
  303   3HG1  VAL  41          3HG1      VAL  41  -2.346  -7.093  -2.150
  304   1HG2  VAL  41          1HG2      VAL  41  -3.283  -3.061  -3.318
  305   2HG2  VAL  41          2HG2      VAL  41  -1.825  -3.444  -2.400
  306   3HG2  VAL  41          3HG2      VAL  41  -3.426  -3.568  -1.633
  307    H    ASP  42           HN       ASP  42  -3.642  -5.848  -5.708
  308    HA   ASP  42           HA       ASP  42  -4.355  -3.451  -6.981
  309   1HB   ASP  42          1HB       ASP  42  -4.125  -6.234  -8.208
  310   2HB   ASP  42          2HB       ASP  42  -4.038  -4.707  -9.085
  311    H    GLU  43           HN       GLU  43  -6.149  -6.626  -7.119
  312    HA   GLU  43           HA       GLU  43  -8.169  -5.578  -8.762
  313   1HB   GLU  43          1HB       GLU  43  -9.279  -7.525  -8.525
  314   2HB   GLU  43          2HB       GLU  43  -7.639  -8.051  -8.165
  315   1HG   GLU  43          2HG       GLU  43  -8.284  -7.901  -5.688
  316   2HG   GLU  43          1HG       GLU  43  -9.946  -7.585  -6.207
  317    H    ILE  44           H        ILE  44  -8.104  -5.863  -5.148
  318    HA   ILE  44           HA       ILE  44 -10.690  -4.860  -4.660
  319    HB   ILE  44           HB       ILE  44  -8.100  -4.563  -3.075
  320   1HG1  ILE  44          2HG1      ILE  44 -10.538  -6.345  -2.619
  321   2HG1  ILE  44          1HG1      ILE  44  -9.118  -6.889  -3.493
  322   1HG2  ILE  44          1HG2      ILE  44 -10.971  -3.933  -2.232
  323   2HG2  ILE  44          2HG2      ILE  44  -9.577  -3.970  -1.134
  324   3HG2  ILE  44          3HG2      ILE  44  -9.651  -2.755  -2.390
  325   1HD1  ILE  44          1HD1      ILE  44  -9.136  -6.014  -0.576
  326   2HD1  ILE  44          2HD1      ILE  44  -7.689  -6.442  -1.516
  327   3HD1  ILE  44          3HD1      ILE  44  -8.951  -7.647  -1.202
  328    H    ALA  45           H        ALA  45  -7.602  -3.026  -4.954
  329    HA   ALA  45           HA       ALA  45  -8.800  -0.439  -4.753
  330   1HB   ALA  45          1HB       ALA  45  -6.661   0.333  -5.609
  331   2HB   ALA  45          2HB       ALA  45  -6.447  -0.946  -4.401
  332   3HB   ALA  45          3HB       ALA  45  -6.255  -1.321  -6.138
  333    H    GLY  46           H        GLY  46  -8.417  -2.666  -7.531
  334   1HA   GLY  46          1HA       GLY  46  -8.951  -0.774  -9.622
  335   2HA   GLY  46          2HA       GLY  46  -9.125  -2.541  -9.681
  336    H    GLU  47           HN       GLU  47 -10.947  -2.943  -7.573
  337    HA   GLU  47           HA       GLU  47 -13.468  -2.277  -8.812
  338   1HB   GLU  47          2HB       GLU  47 -12.980  -3.268  -5.963
  339   2HB   GLU  47          1HB       GLU  47 -14.480  -3.287  -6.888
  340   1HG   GLU  47          2HG       GLU  47 -12.932  -4.669  -8.636
  341   2HG   GLU  47          1HG       GLU  47 -12.014  -4.993  -7.170
  342    H    TYR  48           H        TYR  48 -11.842  -1.180  -5.860
  343    HA   TYR  48           HA       TYR  48 -13.804   0.961  -5.374
  344   1HB   TYR  48          1HB       TYR  48 -11.216   0.253  -3.960
  345   2HB   TYR  48          2HB       TYR  48 -12.439   1.389  -3.390
  346    HD1  TYR  48           HD1      TYR  48 -11.792  -0.353  -1.413
  347    HD2  TYR  48           HD2      TYR  48 -14.455  -1.182  -4.718
  348    HE1  TYR  48           HE1      TYR  48 -12.922  -2.125  -0.107
  349    HE2  TYR  48           HE2      TYR  48 -15.347  -3.111  -3.526
  350    HH   TYR  48           HH       TYR  48 -15.055  -3.303  -0.085
  351    H    LYS  49           HN       LYS  49 -13.174   1.530  -7.661
  352    HA   LYS  49           HA       LYS  49 -10.946   2.797  -8.593
  353   1HB   LYS  49          2HB       LYS  49 -13.866   3.459  -9.126
  354   2HB   LYS  49          1HB       LYS  49 -12.506   4.093 -10.075
  355   1HG   LYS  49          2HG       LYS  49 -11.793   1.800 -10.638
  356   2HG   LYS  49          1HG       LYS  49 -13.112   1.144  -9.655
  357   1HD   LYS  49          2HD       LYS  49 -14.793   2.119 -11.120
  358   2HD   LYS  49          1HD       LYS  49 -13.540   2.927 -12.081
  359   1HE   LYS  49          1HE       LYS  49 -14.361   0.841 -13.165
  360   2HE   LYS  49          2HE       LYS  49 -12.626   0.779 -12.812
  361   1HZ   LYS  49          1HZ       LYS  49 -13.081  -0.546 -10.911
  362   2HZ   LYS  49          2HZ       LYS  49 -14.712  -0.440 -11.141
  363   3HZ   LYS  49          3HZ       LYS  49 -13.773  -1.244 -12.232
  364    H    ASP  50           HN       ASP  50 -13.685   4.660  -7.353
  365    HA   ASP  50           HA       ASP  50 -12.601   7.193  -7.365
  366   1HB   ASP  50          2HB       ASP  50 -14.962   6.666  -6.946
  367   2HB   ASP  50          1HB       ASP  50 -14.569   5.952  -5.387
  368    H    LYS  51           HN       LYS  51 -12.819   5.158  -4.495
  369    HA   LYS  51           HA       LYS  51 -11.567   7.141  -2.873
  370   1HB   LYS  51          1HB       LYS  51 -12.123   4.252  -2.230
  371   2HB   LYS  51          2HB       LYS  51 -11.810   5.524  -1.051
  372   1HG   LYS  51          1HG       LYS  51 -13.821   6.741  -1.795
  373   2HG   LYS  51          2HG       LYS  51 -14.242   5.443  -2.908
  374   1HD   LYS  51          2HD       LYS  51 -13.942   5.051   0.118
  375   2HD   LYS  51          1HD       LYS  51 -15.450   5.453  -0.701
  376   1HE   LYS  51          2HE       LYS  51 -15.630   3.172  -0.452
  377   2HE   LYS  51          1HE       LYS  51 -15.078   3.309  -2.128
  378   1HZ   LYS  51          1HZ       LYS  51 -13.446   2.702   0.253
  379   2HZ   LYS  51          2HZ       LYS  51 -12.859   2.773  -1.289
  380   3HZ   LYS  51          3HZ       LYS  51 -13.950   1.614  -0.869
  381    H    LEU  52           H        LEU  52 -10.285   3.883  -3.754
  382    HA   LEU  52           HA       LEU  52  -7.780   4.812  -2.320
  383   1HB   LEU  52          1HB       LEU  52  -9.302   3.329  -1.079
  384   2HB   LEU  52          2HB       LEU  52  -9.006   2.059  -2.278
  385    HG   LEU  52           HG       LEU  52  -6.628   2.012  -1.648
  386   1HD1  LEU  52          1HD2      LEU  52  -5.845   3.261   0.391
  387   2HD1  LEU  52          2HD2      LEU  52  -7.342   4.188   0.364
  388   3HD1  LEU  52          3HD2      LEU  52  -6.170   4.308  -0.981
  389   1HD2  LEU  52          1HD1      LEU  52  -8.318   0.691  -0.339
  390   2HD2  LEU  52          2HD1      LEU  52  -8.578   2.098   0.720
  391   3HD2  LEU  52          3HD1      LEU  52  -7.029   1.252   0.759
  392    H    LYS  53           HN       LYS  53  -6.078   5.015  -3.509
  393    HA   LYS  53           HA       LYS  53  -5.803   3.546  -6.051
  394   1HB   LYS  53          1HB       LYS  53  -5.510   6.038  -5.669
  395   2HB   LYS  53          2HB       LYS  53  -4.016   5.691  -4.826
  396   1HG   LYS  53          1HG       LYS  53  -4.459   4.625  -7.646
  397   2HG   LYS  53          2HG       LYS  53  -4.067   6.334  -7.388
  398   1HD   LYS  53          1HD       LYS  53  -1.971   5.757  -6.283
  399   2HD   LYS  53          2HD       LYS  53  -2.392   4.040  -6.328
  400   1HE   LYS  53          1HE       LYS  53  -0.792   4.541  -8.086
  401   2HE   LYS  53          2HE       LYS  53  -2.331   4.012  -8.777
  402   1HZ   LYS  53          1HZ       LYS  53  -2.845   6.313  -9.199
  403   2HZ   LYS  53          2HZ       LYS  53  -1.425   6.801  -8.518
  404   3HZ   LYS  53          3HZ       LYS  53  -1.413   5.911  -9.905
  405    H    CYS  54           H        CYS  54  -4.780   1.625  -6.116
  406    HA   CYS  54           HA       CYS  54  -3.095   0.777  -3.850
  407   1HB   CYS  54          1HB       CYS  54  -4.255  -1.043  -4.679
  408   2HB   CYS  54          2HB       CYS  54  -4.035  -0.574  -6.381
  409    HG   CYS  54           HG       CYS  54  -2.700  -2.771  -5.982
  410    H    VAL  55           H        VAL  55  -0.886   0.541  -3.798
  411    HA   VAL  55           HA       VAL  55   0.654   0.912  -6.238
  412    HB   VAL  55           HB       VAL  55   1.992   2.525  -4.244
  413   1HG1  VAL  55          1HG1      VAL  55  -0.200   3.074  -3.295
  414   2HG1  VAL  55          2HG1      VAL  55  -0.754   3.626  -4.893
  415   3HG1  VAL  55          3HG1      VAL  55   0.579   4.456  -4.091
  416   1HG2  VAL  55          1HG2      VAL  55   1.885   4.184  -6.086
  417   2HG2  VAL  55          2HG2      VAL  55   0.733   3.140  -6.941
  418   3HG2  VAL  55          3HG2      VAL  55   2.392   2.574  -6.649
  419    H    LYS  56           HN       LYS  56   2.949   0.464  -5.842
  420    HA   LYS  56           HA       LYS  56   3.378  -1.428  -3.587
  421   1HB   LYS  56          2HB       LYS  56   3.418  -1.812  -6.559
  422   2HB   LYS  56          1HB       LYS  56   4.503  -2.780  -5.551
  423   1HG   LYS  56          1HG       LYS  56   2.700  -3.656  -4.231
  424   2HG   LYS  56          2HG       LYS  56   1.504  -2.610  -5.009
  425   1HD   LYS  56          1HD       LYS  56   3.123  -4.748  -6.443
  426   2HD   LYS  56          2HD       LYS  56   1.494  -4.964  -5.763
  427   1HE   LYS  56          1HE       LYS  56   0.680  -3.059  -7.219
  428   2HE   LYS  56          2HE       LYS  56   2.260  -3.054  -8.024
  429   1HZ   LYS  56          1HZ       LYS  56   0.328  -5.261  -7.951
  430   2HZ   LYS  56          2HZ       LYS  56   0.725  -4.330  -9.240
  431   3HZ   LYS  56          3HZ       LYS  56   1.841  -5.365  -8.609
  432    H    LEU  57           H        LEU  57   5.131  -0.828  -2.534
  433    HA   LEU  57           HA       LEU  57   7.221   0.860  -3.876
  434   1HB   LEU  57          2HB       LEU  57   6.173   1.734  -1.745
  435   2HB   LEU  57          1HB       LEU  57   6.843   0.329  -0.945
  436    HG   LEU  57           HG       LEU  57   9.069   1.397  -2.155
  437   1HD1  LEU  57          1HD2      LEU  57   9.483   2.331   0.178
  438   2HD1  LEU  57          2HD2      LEU  57   7.784   2.011   0.534
  439   3HD1  LEU  57          3HD2      LEU  57   8.890   0.659   0.181
  440   1HD2  LEU  57          1HD1      LEU  57   8.976   3.832  -1.741
  441   2HD2  LEU  57          2HD1      LEU  57   7.728   3.377  -2.923
  442   3HD2  LEU  57          3HD1      LEU  57   7.290   3.707  -1.235
  443    H    ASN  58           H        ASN  58   8.995  -0.250  -4.582
  444    HA   ASN  58           HA       ASN  58   9.552  -2.924  -3.521
  445   1HB   ASN  58          1HB       ASN  58  10.122  -2.380  -5.846
  446   2HB   ASN  58          2HB       ASN  58  11.258  -1.145  -5.302
  447   1HD2  ASN  58          2HD2      ASN  58  11.149  -4.273  -6.397
  448   2HD2  ASN  58          1HD2      ASN  58  12.597  -4.887  -5.612
  449    H    THR  59           H        THR  59  10.197  -3.152  -1.573
  450    HA   THR  59           HA       THR  59  11.031  -1.099   0.191
  451    HB   THR  59           HB       THR  59  11.215  -4.146   0.360
  452    HG1  THR  59           HG1      THR  59   9.138  -3.479   0.050
  453   1HG2  THR  59          1HG2      THR  59  11.357  -2.035   2.529
  454   2HG2  THR  59          2HG2      THR  59  12.628  -3.196   2.070
  455   3HG2  THR  59          3HG2      THR  59  11.126  -3.786   2.800
  456    H    ASP  60           HN       ASP  60  12.847  -3.510  -1.657
  457    HA   ASP  60           HA       ASP  60  15.380  -3.186  -0.280
  458   1HB   ASP  60          2HB       ASP  60  14.797  -5.243  -1.361
  459   2HB   ASP  60          1HB       ASP  60  14.399  -4.430  -2.854
  460    H    GLU  61           HN       GLU  61  13.807  -1.818  -3.119
  461    HA   GLU  61           HA       GLU  61  16.049  -0.126  -3.909
  462   1HB   GLU  61          2HB       GLU  61  14.314  -1.225  -5.411
  463   2HB   GLU  61          1HB       GLU  61  13.131  -0.075  -4.753
  464   1HG   GLU  61          2HG       GLU  61  14.480   1.805  -5.662
  465   2HG   GLU  61          1HG       GLU  61  15.675   0.643  -6.243
  466    H    SER  62           H        SER  62  13.238   0.142  -1.847
  467    HA   SER  62           HA       SER  62  13.594   3.081  -1.440
  468   1HB   SER  62          2HB       SER  62  11.120   1.381  -1.130
  469   2HB   SER  62          1HB       SER  62  11.163   3.119  -1.186
  470    HG   SER  62           HG       SER  62  11.573   1.160  -3.164
  471    HA   PRO  63           HA       PRO  63  14.013   0.615   2.647
  472   1HB   PRO  63          1HB       PRO  63  16.647   1.075   3.216
  473   2HB   PRO  63          2HB       PRO  63  16.105  -0.297   2.195
  474   1HG   PRO  63          1HG       PRO  63  17.156   2.402   1.294
  475   2HG   PRO  63          2HG       PRO  63  17.631   0.783   0.700
  476   1HD   PRO  63          1HD       PRO  63  15.782   2.300  -0.621
  477   2HD   PRO  63          2HD       PRO  63  15.576   0.532  -0.483
  478    H    ASN  64           H        ASN  64  15.097   3.664   1.356
  479    HA   ASN  64           HA       ASN  64  15.515   5.261   3.613
  480   1HB   ASN  64          1HB       ASN  64  14.063   5.986   1.034
  481   2HB   ASN  64          2HB       ASN  64  14.679   7.155   2.212
  482   1HD2  ASN  64          1HD2      ASN  64  15.543   7.473  -0.354
  483   2HD2  ASN  64          2HD2      ASN  64  17.217   6.940  -0.477
  484    H    VAL  65           H        VAL  65  12.412   4.653   1.948
  485    HA   VAL  65           HA       VAL  65  10.786   6.101   3.783
  486    HB   VAL  65           HB       VAL  65  10.043   3.743   1.986
  487   1HG1  VAL  65          1HG2      VAL  65   8.328   4.337   3.679
  488   2HG1  VAL  65          2HG2      VAL  65   7.801   4.712   2.030
  489   3HG1  VAL  65          3HG2      VAL  65   8.357   6.016   3.109
  490   1HG2  VAL  65          1HG1      VAL  65  11.099   5.452   0.624
  491   2HG2  VAL  65          2HG1      VAL  65   9.347   5.529   0.382
  492   3HG2  VAL  65          3HG1      VAL  65  10.150   6.730   1.417
  493    H    ALA  66           H        ALA  66  11.300   2.618   3.400
  494    HA   ALA  66           HA       ALA  66   9.812   1.699   5.579
  495   1HB   ALA  66          1HB       ALA  66  11.219  -0.339   5.469
  496   2HB   ALA  66          2HB       ALA  66  10.737   0.226   3.857
  497   3HB   ALA  66          3HB       ALA  66  12.388   0.526   4.455
  498    H    SER  67           H        SER  67  13.265   2.687   5.619
  499    HA   SER  67           HA       SER  67  13.675   2.042   8.383
  500   1HB   SER  67          1HB       SER  67  15.714   3.434   8.172
  501   2HB   SER  67          2HB       SER  67  15.573   2.212   6.897
  502    HG   SER  67           HG       SER  67  14.859   3.833   5.488
  503    H    GLU  68           HN       GLU  68  12.971   5.136   6.728
  504    HA   GLU  68           HA       GLU  68  12.758   6.750   9.049
  505   1HB   GLU  68          2HB       GLU  68  11.330   6.849   6.356
  506   2HB   GLU  68          1HB       GLU  68  11.086   8.076   7.599
  507   1HG   GLU  68          2HG       GLU  68  13.842   7.353   6.493
  508   2HG   GLU  68          1HG       GLU  68  12.830   8.655   5.854
  509    H    TYR  69           H        TYR  69  10.337   4.628   7.542
  510    HA   TYR  69           HA       TYR  69   8.273   5.273   9.495
  511   1HB   TYR  69          1HB       TYR  69   8.593   3.485   7.115
  512   2HB   TYR  69          2HB       TYR  69   7.526   2.880   8.339
  513    HD1  TYR  69           HD1      TYR  69   7.939   5.353   5.704
  514    HD2  TYR  69           HD2      TYR  69   5.641   4.410   9.218
  515    HE1  TYR  69           HE1      TYR  69   6.240   7.035   5.042
  516    HE2  TYR  69           HE2      TYR  69   4.013   6.178   8.625
  517    HH   TYR  69           HH       TYR  69   3.468   7.839   7.137
  518    H    GLY  70           H        GLY  70  10.903   2.960   9.372
  519   1HA   GLY  70          1HA       GLY  70  11.823   1.829  11.161
  520   2HA   GLY  70          2HA       GLY  70  10.449   2.276  12.183
  521    H    ILE  71           H        ILE  71  10.406   0.627   8.968
  522    HA   ILE  71           HA       ILE  71   9.380  -1.854  10.252
  523    HB   ILE  71           HB       ILE  71   8.032  -2.051   8.169
  524   1HG1  ILE  71          1HG1      ILE  71   8.538   0.909   7.753
  525   2HG1  ILE  71          2HG1      ILE  71   9.396  -0.358   6.867
  526   1HG2  ILE  71          1HG2      ILE  71   6.210  -0.606   8.989
  527   2HG2  ILE  71          2HG2      ILE  71   7.372   0.420   9.849
  528   3HG2  ILE  71          3HG2      ILE  71   7.098  -1.254  10.368
  529   1HD1  ILE  71          1HD1      ILE  71   6.384  -0.001   6.827
  530   2HD1  ILE  71          2HD1      ILE  71   7.316  -1.224   5.936
  531   3HD1  ILE  71          3HD1      ILE  71   7.518   0.503   5.579
  532    H    ARG  72           HN       ARG  72   9.582  -3.690   8.645
  533    HA   ARG  72           HA       ARG  72  11.845  -3.570   6.791
  534   1HB   ARG  72          1HB       ARG  72  13.063  -3.781   8.863
  535   2HB   ARG  72          2HB       ARG  72  12.003  -5.069   9.448
  536   1HG   ARG  72          2HG       ARG  72  12.785  -6.610   7.729
  537   2HG   ARG  72          1HG       ARG  72  13.744  -5.329   6.955
  538   1HD   ARG  72          2HD       ARG  72  14.162  -6.394   9.783
  539   2HD   ARG  72          1HD       ARG  72  15.106  -6.871   8.352
  540    HE   ARG  72           HE       ARG  72  15.207  -4.065   8.506
  541   1HH1  ARG  72          2HH2      ARG  72  16.321  -6.850  10.363
  542   2HH1  ARG  72          1HH2      ARG  72  17.696  -6.030  11.050
  543   1HH2  ARG  72          1HH1      ARG  72  16.992  -2.969   9.394
  544   2HH2  ARG  72          2HH1      ARG  72  18.087  -3.777  10.481
  545    H    SER  73           H        SER  73   9.937  -5.935   8.805
  546    HA   SER  73           HA       SER  73   9.816  -7.906   6.845
  547   1HB   SER  73          2HB       SER  73   7.531  -7.436   8.743
  548   2HB   SER  73          1HB       SER  73   8.359  -8.948   8.332
  549    HG   SER  73           HG       SER  73  10.136  -8.258   9.563
  550    H    ILE  74           H        ILE  74   8.115  -8.517   5.402
  551    HA   ILE  74           HA       ILE  74   6.107  -6.530   4.690
  552    HB   ILE  74           HB       ILE  74   6.885  -6.810   2.226
  553   1HG1  ILE  74          1HG1      ILE  74   9.591  -7.360   3.470
  554   2HG1  ILE  74          2HG1      ILE  74   8.563  -8.618   2.757
  555   1HG2  ILE  74          1HG2      ILE  74   8.698  -5.175   4.055
  556   2HG2  ILE  74          2HG2      ILE  74   7.032  -4.715   3.660
  557   3HG2  ILE  74          3HG2      ILE  74   8.242  -4.818   2.385
  558   1HD1  ILE  74          1HD1      ILE  74   9.632  -6.164   1.294
  559   2HD1  ILE  74          2HD1      ILE  74   8.514  -7.373   0.615
  560   3HD1  ILE  74          3HD1      ILE  74  10.146  -7.837   1.093
  561    HA   PRO  75           HA       PRO  75   4.701  -6.688   2.434
  562   1HB   PRO  75          2HB       PRO  75   1.993  -7.111   2.433
  563   2HB   PRO  75          1HB       PRO  75   3.131  -7.738   1.228
  564   1HG   PRO  75          1HG       PRO  75   1.981  -9.120   3.662
  565   2HG   PRO  75          2HG       PRO  75   2.148  -9.801   2.017
  566   1HD   PRO  75          1HD       PRO  75   3.931 -10.334   4.052
  567   2HD   PRO  75          2HD       PRO  75   4.468 -10.203   2.356
  568    H    THR  76           H        THR  76   4.006  -4.852   3.156
  569    HA   THR  76           HA       THR  76   2.659  -4.538   5.766
  570    HB   THR  76           HB       THR  76   5.378  -3.355   5.095
  571    HG1  THR  76           HG1      THR  76   5.924  -4.826   6.511
  572   1HG2  THR  76          1HG2      THR  76   5.070  -2.093   7.257
  573   2HG2  THR  76          2HG2      THR  76   3.347  -2.512   7.214
  574   3HG2  THR  76          3HG2      THR  76   4.052  -1.495   5.936
  575    H    ILE  77           H        ILE  77   0.873  -3.705   4.976
  576    HA   ILE  77           HA       ILE  77   0.834  -1.942   2.616
  577    HB   ILE  77           HB       ILE  77  -1.236  -3.413   4.263
  578   1HG1  ILE  77          2HG1      ILE  77  -1.976  -4.156   1.990
  579   2HG1  ILE  77          1HG1      ILE  77  -0.609  -3.291   1.278
  580   1HG2  ILE  77          1HG2      ILE  77  -2.975  -2.264   2.812
  581   2HG2  ILE  77          2HG2      ILE  77  -2.262  -1.256   4.066
  582   3HG2  ILE  77          3HG2      ILE  77  -1.712  -1.085   2.387
  583   1HD1  ILE  77          1HD1      ILE  77  -0.381  -5.557   3.316
  584   2HD1  ILE  77          2HD1      ILE  77   0.955  -4.807   2.410
  585   3HD1  ILE  77          3HD1      ILE  77  -0.264  -5.756   1.555
  586    H    MET  78           H        MET  78   0.569   0.283   2.868
  587    HA   MET  78           HA       MET  78  -0.152   1.387   5.544
  588   1HB   MET  78          1HB       MET  78   2.024   2.335   3.661
  589   2HB   MET  78          2HB       MET  78   1.367   3.294   5.000
  590   1HG   MET  78          2HG       MET  78   1.926   1.434   6.569
  591   2HG   MET  78          1HG       MET  78   2.771   0.621   5.256
  592   1HE   MET  78          1HE       MET  78   3.601   1.974   8.424
  593   2HE   MET  78          2HE       MET  78   4.274   0.597   7.533
  594   3HE   MET  78          3HE       MET  78   5.329   1.950   8.012
  595    H    VAL  79           H        VAL  79  -1.874   2.628   5.380
  596    HA   VAL  79           HA       VAL  79  -2.822   3.378   2.654
  597    HB   VAL  79           HB       VAL  79  -4.269   3.213   5.331
  598   1HG1  VAL  79          1HG1      VAL  79  -5.615   1.491   4.178
  599   2HG1  VAL  79          2HG1      VAL  79  -4.634   1.687   2.711
  600   3HG1  VAL  79          3HG1      VAL  79  -3.904   1.032   4.194
  601   1HG2  VAL  79          1HG2      VAL  79  -5.152   5.162   4.123
  602   2HG2  VAL  79          2HG2      VAL  79  -6.289   3.830   3.961
  603   3HG2  VAL  79          3HG2      VAL  79  -5.205   4.250   2.612
  604    H    PHE  80           H        PHE  80  -3.118   5.493   2.132
  605    HA   PHE  80           HA       PHE  80  -2.553   7.603   4.151
  606   1HB   PHE  80          2HB       PHE  80  -1.701   7.589   1.241
  607   2HB   PHE  80          1HB       PHE  80  -1.526   8.888   2.397
  608    HD1  PHE  80           HD1      PHE  80  -0.449   5.325   1.800
  609    HD2  PHE  80           HD2      PHE  80   0.493   9.120   3.634
  610    HE1  PHE  80           HE1      PHE  80   1.672   4.394   2.646
  611    HE2  PHE  80           HE2      PHE  80   2.619   8.184   4.463
  612    HZ   PHE  80           HZ       PHE  80   3.158   5.778   4.095
  613    H    LYS  81           HN       LYS  81  -3.518   9.591   3.594
  614    HA   LYS  81           HA       LYS  81  -5.894   9.537   1.814
  615   1HB   LYS  81          2HB       LYS  81  -7.491   9.839   3.500
  616   2HB   LYS  81          1HB       LYS  81  -6.523   8.454   3.979
  617   1HG   LYS  81          1HG       LYS  81  -6.684  11.199   5.220
  618   2HG   LYS  81          2HG       LYS  81  -6.926   9.618   5.952
  619   1HD   LYS  81          1HD       LYS  81  -4.426   9.194   5.625
  620   2HD   LYS  81          2HD       LYS  81  -4.277  10.901   5.147
  621   1HE   LYS  81          2HE       LYS  81  -5.362   9.912   7.826
  622   2HE   LYS  81          1HE       LYS  81  -3.726  10.515   7.539
  623   1HZ   LYS  81          1HZ       LYS  81  -5.117  12.218   8.406
  624   2HZ   LYS  81          2HZ       LYS  81  -4.674  12.606   6.866
  625   3HZ   LYS  81          3HZ       LYS  81  -6.196  12.055   7.172
  626    H    GLY  82           H        GLY  82  -3.559  10.963   1.488
  627   1HA   GLY  82          2HA       GLY  82  -3.429  13.211   0.622
  628   2HA   GLY  82          1HA       GLY  82  -4.556  13.742   1.884
  629    H    GLY  83           H        GLY  83  -1.199  13.121   1.129
  630   1HA   GLY  83          2HA       GLY  83   0.696  13.759   2.195
  631   2HA   GLY  83          1HA       GLY  83  -0.281  14.682   3.333
  632    H    LYS  84           HN       LYS  84  -1.474  13.247   4.956
  633    HA   LYS  84           HA       LYS  84   0.629  11.734   6.359
  634   1HB   LYS  84          2HB       LYS  84  -2.212  12.392   7.209
  635   2HB   LYS  84          1HB       LYS  84  -0.927  11.792   8.257
  636   1HG   LYS  84          2HG       LYS  84  -0.979  14.506   6.851
  637   2HG   LYS  84          1HG       LYS  84  -1.275  14.185   8.562
  638   1HD   LYS  84          2HD       LYS  84   1.063  13.263   8.761
  639   2HD   LYS  84          1HD       LYS  84   1.361  13.752   7.078
  640   1HE   LYS  84          1HE       LYS  84   0.848  16.110   7.666
  641   2HE   LYS  84          2HE       LYS  84   0.576  15.629   9.353
  642   1HZ   LYS  84          1HZ       LYS  84   3.097  15.341   7.877
  643   2HZ   LYS  84          2HZ       LYS  84   2.764  16.483   9.017
  644   3HZ   LYS  84          3HZ       LYS  84   2.844  14.894   9.444
  645    H    LYS  85           HN       LYS  85   0.155   9.789   7.471
  646    HA   LYS  85           HA       LYS  85  -1.001   7.734   5.715
  647   1HB   LYS  85          2HB       LYS  85   1.287   7.527   6.802
  648   2HB   LYS  85          1HB       LYS  85   0.447   7.430   8.360
  649   1HG   LYS  85          2HG       LYS  85  -0.815   5.401   7.419
  650   2HG   LYS  85          1HG       LYS  85   0.169   5.559   5.960
  651   1HD   LYS  85          2HD       LYS  85   1.023   3.805   7.364
  652   2HD   LYS  85          1HD       LYS  85   2.211   5.110   7.280
  653   1HE   LYS  85          2HE       LYS  85   1.530   5.886   9.540
  654   2HE   LYS  85          1HE       LYS  85   0.200   4.713   9.565
  655   1HZ   LYS  85          1HZ       LYS  85   3.059   4.060   9.468
  656   2HZ   LYS  85          2HZ       LYS  85   2.094   3.982  10.802
  657   3HZ   LYS  85          3HZ       LYS  85   1.821   2.973   9.529
  658    H    CYS  86           H        CYS  86  -2.739   6.462   6.404
  659    HA   CYS  86           HA       CYS  86  -4.507   7.564   8.523
  660   1HB   CYS  86          2HB       CYS  86  -5.525   7.076   6.345
  661   2HB   CYS  86          1HB       CYS  86  -4.922   5.418   6.390
  662    HG   CYS  86           HG       CYS  86  -6.978   6.913   8.493
  663    H    GLU  87           HN       GLU  87  -3.585   4.292   7.428
  664    HA   GLU  87           HA       GLU  87  -2.683   3.435  10.073
  665   1HB   GLU  87          1HB       GLU  87  -5.167   2.350   8.690
  666   2HB   GLU  87          2HB       GLU  87  -4.354   1.478   9.998
  667   1HG   GLU  87          1HG       GLU  87  -5.702   4.186  10.252
  668   2HG   GLU  87          2HG       GLU  87  -6.330   2.640  10.803
  669    H    THR  88           H        THR  88  -2.452   0.769   9.724
  670    HA   THR  88           HA       THR  88  -1.278   0.225   7.103
  671    HB   THR  88           HB       THR  88   0.542   1.272   8.374
  672    HG1  THR  88           HG1      THR  88   1.002  -0.722   7.187
  673   1HG2  THR  88          1HG2      THR  88   1.376   0.312  10.498
  674   2HG2  THR  88          2HG2      THR  88  -0.003  -0.798  10.552
  675   3HG2  THR  88          3HG2      THR  88  -0.259   0.957  10.687
  676    H    ILE  89           H        ILE  89  -0.636  -2.139   6.960
  677    HA   ILE  89           HA       ILE  89  -1.991  -3.933   8.867
  678    HB   ILE  89           HB       ILE  89  -2.365  -4.335   5.871
  679   1HG1  ILE  89          2HG1      ILE  89  -4.390  -3.033   7.728
  680   2HG1  ILE  89          1HG1      ILE  89  -3.517  -2.213   6.418
  681   1HG2  ILE  89          1HG2      ILE  89  -2.541  -6.282   7.444
  682   2HG2  ILE  89          2HG2      ILE  89  -3.863  -5.444   8.282
  683   3HG2  ILE  89          3HG2      ILE  89  -4.039  -5.956   6.590
  684   1HD1  ILE  89          1HD1      ILE  89  -5.555  -4.424   6.047
  685   2HD1  ILE  89          2HD1      ILE  89  -5.678  -2.722   5.584
  686   3HD1  ILE  89          3HD1      ILE  89  -4.512  -3.774   4.761
  687    H    ILE  90           H        ILE  90  -0.732  -5.921   8.977
  688    HA   ILE  90           HA       ILE  90   1.696  -6.011   7.234
  689    HB   ILE  90           HB       ILE  90   1.516  -6.615  10.213
  690   1HG1  ILE  90          2HG1      ILE  90   2.919  -4.374   8.677
  691   2HG1  ILE  90          1HG1      ILE  90   1.511  -4.184   9.730
  692   1HG2  ILE  90          1HG2      ILE  90   3.888  -6.716   8.283
  693   2HG2  ILE  90          2HG2      ILE  90   3.953  -7.032  10.030
  694   3HG2  ILE  90          3HG2      ILE  90   3.079  -8.132   8.986
  695   1HD1  ILE  90          1HD1      ILE  90   4.324  -4.912  10.595
  696   2HD1  ILE  90          2HD1      ILE  90   3.388  -3.462  10.972
  697   3HD1  ILE  90          3HD1      ILE  90   2.895  -5.024  11.657
  698    H    GLY  91           H        GLY  91   2.109  -7.972   6.362
  699   1HA   GLY  91          2HA       GLY  91   2.047 -10.277   6.137
  700   2HA   GLY  91          1HA       GLY  91   0.825 -10.420   7.406
  701    H    ALA  92           H        ALA  92   0.795 -11.758   4.882
  702    HA   ALA  92           HA       ALA  92  -1.083 -10.440   3.074
  703   1HB   ALA  92          1HB       ALA  92   0.027 -13.275   3.217
  704   2HB   ALA  92          2HB       ALA  92   0.603 -11.941   2.185
  705   3HB   ALA  92          3HB       ALA  92  -1.000 -12.646   1.918
  706    H    VAL  93           H        VAL  93  -2.672  -9.978   4.829
  707    HA   VAL  93           HA       VAL  93  -4.113 -12.221   5.971
  708    HB   VAL  93           HB       VAL  93  -5.645 -10.571   6.861
  709   1HG1  VAL  93          1HG2      VAL  93  -5.938  -9.046   4.996
  710   2HG1  VAL  93          2HG2      VAL  93  -5.378  -8.143   6.398
  711   3HG1  VAL  93          3HG2      VAL  93  -4.246  -8.523   5.083
  712   1HG2  VAL  93          1HG1      VAL  93  -4.119  -9.275   8.212
  713   2HG2  VAL  93          2HG1      VAL  93  -2.803  -9.494   7.048
  714   3HG2  VAL  93          3HG1      VAL  93  -3.433 -10.888   7.951
  715    HA   PRO  94           HA       PRO  94  -6.772 -13.264   2.636
  716   1HB   PRO  94          2HB       PRO  94  -9.116 -12.969   4.513
  717   2HB   PRO  94          1HB       PRO  94  -8.784 -14.299   3.376
  718   1HG   PRO  94          1HG       PRO  94  -8.207 -14.610   6.016
  719   2HG   PRO  94          2HG       PRO  94  -7.019 -15.140   4.787
  720   1HD   PRO  94          1HD       PRO  94  -6.997 -12.600   6.426
  721   2HD   PRO  94          2HD       PRO  94  -5.662 -13.715   6.011
  722    H    LYS  95           HN       LYS  95  -8.217 -12.483   1.115
  723    HA   LYS  95           HA       LYS  95  -8.371  -9.823   0.502
  724   1HB   LYS  95          2HB       LYS  95  -8.850 -11.761  -0.997
  725   2HB   LYS  95          1HB       LYS  95 -10.366 -12.062  -0.140
  726   1HG   LYS  95          2HG       LYS  95 -11.116  -9.720  -0.884
  727   2HG   LYS  95          1HG       LYS  95  -9.693  -9.695  -1.927
  728   1HD   LYS  95          2HD       LYS  95 -11.977 -11.722  -1.990
  729   2HD   LYS  95          1HD       LYS  95 -11.700 -10.407  -3.140
  730   1HE   LYS  95          1HE       LYS  95  -9.518 -11.474  -3.791
  731   2HE   LYS  95          2HE       LYS  95  -9.896 -12.840  -2.723
  732   1HZ   LYS  95          1HZ       LYS  95 -11.482 -11.972  -5.026
  733   2HZ   LYS  95          2HZ       LYS  95 -10.491 -13.284  -4.962
  734   3HZ   LYS  95          3HZ       LYS  95 -11.849 -13.234  -4.029
  735    H    ALA  96           H        ALA  96 -10.884 -11.762   2.122
  736    HA   ALA  96           HA       ALA  96 -12.850  -9.751   2.460
  737   1HB   ALA  96          1HB       ALA  96 -13.683 -11.183   4.301
  738   2HB   ALA  96          2HB       ALA  96 -13.264 -12.149   2.873
  739   3HB   ALA  96          3HB       ALA  96 -12.171 -12.116   4.275
  740    H    THR  97           H        THR  97 -10.067 -10.680   4.557
  741    HA   THR  97           HA       THR  97 -10.648  -8.834   6.644
  742    HB   THR  97           HB       THR  97  -7.913  -9.936   5.890
  743    HG1  THR  97           HG1      THR  97 -10.069 -11.227   7.207
  744   1HG2  THR  97          1HG2      THR  97  -9.257  -9.337   8.568
  745   2HG2  THR  97          2HG2      THR  97  -7.631 -10.010   8.346
  746   3HG2  THR  97          3HG2      THR  97  -7.986  -8.362   7.799
  747    H    ILE  98           H        ILE  98  -8.530  -8.682   3.713
  748    HA   ILE  98           HA       ILE  98  -7.427  -6.114   4.204
  749    HB   ILE  98           HB       ILE  98  -8.106  -7.450   1.535
  750   1HG1  ILE  98          1HG1      ILE  98  -5.515  -7.245   3.132
  751   2HG1  ILE  98          2HG1      ILE  98  -6.504  -8.692   2.888
  752   1HG2  ILE  98          1HG2      ILE  98  -6.540  -5.786   0.546
  753   2HG2  ILE  98          2HG2      ILE  98  -7.885  -4.952   1.294
  754   3HG2  ILE  98          3HG2      ILE  98  -6.327  -5.031   2.137
  755   1HD1  ILE  98          1HD1      ILE  98  -6.097  -8.535   0.425
  756   2HD1  ILE  98          2HD1      ILE  98  -4.906  -7.250   0.760
  757   3HD1  ILE  98          3HD1      ILE  98  -4.669  -8.866   1.424
  758    H    VAL  99           H        VAL  99 -10.375  -6.986   2.311
  759    HA   VAL  99           HA       VAL  99 -11.271  -4.374   1.754
  760    HB   VAL  99           HB       VAL  99 -12.726  -7.012   2.209
  761   1HG1  VAL  99          1HG1      VAL  99 -14.713  -5.888   1.114
  762   2HG1  VAL  99          2HG1      VAL  99 -13.911  -4.332   1.429
  763   3HG1  VAL  99          3HG1      VAL  99 -14.412  -5.378   2.773
  764   1HG2  VAL  99          1HG2      VAL  99 -11.293  -6.802   0.183
  765   2HG2  VAL  99          2HG2      VAL  99 -13.007  -6.925  -0.233
  766   3HG2  VAL  99          3HG2      VAL  99 -12.194  -5.348  -0.293
  767    H    GLN 100           H        GLN 100 -12.303  -6.478   4.480
  768    HA   GLN 100           HA       GLN 100 -13.963  -4.687   5.789
  769   1HB   GLN 100          1HB       GLN 100 -13.509  -7.121   6.231
  770   2HB   GLN 100          2HB       GLN 100 -12.057  -6.694   7.110
  771   1HG   GLN 100          2HG       GLN 100 -14.837  -5.614   7.781
  772   2HG   GLN 100          1HG       GLN 100 -14.232  -7.139   8.441
  773   1HE2  GLN 100          2HE2      GLN 100 -11.681  -6.754   9.204
  774   2HE2  GLN 100          1HE2      GLN 100 -11.591  -5.474  10.392
  775    H    THR 101           H        THR 101 -10.496  -5.174   6.305
  776    HA   THR 101           HA       THR 101 -10.146  -3.161   8.287
  777    HB   THR 101           HB       THR 101  -8.089  -4.291   6.346
  778    HG1  THR 101           HG1      THR 101  -9.053  -5.942   7.453
  779   1HG2  THR 101          1HG2      THR 101  -6.548  -3.838   8.285
  780   2HG2  THR 101          2HG2      THR 101  -7.218  -2.370   7.542
  781   3HG2  THR 101          3HG2      THR 101  -7.867  -2.969   9.090
  782    H    VAL 102           H        VAL 102  -9.747  -2.967   4.688
  783    HA   VAL 102           HA       VAL 102  -8.792  -0.298   4.557
  784    HB   VAL 102           HB       VAL 102 -10.434  -2.059   2.703
  785   1HG1  VAL 102          1HG1      VAL 102  -7.735  -0.729   2.361
  786   2HG1  VAL 102          2HG1      VAL 102  -7.970  -2.396   2.941
  787   3HG1  VAL 102          3HG1      VAL 102  -8.483  -1.946   1.299
  788   1HG2  VAL 102          1HG2      VAL 102  -9.756   0.858   2.224
  789   2HG2  VAL 102          2HG2      VAL 102 -11.358   0.102   2.138
  790   3HG2  VAL 102          3HG2      VAL 102 -10.150  -0.295   0.927
  791    H    GLU 103           HN       GLU 103 -12.118  -1.539   4.367
  792    HA   GLU 103           HA       GLU 103 -13.310   1.037   4.222
  793   1HB   GLU 103          2HB       GLU 103 -14.481  -1.659   5.069
  794   2HB   GLU 103          1HB       GLU 103 -15.376  -0.186   4.673
  795   1HG   GLU 103          2HG       GLU 103 -14.012  -0.226   2.400
  796   2HG   GLU 103          1HG       GLU 103 -13.588  -1.854   2.830
  797    H    LYS 104           HN       LYS 104 -12.807  -1.119   6.984
  798    HA   LYS 104           HA       LYS 104 -13.905   0.424   9.060
  799   1HB   LYS 104          2HB       LYS 104 -12.967  -1.757   9.511
  800   2HB   LYS 104          1HB       LYS 104 -11.384  -1.257   8.919
  801   1HG   LYS 104          2HG       LYS 104 -11.334   0.442  10.901
  802   2HG   LYS 104          1HG       LYS 104 -12.678  -0.491  11.542
  803   1HD   LYS 104          1HD       LYS 104  -9.867  -1.434  10.766
  804   2HD   LYS 104          2HD       LYS 104 -10.454  -1.190  12.411
  805   1HE   LYS 104          1HE       LYS 104 -11.365  -3.307  10.408
  806   2HE   LYS 104          2HE       LYS 104 -10.430  -3.580  11.887
  807   1HZ   LYS 104          1HZ       LYS 104 -12.728  -4.117  12.183
  808   2HZ   LYS 104          2HZ       LYS 104 -13.197  -2.609  11.741
  809   3HZ   LYS 104          3HZ       LYS 104 -12.343  -2.826  13.138
  810    H    TYR 105           H        TYR 105 -10.545   0.606   7.725
  811    HA   TYR 105           HA       TYR 105  -9.786   2.800   9.400
  812   1HB   TYR 105          1HB       TYR 105  -8.632   1.975   6.704
  813   2HB   TYR 105          2HB       TYR 105  -7.892   2.986   7.955
  814    HD1  TYR 105           HD1      TYR 105  -6.483   0.745   6.700
  815    HD2  TYR 105           HD2      TYR 105  -8.910   0.920  10.264
  816    HE1  TYR 105           HE1      TYR 105  -4.853  -0.679   7.890
  817    HE2  TYR 105           HE2      TYR 105  -7.352  -0.624  11.393
  818    HH   TYR 105           HH       TYR 105  -4.256  -1.632   9.953
  819    H    LEU 106           H        LEU 106 -11.042   2.713   6.049
  820    HA   LEU 106           HA       LEU 106 -11.390   5.698   6.150
  821   1HB   LEU 106          2HB       LEU 106 -10.712   3.848   3.826
  822   2HB   LEU 106          1HB       LEU 106 -11.183   5.546   3.653
  823    HG   LEU 106           HG       LEU 106  -8.703   4.502   5.099
  824   1HD1  LEU 106          1HD2      LEU 106  -9.602   7.358   4.485
  825   2HD1  LEU 106          2HD2      LEU 106  -7.989   6.890   5.066
  826   3HD1  LEU 106          3HD2      LEU 106  -9.391   6.643   6.101
  827   1HD2  LEU 106          1HD1      LEU 106  -8.582   4.174   2.686
  828   2HD2  LEU 106          2HD1      LEU 106  -9.162   5.823   2.390
  829   3HD2  LEU 106          3HD1      LEU 106  -7.567   5.567   3.114
  830    H    ASN 107           H        ASN 107 -12.635   3.633   3.583
  831    HA   ASN 107           HA       ASN 107 -15.212   3.118   4.497
  832   1HB   ASN 107          1HB       ASN 107 -15.261   5.718   4.179
  833   2HB   ASN 107          2HB       ASN 107 -15.023   5.390   2.463
  834   1HD2  ASN 107          1HD2      ASN 107 -16.755   3.040   2.253
  835   2HD2  ASN 107          2HD2      ASN 107 -18.404   3.623   2.519
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1  -0.522  -1.879 -10.877
    2   2H    MET   1          2H        MET   1   0.456  -3.017 -11.615
    3   3H    MET   1          3H        MET   1  -0.918  -3.463 -10.786
    4    HA   MET   1           HA       MET   1  -0.986  -1.837 -13.208
    5   1HB   MET   1          1HB       MET   1  -0.251  -4.163 -13.676
    6   2HB   MET   1          2HB       MET   1  -1.647  -4.795 -12.786
    7   1HG   MET   1          1HG       MET   1  -3.173  -3.761 -14.427
    8   2HG   MET   1          2HG       MET   1  -1.790  -3.056 -15.286
    9   1HE   MET   1          1HE       MET   1  -3.198  -5.754 -17.746
   10   2HE   MET   1          2HE       MET   1  -4.156  -4.790 -16.599
   11   3HE   MET   1          3HE       MET   1  -2.823  -4.032 -17.509
   12    H    GLU   2           HN       GLU   2  -2.987  -0.748 -13.282
   13    HA   GLU   2           HA       GLU   2  -5.018   0.016 -12.585
   14   1HB   GLU   2          2HB       GLU   2  -5.458  -2.470 -10.869
   15   2HB   GLU   2          1HB       GLU   2  -6.628  -1.266 -11.361
   16   1HG   GLU   2          1HG       GLU   2  -6.571  -2.030 -13.656
   17   2HG   GLU   2          2HG       GLU   2  -5.202  -3.105 -13.327
   18    H    ALA   3           H        ALA   3  -3.707  -1.896  -9.895
   19    HA   ALA   3           HA       ALA   3  -3.572   0.294  -8.044
   20   1HB   ALA   3          1HB       ALA   3  -2.194  -1.279  -6.698
   21   2HB   ALA   3          2HB       ALA   3  -2.086  -2.378  -8.089
   22   3HB   ALA   3          3HB       ALA   3  -3.650  -2.085  -7.302
   23    H    GLY   4           H        GLY   4  -1.792   1.578  -7.600
   24   1HA   GLY   4          2HA       GLY   4   0.080   2.281  -9.607
   25   2HA   GLY   4          1HA       GLY   4   0.111   2.791  -7.957
   26    H    ALA   5           H        ALA   5   2.368   2.237  -9.547
   27    HA   ALA   5           HA       ALA   5   3.691   0.178  -7.855
   28   1HB   ALA   5          1HB       ALA   5   3.626  -0.708 -10.138
   29   2HB   ALA   5          2HB       ALA   5   4.281   0.826 -10.772
   30   3HB   ALA   5          3HB       ALA   5   5.269  -0.190  -9.696
   31    H    VAL   6           H        VAL   6   4.924   1.365  -6.515
   32    HA   VAL   6           HA       VAL   6   5.966   4.015  -7.425
   33    HB   VAL   6           HB       VAL   6   5.680   4.663  -4.917
   34   1HG1  VAL   6          1HG1      VAL   6   4.871   2.431  -4.163
   35   2HG1  VAL   6          2HG1      VAL   6   3.399   2.662  -5.119
   36   3HG1  VAL   6          3HG1      VAL   6   3.776   3.754  -3.765
   37   1HG2  VAL   6          1HG2      VAL   6   3.318   4.568  -6.808
   38   2HG2  VAL   6          2HG2      VAL   6   3.453   5.567  -5.341
   39   3HG2  VAL   6          3HG2      VAL   6   4.565   5.838  -6.696
   40    H    ASN   7           H        ASN   7   7.647   4.812  -6.099
   41    HA   ASN   7           HA       ASN   7   9.418   2.852  -4.844
   42   1HB   ASN   7          2HB       ASN   7  10.108   4.580  -7.285
   43   2HB   ASN   7          1HB       ASN   7  11.335   3.811  -6.287
   44   1HD2  ASN   7          1HD2      ASN   7  11.000   1.384  -5.909
   45   2HD2  ASN   7          2HD2      ASN   7  10.552   0.463  -7.340
   46    H    ASP   8           HN       ASP   8  11.302   4.161  -3.988
   47    HA   ASP   8           HA       ASP   8  10.669   5.915  -2.108
   48   1HB   ASP   8          1HB       ASP   8  13.047   4.985  -3.077
   49   2HB   ASP   8          2HB       ASP   8  13.209   6.660  -3.576
   50    H    ASP   9           HN       ASP   9  11.718   7.186  -5.263
   51    HA   ASP   9           HA       ASP   9  11.140   9.900  -4.686
   52   1HB   ASP   9          2HB       ASP   9  11.296   8.504  -7.403
   53   2HB   ASP   9          1HB       ASP   9  11.490  10.228  -7.075
   54    H    THR  10           H        THR  10   9.304   7.570  -6.778
   55    HA   THR  10           HA       THR  10   7.257   9.414  -7.456
   56    HB   THR  10           HB       THR  10   6.077   7.259  -8.161
   57    HG1  THR  10           HG1      THR  10   7.594   5.454  -8.143
   58   1HG2  THR  10          1HG2      THR  10   7.688   6.806  -9.975
   59   2HG2  THR  10          2HG2      THR  10   7.566   8.550  -9.685
   60   3HG2  THR  10          3HG2      THR  10   8.971   7.644  -9.084
   61    H    PHE  11           H        PHE  11   7.576   7.174  -4.760
   62    HA   PHE  11           HA       PHE  11   5.071   7.007  -3.625
   63   1HB   PHE  11          1HB       PHE  11   7.122   6.007  -2.738
   64   2HB   PHE  11          2HB       PHE  11   7.769   7.565  -2.341
   65    HD1  PHE  11           HD1      PHE  11   7.047   8.825  -0.383
   66    HD2  PHE  11           HD2      PHE  11   5.373   4.954  -1.301
   67    HE1  PHE  11           HE1      PHE  11   6.116   8.686   1.900
   68    HE2  PHE  11           HE2      PHE  11   4.475   4.810   1.011
   69    HZ   PHE  11           HZ       PHE  11   4.891   6.652   2.622
   70    H    LYS  12           HN       LYS  12   7.421   9.613  -3.265
   71    HA   LYS  12           HA       LYS  12   5.900  11.293  -1.553
   72   1HB   LYS  12          2HB       LYS  12   7.815  12.221  -3.737
   73   2HB   LYS  12          1HB       LYS  12   7.264  13.144  -2.338
   74   1HG   LYS  12          2HG       LYS  12   8.225  11.022  -0.978
   75   2HG   LYS  12          1HG       LYS  12   9.133  10.762  -2.471
   76   1HD   LYS  12          1HD       LYS  12  10.577  12.015  -1.116
   77   2HD   LYS  12          2HD       LYS  12   9.914  13.210  -2.244
   78   1HE   LYS  12          2HE       LYS  12   8.260  13.902  -0.460
   79   2HE   LYS  12          1HE       LYS  12   8.949  12.686   0.625
   80   1HZ   LYS  12          1HZ       LYS  12  10.391  14.978  -0.507
   81   2HZ   LYS  12          2HZ       LYS  12  11.028  13.849   0.511
   82   3HZ   LYS  12          3HZ       LYS  12   9.829  14.850   1.036
   83    H    ASN  13           H        ASN  13   6.027  11.379  -5.128
   84    HA   ASN  13           HA       ASN  13   4.014  13.422  -5.473
   85   1HB   ASN  13          2HB       ASN  13   5.364  11.338  -7.185
   86   2HB   ASN  13          1HB       ASN  13   3.824  11.952  -7.750
   87   1HD2  ASN  13          2HD2      ASN  13   5.885  14.213  -5.858
   88   2HD2  ASN  13          1HD2      ASN  13   6.429  15.085  -7.275
   89    H    VAL  14           H        VAL  14   3.800   9.910  -5.686
   90    HA   VAL  14           HA       VAL  14   1.004   9.923  -6.380
   91    HB   VAL  14           HB       VAL  14   3.031   7.780  -5.645
   92   1HG1  VAL  14          1HG1      VAL  14   3.536   9.043  -7.745
   93   2HG1  VAL  14          2HG1      VAL  14   3.065   7.379  -8.098
   94   3HG1  VAL  14          3HG1      VAL  14   1.901   8.695  -8.333
   95   1HG2  VAL  14          1HG2      VAL  14   0.243   7.467  -6.800
   96   2HG2  VAL  14          2HG2      VAL  14   0.858   6.796  -5.261
   97   3HG2  VAL  14          3HG2      VAL  14   1.486   6.197  -6.806
   98    H    VAL  15           H        VAL  15   2.735   9.301  -3.321
   99    HA   VAL  15           HA       VAL  15   0.195   8.517  -2.003
  100    HB   VAL  15           HB       VAL  15   3.027   8.360  -0.899
  101   1HG1  VAL  15          1HG1      VAL  15   1.208   8.353   0.775
  102   2HG1  VAL  15          2HG1      VAL  15   0.470   6.967  -0.052
  103   3HG1  VAL  15          3HG1      VAL  15   2.081   6.824   0.687
  104   1HG2  VAL  15          1HG2      VAL  15   2.938   5.970  -1.488
  105   2HG2  VAL  15          2HG2      VAL  15   1.409   6.227  -2.353
  106   3HG2  VAL  15          3HG2      VAL  15   2.904   6.970  -2.935
  107    H    LEU  16           H        LEU  16   3.063  10.534  -1.141
  108    HA   LEU  16           HA       LEU  16   1.693  11.836   1.016
  109   1HB   LEU  16          2HB       LEU  16   4.159  12.663  -0.579
  110   2HB   LEU  16          1HB       LEU  16   3.559  13.521   0.796
  111    HG   LEU  16           HG       LEU  16   4.564  10.624   0.716
  112   1HD1  LEU  16          1HD2      LEU  16   5.782  13.116   1.985
  113   2HD1  LEU  16          2HD2      LEU  16   6.483  11.484   1.982
  114   3HD1  LEU  16          3HD2      LEU  16   6.319  12.382   0.464
  115   1HD2  LEU  16          1HD1      LEU  16   3.594  12.294   3.078
  116   2HD2  LEU  16          2HD1      LEU  16   2.925  10.742   2.511
  117   3HD2  LEU  16          3HD1      LEU  16   4.535  10.796   3.232
  118    H    GLU  17           HN       GLU  17   2.681  13.198  -2.108
  119    HA   GLU  17           HA       GLU  17   0.948  15.515  -1.809
  120   1HB   GLU  17          1HB       GLU  17   2.418  14.469  -4.247
  121   2HB   GLU  17          2HB       GLU  17   1.788  16.101  -4.046
  122   1HG   GLU  17          1HG       GLU  17   3.391  16.599  -2.300
  123   2HG   GLU  17          2HG       GLU  17   3.951  14.927  -2.220
  124    H    SER  18           H        SER  18  -0.682  13.235  -1.563
  125    HA   SER  18           HA       SER  18  -2.171  12.939  -4.132
  126   1HB   SER  18          2HB       SER  18  -1.641  10.891  -2.813
  127   2HB   SER  18          1HB       SER  18  -2.574  11.541  -1.451
  128    HG   SER  18           HG       SER  18  -4.135  10.455  -2.493
  129    H    SER  19           H        SER  19  -4.624  12.581  -3.185
  130    HA   SER  19           HA       SER  19  -5.577  15.034  -1.772
  131   1HB   SER  19          1HB       SER  19  -7.459  15.050  -3.511
  132   2HB   SER  19          2HB       SER  19  -5.880  15.621  -4.081
  133    HG   SER  19           HG       SER  19  -5.532  13.671  -5.086
  134    H    VAL  20           H        VAL  20  -6.860  12.234  -3.506
  135    HA   VAL  20           HA       VAL  20  -8.627  11.468  -1.335
  136    HB   VAL  20           HB       VAL  20  -8.618   9.237  -2.864
  137   1HG1  VAL  20          1HG1      VAL  20  -7.938  11.367  -4.929
  138   2HG1  VAL  20          2HG1      VAL  20  -8.277   9.660  -5.199
  139   3HG1  VAL  20          3HG1      VAL  20  -6.791  10.122  -4.363
  140   1HG2  VAL  20          1HG2      VAL  20 -10.107  11.792  -3.454
  141   2HG2  VAL  20          2HG2      VAL  20 -10.495  10.215  -4.161
  142   3HG2  VAL  20          3HG2      VAL  20 -10.598  10.428  -2.412
  143    HA   PRO  21           HA       PRO  21  -5.966   8.843   0.965
  144   1HB   PRO  21          1HB       PRO  21  -8.037   6.660   0.729
  145   2HB   PRO  21          2HB       PRO  21  -7.198   7.216   2.195
  146   1HG   PRO  21          1HG       PRO  21  -9.719   7.978   1.636
  147   2HG   PRO  21          2HG       PRO  21  -8.576   9.166   2.323
  148   1HD   PRO  21          1HD       PRO  21  -9.556   8.975  -0.514
  149   2HD   PRO  21          2HD       PRO  21  -9.093  10.384   0.454
  150    H    VAL  22           H        VAL  22  -4.770   6.844   0.986
  151    HA   VAL  22           HA       VAL  22  -4.445   5.532  -1.636
  152    HB   VAL  22           HB       VAL  22  -2.163   6.763  -0.056
  153   1HG1  VAL  22          1HG2      VAL  22  -0.883   6.408  -2.028
  154   2HG1  VAL  22          2HG2      VAL  22  -2.294   5.893  -2.943
  155   3HG1  VAL  22          3HG2      VAL  22  -1.689   4.878  -1.623
  156   1HG2  VAL  22          1HG1      VAL  22  -2.061   8.530  -1.846
  157   2HG2  VAL  22          2HG1      VAL  22  -3.428   8.700  -0.751
  158   3HG2  VAL  22          3HG1      VAL  22  -3.671   8.028  -2.379
  159    H    LEU  23           H        LEU  23  -3.685   3.464  -1.471
  160    HA   LEU  23           HA       LEU  23  -3.079   2.350   1.256
  161   1HB   LEU  23          2HB       LEU  23  -5.208   1.539   0.386
  162   2HB   LEU  23          1HB       LEU  23  -4.465   0.937  -1.074
  163    HG   LEU  23           HG       LEU  23  -3.555   0.019   1.671
  164   1HD1  LEU  23          1HD2      LEU  23  -2.042  -0.736  -0.131
  165   2HD1  LEU  23          2HD2      LEU  23  -3.425  -1.220  -1.132
  166   3HD1  LEU  23          3HD2      LEU  23  -3.025  -2.108   0.344
  167   1HD2  LEU  23          1HD1      LEU  23  -5.957  -0.381   1.581
  168   2HD2  LEU  23          2HD1      LEU  23  -5.089  -1.911   1.449
  169   3HD2  LEU  23          3HD1      LEU  23  -5.788  -1.181  -0.006
  170    H    VAL  24           H        VAL  24  -0.905   1.878   1.314
  171    HA   VAL  24           HA       VAL  24   0.498   1.350  -1.299
  172    HB   VAL  24           HB       VAL  24   1.582   2.522   1.276
  173   1HG1  VAL  24          1HG1      VAL  24   2.872   2.073  -1.449
  174   2HG1  VAL  24          2HG1      VAL  24   3.610   2.961  -0.106
  175   3HG1  VAL  24          3HG1      VAL  24   3.292   1.233   0.056
  176   1HG2  VAL  24          1HG2      VAL  24   0.095   4.135   0.033
  177   2HG2  VAL  24          2HG2      VAL  24   1.097   3.900  -1.407
  178   3HG2  VAL  24          3HG2      VAL  24   1.796   4.614   0.046
  179    H    ASP  25           HN       ASP  25   0.952  -0.761  -1.562
  180    HA   ASP  25           HA       ASP  25   1.288  -2.467   0.872
  181   1HB   ASP  25          2HB       ASP  25  -0.114  -3.422  -0.833
  182   2HB   ASP  25          1HB       ASP  25   1.113  -3.119  -2.060
  183    H    PHE  26           H        PHE  26   3.329  -2.429   1.779
  184    HA   PHE  26           HA       PHE  26   5.642  -1.726   0.085
  185   1HB   PHE  26          2HB       PHE  26   5.331  -2.469   3.008
  186   2HB   PHE  26          1HB       PHE  26   6.880  -2.311   2.213
  187    HD1  PHE  26           HD1      PHE  26   3.684  -0.307   2.665
  188    HD2  PHE  26           HD2      PHE  26   7.966  -0.263   2.135
  189    HE1  PHE  26           HE1      PHE  26   3.691   2.159   2.842
  190    HE2  PHE  26           HE2      PHE  26   7.975   2.186   2.416
  191    HZ   PHE  26           HZ       PHE  26   5.840   3.416   2.778
  192    H    TRP  27           H        TRP  27   6.426  -3.242  -1.254
  193    HA   TRP  27           HA       TRP  27   6.277  -6.141  -0.481
  194   1HB   TRP  27          1HB       TRP  27   5.706  -6.729  -2.675
  195   2HB   TRP  27          2HB       TRP  27   4.590  -5.462  -2.226
  196    HD1  TRP  27           HD1      TRP  27   5.392  -2.969  -3.264
  197    HE1  TRP  27           HE1      TRP  27   6.640  -2.352  -5.458
  198    HE3  TRP  27           HE3      TRP  27   6.987  -7.639  -4.640
  199    HZ2  TRP  27           HZ2      TRP  27   8.339  -3.715  -7.358
  200    HZ3  TRP  27           HZ3      TRP  27   8.260  -7.943  -6.726
  201    HH2  TRP  27           HH2      TRP  27   8.941  -5.997  -8.089
  202    H    ALA  28           H        ALA  28   7.683  -7.276  -2.365
  203    HA   ALA  28           HA       ALA  28   9.882  -5.881  -3.450
  204   1HB   ALA  28          1HB       ALA  28  11.740  -6.975  -2.235
  205   2HB   ALA  28          2HB       ALA  28  10.808  -5.964  -1.120
  206   3HB   ALA  28          3HB       ALA  28  10.587  -7.734  -1.128
  207    HA   PRO  29           HA       PRO  29   9.484  -9.584  -5.924
  208   1HB   PRO  29          1HB       PRO  29  12.123 -10.097  -6.677
  209   2HB   PRO  29          2HB       PRO  29  10.984  -8.943  -7.451
  210   1HG   PRO  29          2HG       PRO  29  13.083  -8.342  -5.346
  211   2HG   PRO  29          1HG       PRO  29  12.772  -7.447  -6.867
  212   1HD   PRO  29          2HD       PRO  29  11.706  -6.470  -4.611
  213   2HD   PRO  29          1HD       PRO  29  10.664  -6.653  -6.011
  214    H    TRP  30           H        TRP  30  11.919  -9.715  -3.286
  215    HA   TRP  30           HA       TRP  30  11.850 -12.651  -3.260
  216   1HB   TRP  30          2HB       TRP  30  13.144 -12.351  -1.158
  217   2HB   TRP  30          1HB       TRP  30  13.860 -11.640  -2.595
  218    HD1  TRP  30           HD1      TRP  30  14.545  -9.203  -2.504
  219    HE1  TRP  30           HE1      TRP  30  14.420  -7.302  -0.789
  220    HE3  TRP  30           HE3      TRP  30  11.417 -11.400   0.922
  221    HZ2  TRP  30           HZ2      TRP  30  13.091  -6.778   1.707
  222    HZ3  TRP  30           HZ3      TRP  30  10.722 -10.156   2.938
  223    HH2  TRP  30           HH2      TRP  30  11.501  -7.833   3.316
  224    H    CYS  31           H        CYS  31   9.531 -10.355  -2.344
  225    HA   CYS  31           HA       CYS  31   8.764 -11.623   0.204
  226   1HB   CYS  31          1HB       CYS  31   8.510  -9.207  -0.087
  227   2HB   CYS  31          2HB       CYS  31   7.459  -9.478  -1.460
  228    H    GLY  32           H        GLY  32   8.421 -13.780  -0.559
  229   1HA   GLY  32          1HA       GLY  32   6.868 -14.897  -2.446
  230   2HA   GLY  32          2HA       GLY  32   6.813 -15.478  -0.781
  231    HA   PRO  33           HA       PRO  33   2.572 -14.324  -0.206
  232   1HB   PRO  33          2HB       PRO  33   3.390 -11.912   1.421
  233   2HB   PRO  33          1HB       PRO  33   2.076 -13.074   1.768
  234   1HG   PRO  33          2HG       PRO  33   4.456 -13.282   3.051
  235   2HG   PRO  33          1HG       PRO  33   3.637 -14.729   2.403
  236   1HD   PRO  33          1HD       PRO  33   5.958 -13.157   1.223
  237   2HD   PRO  33          2HD       PRO  33   5.736 -14.929   1.282
  238    H    CYS  34           H        CYS  34   4.604 -11.449  -0.678
  239    HA   CYS  34           HA       CYS  34   2.646  -9.609  -1.577
  240   1HB   CYS  34          2HB       CYS  34   5.515  -9.635  -2.449
  241   2HB   CYS  34          1HB       CYS  34   4.314  -8.367  -2.565
  242    H    ARG  35           HN       ARG  35   4.712 -11.998  -3.362
  243    HA   ARG  35           HA       ARG  35   4.046 -11.268  -5.995
  244   1HB   ARG  35          2HB       ARG  35   4.529 -14.069  -4.883
  245   2HB   ARG  35          1HB       ARG  35   4.604 -13.580  -6.568
  246   1HG   ARG  35          1HG       ARG  35   6.539 -12.139  -6.127
  247   2HG   ARG  35          2HG       ARG  35   6.473 -12.547  -4.401
  248   1HD   ARG  35          2HD       ARG  35   6.748 -14.952  -4.954
  249   2HD   ARG  35          1HD       ARG  35   6.901 -14.526  -6.677
  250    HE   ARG  35           HE       ARG  35   8.786 -12.976  -5.277
  251   1HH1  ARG  35          2HH2      ARG  35   8.210 -16.407  -5.907
  252   2HH1  ARG  35          1HH2      ARG  35   9.897 -16.841  -5.802
  253   1HH2  ARG  35          2HH1      ARG  35  10.885 -13.476  -5.174
  254   2HH2  ARG  35          1HH1      ARG  35  11.502 -15.113  -5.363
  255    H    ILE  36           H        ILE  36   2.428 -13.625  -3.823
  256    HA   ILE  36           HA       ILE  36   0.380 -14.164  -5.884
  257    HB   ILE  36           HB       ILE  36  -0.467 -15.849  -4.292
  258   1HG1  ILE  36          2HG1      ILE  36   1.253 -16.562  -2.492
  259   2HG1  ILE  36          1HG1      ILE  36   1.813 -14.902  -2.486
  260   1HG2  ILE  36          1HG2      ILE  36   1.239 -16.298  -6.051
  261   2HG2  ILE  36          2HG2      ILE  36   2.525 -16.013  -4.859
  262   3HG2  ILE  36          3HG2      ILE  36   1.399 -17.368  -4.656
  263   1HD1  ILE  36          1HD1      ILE  36  -0.656 -14.275  -1.993
  264   2HD1  ILE  36          2HD1      ILE  36  -0.977 -16.006  -1.870
  265   3HD1  ILE  36          3HD1      ILE  36   0.142 -15.232  -0.731
  266    H    ILE  37           H        ILE  37   0.686 -12.039  -3.139
  267    HA   ILE  37           HA       ILE  37  -2.179 -11.504  -2.942
  268    HB   ILE  37           HB       ILE  37   0.365 -10.275  -1.830
  269   1HG1  ILE  37          2HG1      ILE  37  -2.095 -11.460  -0.454
  270   2HG1  ILE  37          1HG1      ILE  37  -0.671 -12.401  -0.897
  271   1HG2  ILE  37          1HG2      ILE  37  -2.434  -9.124  -1.695
  272   2HG2  ILE  37          2HG2      ILE  37  -0.877  -8.340  -2.108
  273   3HG2  ILE  37          3HG2      ILE  37  -1.213  -8.779  -0.454
  274   1HD1  ILE  37          1HD1      ILE  37  -0.757 -10.173   1.154
  275   2HD1  ILE  37          2HD1      ILE  37  -0.425 -11.891   1.385
  276   3HD1  ILE  37          3HD1      ILE  37   0.745 -10.880   0.515
  277    H    ALA  38           H        ALA  38   0.588 -10.077  -4.643
  278    HA   ALA  38           HA       ALA  38  -0.173  -7.681  -5.500
  279   1HB   ALA  38          1HB       ALA  38   1.166  -8.069  -7.556
  280   2HB   ALA  38          2HB       ALA  38   1.201  -9.797  -7.212
  281   3HB   ALA  38          3HB       ALA  38   1.960  -8.653  -6.090
  282    HA   PRO  39           HA       PRO  39  -2.724  -9.084  -9.350
  283   1HB   PRO  39          2HB       PRO  39  -4.006 -11.622  -8.426
  284   2HB   PRO  39          1HB       PRO  39  -3.348 -11.224 -10.035
  285   1HG   PRO  39          2HG       PRO  39  -2.024 -12.934  -8.366
  286   2HG   PRO  39          1HG       PRO  39  -1.118 -11.716  -9.318
  287   1HD   PRO  39          1HD       PRO  39  -2.105 -11.459  -6.459
  288   2HD   PRO  39          2HD       PRO  39  -0.438 -11.252  -7.062
  289    H    VAL  40           H        VAL  40  -3.615 -10.046  -6.064
  290    HA   VAL  40           HA       VAL  40  -6.398  -9.294  -6.294
  291    HB   VAL  40           HB       VAL  40  -4.898  -9.625  -3.683
  292   1HG1  VAL  40          1HG1      VAL  40  -7.678 -10.441  -4.639
  293   2HG1  VAL  40          2HG1      VAL  40  -7.070 -10.487  -2.971
  294   3HG1  VAL  40          3HG1      VAL  40  -7.330  -8.925  -3.789
  295   1HG2  VAL  40          1HG2      VAL  40  -5.465 -12.071  -3.805
  296   2HG2  VAL  40          2HG2      VAL  40  -5.841 -11.868  -5.527
  297   3HG2  VAL  40          3HG2      VAL  40  -4.187 -11.620  -4.927
  298    H    VAL  41           H        VAL  41  -3.347  -7.862  -5.037
  299    HA   VAL  41           HA       VAL  41  -4.445  -5.407  -4.088
  300    HB   VAL  41           HB       VAL  41  -1.740  -5.727  -5.473
  301   1HG1  VAL  41          1HG1      VAL  41  -0.781  -6.140  -3.290
  302   2HG1  VAL  41          2HG1      VAL  41  -2.367  -5.982  -2.507
  303   3HG1  VAL  41          3HG1      VAL  41  -2.038  -7.340  -3.597
  304   1HG2  VAL  41          1HG2      VAL  41  -1.102  -3.851  -3.953
  305   2HG2  VAL  41          2HG2      VAL  41  -2.332  -3.375  -5.128
  306   3HG2  VAL  41          3HG2      VAL  41  -2.781  -3.722  -3.435
  307    H    ASP  42           HN       ASP  42  -3.324  -6.377  -7.341
  308    HA   ASP  42           HA       ASP  42  -3.785  -3.944  -8.706
  309   1HB   ASP  42          1HB       ASP  42  -3.960  -6.810  -9.733
  310   2HB   ASP  42          2HB       ASP  42  -4.005  -5.388 -10.747
  311    H    GLU  43           HN       GLU  43  -6.049  -6.812  -8.678
  312    HA   GLU  43           HA       GLU  43  -8.113  -5.354  -9.948
  313   1HB   GLU  43          1HB       GLU  43  -9.452  -7.209  -9.599
  314   2HB   GLU  43          2HB       GLU  43  -7.825  -7.883  -9.618
  315   1HG   GLU  43          2HG       GLU  43  -7.953  -7.716  -7.017
  316   2HG   GLU  43          1HG       GLU  43  -9.675  -7.418  -7.238
  317    H    ILE  44           H        ILE  44  -7.379  -5.685  -6.479
  318    HA   ILE  44           HA       ILE  44  -9.686  -4.559  -5.374
  319    HB   ILE  44           HB       ILE  44  -6.773  -4.677  -4.587
  320   1HG1  ILE  44          2HG1      ILE  44  -8.516  -6.605  -4.443
  321   2HG1  ILE  44          1HG1      ILE  44  -7.485  -6.279  -3.049
  322   1HG2  ILE  44          1HG2      ILE  44  -7.312  -2.559  -3.657
  323   2HG2  ILE  44          2HG2      ILE  44  -8.857  -3.154  -3.017
  324   3HG2  ILE  44          3HG2      ILE  44  -7.321  -3.760  -2.362
  325   1HD1  ILE  44          1HD1      ILE  44 -10.346  -5.268  -3.318
  326   2HD1  ILE  44          2HD1      ILE  44  -9.298  -5.166  -1.887
  327   3HD1  ILE  44          3HD1      ILE  44  -9.858  -6.742  -2.463
  328    H    ALA  45           H        ALA  45  -6.976  -2.918  -7.034
  329    HA   ALA  45           HA       ALA  45  -7.605  -0.261  -6.229
  330   1HB   ALA  45          1HB       ALA  45  -6.566  -1.161  -8.947
  331   2HB   ALA  45          2HB       ALA  45  -6.329   0.415  -8.170
  332   3HB   ALA  45          3HB       ALA  45  -5.561  -1.038  -7.494
  333    H    GLY  46           H        GLY  46  -8.998  -2.380  -8.741
  334   1HA   GLY  46          1HA       GLY  46 -10.589  -0.297 -10.018
  335   2HA   GLY  46          2HA       GLY  46 -10.747  -2.055 -10.206
  336    H    GLU  47           HN       GLU  47 -11.137  -2.988  -7.723
  337    HA   GLU  47           HA       GLU  47 -13.885  -2.616  -7.281
  338   1HB   GLU  47          2HB       GLU  47 -11.740  -3.638  -5.375
  339   2HB   GLU  47          1HB       GLU  47 -13.476  -3.766  -5.104
  340   1HG   GLU  47          1HG       GLU  47 -13.722  -5.064  -7.220
  341   2HG   GLU  47          2HG       GLU  47 -11.975  -4.993  -7.473
  342    H    TYR  48           H        TYR  48 -11.200  -1.078  -5.521
  343    HA   TYR  48           HA       TYR  48 -13.192   0.791  -4.218
  344   1HB   TYR  48          1HB       TYR  48 -10.474  -0.157  -3.246
  345   2HB   TYR  48          2HB       TYR  48 -11.532   0.983  -2.413
  346    HD1  TYR  48           HD1      TYR  48 -13.773   0.273  -1.549
  347    HD2  TYR  48           HD2      TYR  48 -10.996  -2.558  -3.226
  348    HE1  TYR  48           HE1      TYR  48 -15.253  -1.594  -0.868
  349    HE2  TYR  48           HE2      TYR  48 -12.446  -4.423  -2.489
  350    HH   TYR  48           HH       TYR  48 -14.482  -5.005  -1.605
  351    H    LYS  49           HN       LYS  49 -12.247   1.229  -6.841
  352    HA   LYS  49           HA       LYS  49 -10.168   3.076  -7.060
  353   1HB   LYS  49          1HB       LYS  49 -11.316   3.781  -9.140
  354   2HB   LYS  49          2HB       LYS  49 -11.272   2.025  -8.970
  355   1HG   LYS  49          2HG       LYS  49 -13.639   2.061  -8.134
  356   2HG   LYS  49          1HG       LYS  49 -13.668   3.818  -8.365
  357   1HD   LYS  49          1HD       LYS  49 -13.290   3.522 -10.787
  358   2HD   LYS  49          2HD       LYS  49 -13.077   1.776 -10.557
  359   1HE   LYS  49          1HE       LYS  49 -15.324   2.260 -11.419
  360   2HE   LYS  49          2HE       LYS  49 -15.400   1.532  -9.807
  361   1HZ   LYS  49          1HZ       LYS  49 -15.750   3.706  -8.899
  362   2HZ   LYS  49          2HZ       LYS  49 -16.886   3.387 -10.046
  363   3HZ   LYS  49          3HZ       LYS  49 -15.635   4.404 -10.388
  364    H    ASP  50           HN       ASP  50 -10.277   5.346  -7.460
  365    HA   ASP  50           HA       ASP  50 -10.753   7.520  -7.131
  366   1HB   ASP  50          2HB       ASP  50 -13.117   7.034  -7.720
  367   2HB   ASP  50          1HB       ASP  50 -13.494   6.673  -6.043
  368    H    LYS  51           HN       LYS  51 -12.236   5.713  -4.491
  369    HA   LYS  51           HA       LYS  51 -11.481   7.801  -2.566
  370   1HB   LYS  51          1HB       LYS  51 -12.387   5.006  -1.861
  371   2HB   LYS  51          2HB       LYS  51 -12.518   6.481  -0.892
  372   1HG   LYS  51          2HG       LYS  51 -14.041   7.358  -2.815
  373   2HG   LYS  51          1HG       LYS  51 -14.110   5.677  -3.364
  374   1HD   LYS  51          2HD       LYS  51 -15.035   6.784  -0.674
  375   2HD   LYS  51          1HD       LYS  51 -16.031   6.176  -1.998
  376   1HE   LYS  51          1HE       LYS  51 -16.063   4.422  -0.453
  377   2HE   LYS  51          2HE       LYS  51 -14.857   3.884  -1.630
  378   1HZ   LYS  51          1HZ       LYS  51 -14.282   5.228   0.929
  379   2HZ   LYS  51          2HZ       LYS  51 -13.166   4.575  -0.088
  380   3HZ   LYS  51          3HZ       LYS  51 -14.223   3.605   0.716
  381    H    LEU  52           H        LEU  52 -10.194   4.670  -3.477
  382    HA   LEU  52           HA       LEU  52  -7.987   4.973  -1.456
  383   1HB   LEU  52          1HB       LEU  52  -9.809   3.218  -0.989
  384   2HB   LEU  52          2HB       LEU  52  -9.219   2.373  -2.421
  385    HG   LEU  52           HG       LEU  52  -6.869   2.528  -1.243
  386   1HD1  LEU  52          1HD1      LEU  52  -7.596   4.106   0.566
  387   2HD1  LEU  52          2HD1      LEU  52  -8.798   2.912   1.095
  388   3HD1  LEU  52          3HD1      LEU  52  -7.070   2.565   1.257
  389   1HD2  LEU  52          1HD2      LEU  52  -9.183   0.781  -0.257
  390   2HD2  LEU  52          2HD2      LEU  52  -7.476   0.443   0.059
  391   3HD2  LEU  52          3HD2      LEU  52  -8.081   0.426  -1.606
  392    H    LYS  53           HN       LYS  53  -6.248   5.683  -2.726
  393    HA   LYS  53           HA       LYS  53  -5.985   4.613  -5.449
  394   1HB   LYS  53          1HB       LYS  53  -5.538   6.994  -4.588
  395   2HB   LYS  53          2HB       LYS  53  -4.034   6.389  -3.960
  396   1HG   LYS  53          2HG       LYS  53  -4.981   6.237  -6.866
  397   2HG   LYS  53          1HG       LYS  53  -3.866   7.443  -6.210
  398   1HD   LYS  53          2HD       LYS  53  -2.246   5.688  -5.623
  399   2HD   LYS  53          1HD       LYS  53  -3.301   4.440  -6.318
  400   1HE   LYS  53          1HE       LYS  53  -2.157   6.792  -7.889
  401   2HE   LYS  53          2HE       LYS  53  -1.451   5.170  -7.847
  402   1HZ   LYS  53          1HZ       LYS  53  -3.485   4.309  -8.750
  403   2HZ   LYS  53          2HZ       LYS  53  -2.830   5.446  -9.745
  404   3HZ   LYS  53          3HZ       LYS  53  -4.140   5.821  -8.821
  405    H    CYS  54           H        CYS  54  -5.735   2.435  -5.121
  406    HA   CYS  54           HA       CYS  54  -3.977   1.300  -3.123
  407   1HB   CYS  54          1HB       CYS  54  -6.010   0.143  -3.943
  408   2HB   CYS  54          2HB       CYS  54  -5.306   0.113  -5.580
  409    HG   CYS  54           HG       CYS  54  -4.894  -2.209  -4.942
  410    H    VAL  55           H        VAL  55  -1.793   0.784  -3.298
  411    HA   VAL  55           HA       VAL  55  -0.615   0.451  -5.957
  412    HB   VAL  55           HB       VAL  55   1.028   2.137  -5.796
  413   1HG1  VAL  55          1HG2      VAL  55   0.192   2.689  -3.008
  414   2HG1  VAL  55          2HG2      VAL  55   1.741   1.947  -3.533
  415   3HG1  VAL  55          3HG2      VAL  55   1.388   3.628  -3.943
  416   1HG2  VAL  55          1HG1      VAL  55  -1.237   3.237  -6.296
  417   2HG2  VAL  55          2HG1      VAL  55  -0.063   4.310  -5.538
  418   3HG2  VAL  55          3HG1      VAL  55  -1.353   3.604  -4.562
  419    H    LYS  56           HN       LYS  56   1.805   0.050  -5.747
  420    HA   LYS  56           HA       LYS  56   2.507  -1.526  -3.320
  421   1HB   LYS  56          2HB       LYS  56   2.497  -2.134  -6.251
  422   2HB   LYS  56          1HB       LYS  56   3.800  -2.827  -5.284
  423   1HG   LYS  56          1HG       LYS  56   2.319  -3.944  -3.807
  424   2HG   LYS  56          2HG       LYS  56   0.904  -3.097  -4.458
  425   1HD   LYS  56          1HD       LYS  56   2.619  -5.059  -6.053
  426   2HD   LYS  56          2HD       LYS  56   1.164  -5.506  -5.147
  427   1HE   LYS  56          1HE       LYS  56  -0.149  -3.808  -6.499
  428   2HE   LYS  56          2HE       LYS  56   1.288  -3.566  -7.505
  429   1HZ   LYS  56          1HZ       LYS  56  -0.187  -5.122  -8.471
  430   2HZ   LYS  56          2HZ       LYS  56   1.200  -5.902  -8.043
  431   3HZ   LYS  56          3HZ       LYS  56  -0.176  -6.087  -7.146
  432    H    LEU  57           H        LEU  57   4.364  -0.869  -2.373
  433    HA   LEU  57           HA       LEU  57   6.292   0.869  -3.859
  434   1HB   LEU  57          1HB       LEU  57   5.240   1.947  -1.991
  435   2HB   LEU  57          2HB       LEU  57   5.703   0.619  -0.888
  436    HG   LEU  57           HG       LEU  57   6.881   2.678  -0.546
  437   1HD1  LEU  57          1HD1      LEU  57   8.192   2.145  -3.220
  438   2HD1  LEU  57          2HD1      LEU  57   8.603   3.453  -2.089
  439   3HD1  LEU  57          3HD1      LEU  57   7.026   3.449  -2.904
  440   1HD2  LEU  57          1HD2      LEU  57   7.819   0.255  -0.169
  441   2HD2  LEU  57          2HD2      LEU  57   8.871   1.667   0.020
  442   3HD2  LEU  57          3HD2      LEU  57   8.920   0.694  -1.465
  443    H    ASN  58           H        ASN  58   8.130  -0.050  -4.482
  444    HA   ASN  58           HA       ASN  58   8.870  -2.703  -3.467
  445   1HB   ASN  58          1HB       ASN  58   9.288  -2.053  -5.812
  446   2HB   ASN  58          2HB       ASN  58  10.479  -0.872  -5.254
  447   1HD2  ASN  58          2HD2      ASN  58  10.279  -3.941  -6.479
  448   2HD2  ASN  58          1HD2      ASN  58  11.758  -4.587  -5.791
  449    H    THR  59           H        THR  59   9.631  -2.911  -1.553
  450    HA   THR  59           HA       THR  59  10.636  -0.779   0.095
  451    HB   THR  59           HB       THR  59  10.795  -3.786   0.577
  452    HG1  THR  59           HG1      THR  59   8.699  -3.356   0.018
  453   1HG2  THR  59          1HG2      THR  59  11.894  -2.291   2.296
  454   2HG2  THR  59          2HG2      THR  59  10.320  -1.482   2.508
  455   3HG2  THR  59          3HG2      THR  59  10.503  -3.194   2.923
  456    H    ASP  60           HN       ASP  60  12.151  -3.196  -1.935
  457    HA   ASP  60           HA       ASP  60  14.763  -3.227  -0.680
  458   1HB   ASP  60          1HB       ASP  60  13.444  -4.987  -2.167
  459   2HB   ASP  60          2HB       ASP  60  14.119  -4.088  -3.523
  460    H    GLU  61           HN       GLU  61  13.158  -1.713  -3.384
  461    HA   GLU  61           HA       GLU  61  15.414  -0.179  -4.383
  462   1HB   GLU  61          1HB       GLU  61  13.210  -1.152  -5.513
  463   2HB   GLU  61          2HB       GLU  61  12.496   0.353  -4.969
  464   1HG   GLU  61          2HG       GLU  61  13.229   0.670  -7.255
  465   2HG   GLU  61          1HG       GLU  61  14.294   1.620  -6.213
  466    H    SER  62           H        SER  62  12.754   0.288  -2.184
  467    HA   SER  62           HA       SER  62  13.403   3.168  -1.788
  468   1HB   SER  62          1HB       SER  62  10.706   1.916  -1.189
  469   2HB   SER  62          2HB       SER  62  11.202   3.599  -1.430
  470    HG   SER  62           HG       SER  62  11.054   1.447  -3.272
  471    HA   PRO  63           HA       PRO  63  14.127   0.577   2.158
  472   1HB   PRO  63          1HB       PRO  63  16.785   1.016   2.491
  473   2HB   PRO  63          2HB       PRO  63  16.165  -0.241   1.377
  474   1HG   PRO  63          2HG       PRO  63  16.961   2.610   0.648
  475   2HG   PRO  63          1HG       PRO  63  17.540   1.118  -0.099
  476   1HD   PRO  63          1HD       PRO  63  15.495   2.398  -1.227
  477   2HD   PRO  63          2HD       PRO  63  15.370   0.625  -1.039
  478    H    ASN  64           H        ASN  64  15.140   3.674   0.919
  479    HA   ASN  64           HA       ASN  64  15.671   5.036   3.400
  480   1HB   ASN  64          1HB       ASN  64  14.446   6.591   1.122
  481   2HB   ASN  64          2HB       ASN  64  15.645   7.057   2.297
  482   1HD2  ASN  64          1HD2      ASN  64  15.050   5.240  -0.665
  483   2HD2  ASN  64          2HD2      ASN  64  16.747   5.108  -1.153
  484    H    VAL  65           H        VAL  65  12.749   5.266   1.398
  485    HA   VAL  65           HA       VAL  65  11.051   6.386   3.356
  486    HB   VAL  65           HB       VAL  65  10.588   4.677   0.886
  487   1HG1  VAL  65          1HG2      VAL  65   8.607   4.371   2.363
  488   2HG1  VAL  65          2HG2      VAL  65   8.237   5.324   0.924
  489   3HG1  VAL  65          3HG2      VAL  65   8.455   6.136   2.488
  490   1HG2  VAL  65          1HG1      VAL  65  11.582   6.996   0.712
  491   2HG2  VAL  65          2HG1      VAL  65  10.165   7.634   1.539
  492   3HG2  VAL  65          3HG1      VAL  65   9.990   6.876  -0.061
  493    H    ALA  66           H        ALA  66  11.592   2.971   2.514
  494    HA   ALA  66           HA       ALA  66   9.896   1.766   4.338
  495   1HB   ALA  66          1HB       ALA  66  11.377   0.603   2.645
  496   2HB   ALA  66          2HB       ALA  66  12.729   0.813   3.785
  497   3HB   ALA  66          3HB       ALA  66  11.362  -0.180   4.234
  498    H    SER  67           H        SER  67  13.240   2.930   5.004
  499    HA   SER  67           HA       SER  67  13.271   2.136   7.758
  500   1HB   SER  67          2HB       SER  67  14.879   4.314   6.343
  501   2HB   SER  67          1HB       SER  67  15.232   3.598   7.925
  502    HG   SER  67           HG       SER  67  15.185   2.266   5.414
  503    H    GLU  68           HN       GLU  68  12.504   5.205   6.122
  504    HA   GLU  68           HA       GLU  68  12.097   6.829   8.409
  505   1HB   GLU  68          1HB       GLU  68  10.708   6.862   5.698
  506   2HB   GLU  68          2HB       GLU  68  10.538   8.131   6.905
  507   1HG   GLU  68          2HG       GLU  68  12.798   8.808   6.732
  508   2HG   GLU  68          1HG       GLU  68  13.298   7.326   5.920
  509    H    TYR  69           H        TYR  69   9.756   4.723   6.672
  510    HA   TYR  69           HA       TYR  69   7.635   5.315   8.610
  511   1HB   TYR  69          2HB       TYR  69   7.928   3.499   6.200
  512   2HB   TYR  69          1HB       TYR  69   6.586   3.310   7.314
  513    HD1  TYR  69           HD1      TYR  69   5.047   5.278   7.792
  514    HD2  TYR  69           HD2      TYR  69   7.990   5.396   4.659
  515    HE1  TYR  69           HE1      TYR  69   4.230   7.514   7.096
  516    HE2  TYR  69           HE2      TYR  69   7.198   7.634   3.986
  517    HH   TYR  69           HH       TYR  69   5.803   9.400   4.521
  518    H    GLY  70           H        GLY  70  10.003   2.731   8.203
  519   1HA   GLY  70          2HA       GLY  70  10.848   1.505  10.049
  520   2HA   GLY  70          1HA       GLY  70   9.354   1.765  10.955
  521    H    ILE  71           H        ILE  71   9.910   0.619   7.612
  522    HA   ILE  71           HA       ILE  71   8.024  -1.581   7.906
  523    HB   ILE  71           HB       ILE  71  10.025  -0.977   5.709
  524   1HG1  ILE  71          1HG1      ILE  71   8.524   0.970   6.062
  525   2HG1  ILE  71          2HG1      ILE  71   8.295   0.160   4.529
  526   1HG2  ILE  71          1HG2      ILE  71   7.517  -2.711   5.776
  527   2HG2  ILE  71          2HG2      ILE  71   8.386  -2.260   4.294
  528   3HG2  ILE  71          3HG2      ILE  71   9.187  -3.245   5.523
  529   1HD1  ILE  71          1HD1      ILE  71   6.181   0.871   5.556
  530   2HD1  ILE  71          2HD1      ILE  71   6.523  -0.142   6.972
  531   3HD1  ILE  71          3HD1      ILE  71   6.217  -0.889   5.380
  532    H    ARG  72           HN       ARG  72   8.925  -2.649   9.705
  533    HA   ARG  72           HA       ARG  72  11.572  -3.733   9.693
  534   1HB   ARG  72          1HB       ARG  72  10.348  -3.316  11.756
  535   2HB   ARG  72          2HB       ARG  72   9.053  -4.415  11.268
  536   1HG   ARG  72          2HG       ARG  72  10.444  -5.446  12.963
  537   2HG   ARG  72          1HG       ARG  72  10.541  -6.355  11.472
  538   1HD   ARG  72          2HD       ARG  72  12.762  -5.160  10.980
  539   2HD   ARG  72          1HD       ARG  72  12.599  -4.369  12.546
  540    HE   ARG  72           HE       ARG  72  13.254  -6.293  13.597
  541   1HH1  ARG  72          1HH1      ARG  72  12.347  -7.116  10.254
  542   2HH1  ARG  72          2HH1      ARG  72  13.028  -8.715  10.335
  543   1HH2  ARG  72          1HH2      ARG  72  14.101  -8.397  13.699
  544   2HH2  ARG  72          2HH2      ARG  72  14.013  -9.466  12.326
  545    H    SER  73           H        SER  73   8.595  -4.856   8.201
  546    HA   SER  73           HA       SER  73   9.932  -7.068   6.951
  547   1HB   SER  73          2HB       SER  73   8.173  -8.751   7.777
  548   2HB   SER  73          1HB       SER  73   9.412  -8.285   8.941
  549    HG   SER  73           HG       SER  73   7.899  -6.770   9.803
  550    H    ILE  74           H        ILE  74   8.071  -8.240   5.622
  551    HA   ILE  74           HA       ILE  74   5.912  -6.484   4.818
  552    HB   ILE  74           HB       ILE  74   6.626  -6.713   2.368
  553   1HG1  ILE  74          1HG1      ILE  74   9.369  -7.236   3.517
  554   2HG1  ILE  74          2HG1      ILE  74   8.357  -8.443   2.697
  555   1HG2  ILE  74          1HG2      ILE  74   7.871  -4.668   2.404
  556   2HG2  ILE  74          2HG2      ILE  74   8.514  -4.999   4.019
  557   3HG2  ILE  74          3HG2      ILE  74   6.794  -4.600   3.796
  558   1HD1  ILE  74          1HD1      ILE  74   8.247  -6.895   0.704
  559   2HD1  ILE  74          2HD1      ILE  74   9.834  -7.584   1.031
  560   3HD1  ILE  74          3HD1      ILE  74   9.511  -5.905   1.474
  561    HA   PRO  75           HA       PRO  75   4.424  -6.993   2.591
  562   1HB   PRO  75          2HB       PRO  75   1.817  -7.765   2.768
  563   2HB   PRO  75          1HB       PRO  75   2.988  -8.342   1.578
  564   1HG   PRO  75          1HG       PRO  75   2.243  -9.640   4.257
  565   2HG   PRO  75          2HG       PRO  75   2.249 -10.444   2.663
  566   1HD   PRO  75          2HD       PRO  75   4.306 -10.608   4.458
  567   2HD   PRO  75          1HD       PRO  75   4.666 -10.487   2.720
  568    H    THR  76           H        THR  76   3.744  -5.202   3.298
  569    HA   THR  76           HA       THR  76   2.309  -4.875   5.871
  570    HB   THR  76           HB       THR  76   4.958  -3.504   5.274
  571    HG1  THR  76           HG1      THR  76   5.743  -4.885   6.702
  572   1HG2  THR  76          1HG2      THR  76   4.647  -2.514   7.536
  573   2HG2  THR  76          2HG2      THR  76   3.367  -1.979   6.428
  574   3HG2  THR  76          3HG2      THR  76   3.031  -3.242   7.633
  575    H    ILE  77           H        ILE  77   0.551  -4.019   5.079
  576    HA   ILE  77           HA       ILE  77   0.572  -2.117   2.837
  577    HB   ILE  77           HB       ILE  77  -1.615  -3.548   4.405
  578   1HG1  ILE  77          1HG1      ILE  77  -2.250  -4.210   2.049
  579   2HG1  ILE  77          2HG1      ILE  77  -0.720  -3.561   1.485
  580   1HG2  ILE  77          1HG2      ILE  77  -3.199  -2.340   2.872
  581   2HG2  ILE  77          2HG2      ILE  77  -2.445  -1.292   4.064
  582   3HG2  ILE  77          3HG2      ILE  77  -1.838  -1.295   2.392
  583   1HD1  ILE  77          1HD1      ILE  77   0.513  -5.255   2.755
  584   2HD1  ILE  77          2HD1      ILE  77  -0.970  -5.766   3.591
  585   3HD1  ILE  77          3HD1      ILE  77  -0.770  -6.061   1.851
  586    H    MET  78           H        MET  78   0.315   0.023   3.165
  587    HA   MET  78           HA       MET  78  -0.183   1.000   5.954
  588   1HB   MET  78          2HB       MET  78   1.531   2.224   3.822
  589   2HB   MET  78          1HB       MET  78   1.159   3.002   5.356
  590   1HG   MET  78          1HG       MET  78   2.725   0.396   5.107
  591   2HG   MET  78          2HG       MET  78   3.410   2.005   5.379
  592   1HE   MET  78          1HE       MET  78   4.034   0.909   8.957
  593   2HE   MET  78          2HE       MET  78   4.653   1.722   7.501
  594   3HE   MET  78          3HE       MET  78   4.344  -0.037   7.486
  595    H    VAL  79           H        VAL  79  -1.319   2.919   6.036
  596    HA   VAL  79           HA       VAL  79  -3.116   3.458   3.677
  597    HB   VAL  79           HB       VAL  79  -3.806   3.406   6.625
  598   1HG1  VAL  79          1HG1      VAL  79  -4.787   1.667   4.307
  599   2HG1  VAL  79          2HG1      VAL  79  -5.300   1.542   6.005
  600   3HG1  VAL  79          3HG1      VAL  79  -3.645   1.137   5.559
  601   1HG2  VAL  79          1HG2      VAL  79  -5.053   5.218   5.592
  602   2HG2  VAL  79          2HG2      VAL  79  -5.516   4.180   4.228
  603   3HG2  VAL  79          3HG2      VAL  79  -6.144   3.862   5.860
  604    H    PHE  80           H        PHE  80  -3.241   5.524   3.067
  605    HA   PHE  80           HA       PHE  80  -2.334   7.641   4.928
  606   1HB   PHE  80          1HB       PHE  80  -1.781   7.500   1.941
  607   2HB   PHE  80          2HB       PHE  80  -1.361   8.828   3.000
  608    HD1  PHE  80           HD1      PHE  80   0.833   8.928   3.861
  609    HD2  PHE  80           HD2      PHE  80  -0.705   5.158   2.450
  610    HE1  PHE  80           HE1      PHE  80   3.052   7.906   4.168
  611    HE2  PHE  80           HE2      PHE  80   1.501   4.124   2.869
  612    HZ   PHE  80           HZ       PHE  80   3.304   5.431   3.999
  613    H    LYS  81           HN       LYS  81  -3.533   9.531   4.821
  614    HA   LYS  81           HA       LYS  81  -5.621   9.895   2.822
  615   1HB   LYS  81          1HB       LYS  81  -7.322  10.276   4.773
  616   2HB   LYS  81          2HB       LYS  81  -7.087   8.686   4.059
  617   1HG   LYS  81          2HG       LYS  81  -7.338   8.539   6.439
  618   2HG   LYS  81          1HG       LYS  81  -5.782   7.893   5.917
  619   1HD   LYS  81          1HD       LYS  81  -4.583   9.761   6.756
  620   2HD   LYS  81          2HD       LYS  81  -6.042  10.761   6.907
  621   1HE   LYS  81          1HE       LYS  81  -5.522   8.239   8.525
  622   2HE   LYS  81          2HE       LYS  81  -5.090   9.875   9.059
  623   1HZ   LYS  81          1HZ       LYS  81  -7.176   9.206   9.946
  624   2HZ   LYS  81          2HZ       LYS  81  -7.394  10.472   8.914
  625   3HZ   LYS  81          3HZ       LYS  81  -7.807   8.945   8.448
  626    H    GLY  82           H        GLY  82  -5.931  12.033   2.452
  627   1HA   GLY  82          2HA       GLY  82  -5.334  14.257   2.489
  628   2HA   GLY  82          1HA       GLY  82  -5.267  14.145   4.263
  629    H    GLY  83           H        GLY  83  -3.437  12.324   1.792
  630   1HA   GLY  83          1HA       GLY  83  -1.230  12.281   1.205
  631   2HA   GLY  83          2HA       GLY  83  -0.907  13.728   2.204
  632    H    LYS  84           HN       LYS  84  -1.697  12.932   4.654
  633    HA   LYS  84           HA       LYS  84   0.762  11.593   5.408
  634   1HB   LYS  84          1HB       LYS  84  -1.511  12.650   7.102
  635   2HB   LYS  84          2HB       LYS  84   0.113  12.308   7.673
  636   1HG   LYS  84          1HG       LYS  84  -0.626  14.433   5.560
  637   2HG   LYS  84          2HG       LYS  84  -0.267  14.755   7.210
  638   1HD   LYS  84          2HD       LYS  84   1.668  13.657   5.125
  639   2HD   LYS  84          1HD       LYS  84   1.638  15.274   5.824
  640   1HE   LYS  84          2HE       LYS  84   2.113  14.277   8.090
  641   2HE   LYS  84          1HE       LYS  84   2.304  12.691   7.313
  642   1HZ   LYS  84          1HZ       LYS  84   4.067  13.597   6.007
  643   2HZ   LYS  84          2HZ       LYS  84   4.383  13.768   7.615
  644   3HZ   LYS  84          3HZ       LYS  84   3.905  15.071   6.728
  645    H    LYS  85           HN       LYS  85   0.897  10.023   7.024
  646    HA   LYS  85           HA       LYS  85  -0.492   7.587   6.186
  647   1HB   LYS  85          2HB       LYS  85   1.995   7.926   6.279
  648   2HB   LYS  85          1HB       LYS  85   1.894   8.072   8.013
  649   1HG   LYS  85          2HG       LYS  85   0.659   5.576   6.884
  650   2HG   LYS  85          1HG       LYS  85   2.394   5.737   6.642
  651   1HD   LYS  85          1HD       LYS  85   2.814   6.118   8.983
  652   2HD   LYS  85          2HD       LYS  85   1.085   6.095   9.376
  653   1HE   LYS  85          1HE       LYS  85   1.026   3.692   8.505
  654   2HE   LYS  85          2HE       LYS  85   2.798   3.793   8.389
  655   1HZ   LYS  85          1HZ       LYS  85   2.121   2.833  10.429
  656   2HZ   LYS  85          2HZ       LYS  85   1.153   4.118  10.795
  657   3HZ   LYS  85          3HZ       LYS  85   2.798   4.303  10.756
  658    H    CYS  86           H        CYS  86  -1.359   6.027   7.665
  659    HA   CYS  86           HA       CYS  86  -1.405   6.681  10.558
  660   1HB   CYS  86          2HB       CYS  86  -3.832   6.785   8.803
  661   2HB   CYS  86          1HB       CYS  86  -4.003   5.928  10.343
  662    HG   CYS  86           HG       CYS  86  -2.579   8.860  10.150
  663    H    GLU  87           HN       GLU  87  -3.310   4.338   8.588
  664    HA   GLU  87           HA       GLU  87  -2.766   2.393  10.650
  665   1HB   GLU  87          2HB       GLU  87  -4.044   1.720   8.001
  666   2HB   GLU  87          1HB       GLU  87  -4.306   0.986   9.566
  667   1HG   GLU  87          2HG       GLU  87  -5.215   3.790   8.748
  668   2HG   GLU  87          1HG       GLU  87  -6.219   2.369   8.897
  669    H    THR  88           H        THR  88  -1.921   0.374  10.415
  670    HA   THR  88           HA       THR  88   0.056  -0.220   8.290
  671    HB   THR  88           HB       THR  88   0.449  -0.447  11.318
  672    HG1  THR  88           HG1      THR  88   0.613   1.661  10.363
  673   1HG2  THR  88          1HG2      THR  88   2.800  -1.067  10.689
  674   2HG2  THR  88          2HG2      THR  88   1.613  -2.278  10.175
  675   3HG2  THR  88          3HG2      THR  88   2.297  -1.153   8.988
  676    H    ILE  89           H        ILE  89  -0.822  -2.067   7.412
  677    HA   ILE  89           HA       ILE  89  -2.184  -4.040   9.206
  678    HB   ILE  89           HB       ILE  89  -2.880  -3.281   6.336
  679   1HG1  ILE  89          2HG1      ILE  89  -4.475  -2.693   8.870
  680   2HG1  ILE  89          1HG1      ILE  89  -3.486  -1.493   8.031
  681   1HG2  ILE  89          1HG2      ILE  89  -4.846  -4.770   6.742
  682   2HG2  ILE  89          2HG2      ILE  89  -4.221  -5.149   8.355
  683   3HG2  ILE  89          3HG2      ILE  89  -3.335  -5.655   6.902
  684   1HD1  ILE  89          1HD1      ILE  89  -4.801  -1.785   5.965
  685   2HD1  ILE  89          2HD1      ILE  89  -5.728  -1.161   7.341
  686   3HD1  ILE  89          3HD1      ILE  89  -5.920  -2.849   6.850
  687    H    ILE  90           H        ILE  90  -1.141  -6.004   9.157
  688    HA   ILE  90           HA       ILE  90   1.129  -6.348   7.323
  689    HB   ILE  90           HB       ILE  90  -0.056  -8.172   9.462
  690   1HG1  ILE  90          1HG1      ILE  90   2.311  -6.230   9.509
  691   2HG1  ILE  90          2HG1      ILE  90   0.784  -6.030  10.377
  692   1HG2  ILE  90          1HG2      ILE  90   2.091  -9.391   9.310
  693   2HG2  ILE  90          2HG2      ILE  90   2.633  -8.306   8.013
  694   3HG2  ILE  90          3HG2      ILE  90   1.275  -9.426   7.764
  695   1HD1  ILE  90          1HD1      ILE  90   2.908  -8.116  10.942
  696   2HD1  ILE  90          2HD1      ILE  90   1.271  -8.144  11.648
  697   3HD1  ILE  90          3HD1      ILE  90   2.365  -6.782  11.963
  698    H    GLY  91           H        GLY  91   1.208  -7.947   5.675
  699   1HA   GLY  91          1HA       GLY  91  -1.375  -8.578   4.434
  700   2HA   GLY  91          2HA       GLY  91   0.202  -8.995   3.801
  701    H    ALA  92           H        ALA  92   0.084 -11.269   3.543
  702    HA   ALA  92           HA       ALA  92  -0.111 -13.445   4.009
  703   1HB   ALA  92          1HB       ALA  92  -0.475 -12.837   6.978
  704   2HB   ALA  92          2HB       ALA  92   0.052 -14.333   6.211
  705   3HB   ALA  92          3HB       ALA  92   1.105 -12.908   6.162
  706    H    VAL  93           H        VAL  93  -2.472 -11.539   5.884
  707    HA   VAL  93           HA       VAL  93  -4.599 -13.457   5.522
  708    HB   VAL  93           HB       VAL  93  -6.031 -11.733   6.491
  709   1HG1  VAL  93          1HG2      VAL  93  -5.145  -9.585   7.275
  710   2HG1  VAL  93          2HG2      VAL  93  -5.038  -9.673   5.515
  711   3HG1  VAL  93          3HG2      VAL  93  -3.586  -9.900   6.506
  712   1HG2  VAL  93          1HG1      VAL  93  -4.673 -13.205   7.949
  713   2HG2  VAL  93          2HG1      VAL  93  -3.388 -11.979   7.988
  714   3HG2  VAL  93          3HG1      VAL  93  -4.978 -11.622   8.685
  715    HA   PRO  94           HA       PRO  94  -5.703 -12.232   1.426
  716   1HB   PRO  94          1HB       PRO  94  -8.602 -12.371   2.211
  717   2HB   PRO  94          2HB       PRO  94  -7.784 -13.173   0.843
  718   1HG   PRO  94          2HG       PRO  94  -8.442 -14.605   3.060
  719   2HG   PRO  94          1HG       PRO  94  -6.845 -14.835   2.287
  720   1HD   PRO  94          1HD       PRO  94  -7.505 -13.150   4.712
  721   2HD   PRO  94          2HD       PRO  94  -6.202 -14.330   4.488
  722    H    LYS  95           HN       LYS  95  -6.445 -10.428   0.197
  723    HA   LYS  95           HA       LYS  95  -6.440  -7.908   1.320
  724   1HB   LYS  95          2HB       LYS  95  -7.745  -8.948  -1.228
  725   2HB   LYS  95          1HB       LYS  95  -7.636  -7.244  -0.840
  726   1HG   LYS  95          1HG       LYS  95  -5.287  -9.162  -1.241
  727   2HG   LYS  95          2HG       LYS  95  -5.844  -7.910  -2.351
  728   1HD   LYS  95          2HD       LYS  95  -4.521  -7.466   0.351
  729   2HD   LYS  95          1HD       LYS  95  -3.854  -7.170  -1.244
  730   1HE   LYS  95          2HE       LYS  95  -5.623  -5.451  -1.677
  731   2HE   LYS  95          1HE       LYS  95  -6.213  -5.666  -0.015
  732   1HZ   LYS  95          1HZ       LYS  95  -3.526  -4.777  -0.773
  733   2HZ   LYS  95          2HZ       LYS  95  -4.073  -4.987   0.768
  734   3HZ   LYS  95          3HZ       LYS  95  -4.741  -3.828  -0.193
  735    H    ALA  96           H        ALA  96  -9.259  -9.981   0.731
  736    HA   ALA  96           HA       ALA  96 -11.367  -8.269   1.315
  737   1HB   ALA  96          1HB       ALA  96 -12.542 -10.239   2.232
  738   2HB   ALA  96          2HB       ALA  96 -11.647 -10.657   0.759
  739   3HB   ALA  96          3HB       ALA  96 -11.003 -11.117   2.352
  740    H    THR  97           H        THR  97  -9.116  -9.775   3.673
  741    HA   THR  97           HA       THR  97 -10.422  -8.882   6.045
  742    HB   THR  97           HB       THR  97  -7.414  -9.275   5.841
  743    HG1  THR  97           HG1      THR  97  -7.953 -10.906   4.618
  744   1HG2  THR  97          1HG2      THR  97  -8.503  -8.935   8.068
  745   2HG2  THR  97          2HG2      THR  97  -7.765 -10.543   7.906
  746   3HG2  THR  97          3HG2      THR  97  -9.522 -10.365   7.758
  747    H    ILE  98           H        ILE  98  -7.861  -7.583   3.961
  748    HA   ILE  98           HA       ILE  98  -7.228  -5.251   5.533
  749    HB   ILE  98           HB       ILE  98  -6.681  -5.934   2.594
  750   1HG1  ILE  98          1HG1      ILE  98  -5.237  -6.504   5.205
  751   2HG1  ILE  98          2HG1      ILE  98  -5.721  -7.630   3.936
  752   1HG2  ILE  98          1HG2      ILE  98  -5.383  -3.869   4.436
  753   2HG2  ILE  98          2HG2      ILE  98  -4.944  -4.204   2.748
  754   3HG2  ILE  98          3HG2      ILE  98  -6.502  -3.484   3.113
  755   1HD1  ILE  98          1HD1      ILE  98  -3.365  -7.374   3.815
  756   2HD1  ILE  98          2HD1      ILE  98  -3.464  -5.609   3.833
  757   3HD1  ILE  98          3HD1      ILE  98  -4.037  -6.522   2.413
  758    H    VAL  99           H        VAL  99  -9.483  -5.872   2.845
  759    HA   VAL  99           HA       VAL  99 -10.356  -3.219   2.371
  760    HB   VAL  99           HB       VAL  99 -11.605  -5.962   2.038
  761   1HG1  VAL  99          1HG1      VAL  99 -13.529  -4.515   2.454
  762   2HG1  VAL  99          2HG1      VAL  99 -12.907  -3.331   1.281
  763   3HG1  VAL  99          3HG1      VAL  99 -13.428  -4.951   0.757
  764   1HG2  VAL  99          1HG2      VAL  99 -10.740  -3.843   0.034
  765   2HG2  VAL  99          2HG2      VAL  99 -11.298  -5.491  -0.326
  766   3HG2  VAL  99          3HG2      VAL  99  -9.758  -5.240   0.516
  767    H    GLN 100           H        GLN 100 -11.829  -5.792   4.411
  768    HA   GLN 100           HA       GLN 100 -13.789  -4.180   5.663
  769   1HB   GLN 100          1HB       GLN 100 -12.369  -6.765   6.238
  770   2HB   GLN 100          2HB       GLN 100 -13.141  -5.985   7.614
  771   1HG   GLN 100          2HG       GLN 100 -14.543  -7.662   6.353
  772   2HG   GLN 100          1HG       GLN 100 -15.273  -6.093   6.723
  773   1HE2  GLN 100          1HE2      GLN 100 -13.221  -7.376   3.967
  774   2HE2  GLN 100          2HE2      GLN 100 -14.376  -6.833   2.759
  775    H    THR 101           H        THR 101 -10.417  -4.803   6.667
  776    HA   THR 101           HA       THR 101 -10.534  -3.278   9.061
  777    HB   THR 101           HB       THR 101  -8.131  -3.784   7.254
  778    HG1  THR 101           HG1      THR 101  -9.145  -5.702   7.902
  779   1HG2  THR 101          1HG2      THR 101  -8.332  -3.112  10.226
  780   2HG2  THR 101          2HG2      THR 101  -6.853  -3.614   9.387
  781   3HG2  THR 101          3HG2      THR 101  -7.625  -2.077   8.964
  782    H    VAL 102           H        VAL 102  -9.445  -2.211   5.747
  783    HA   VAL 102           HA       VAL 102  -8.824   0.416   6.686
  784    HB   VAL 102           HB       VAL 102  -8.022  -0.853   4.633
  785   1HG1  VAL 102          1HG2      VAL 102  -7.444   1.286   3.506
  786   2HG1  VAL 102          2HG2      VAL 102  -7.394   1.495   5.265
  787   3HG1  VAL 102          3HG2      VAL 102  -8.783   2.094   4.351
  788   1HG2  VAL 102          1HG1      VAL 102 -10.068  -1.284   3.443
  789   2HG2  VAL 102          2HG1      VAL 102 -10.373   0.455   3.234
  790   3HG2  VAL 102          3HG1      VAL 102  -8.969  -0.317   2.475
  791    H    GLU 103           HN       GLU 103 -11.647  -0.946   5.071
  792    HA   GLU 103           HA       GLU 103 -13.219   1.323   4.693
  793   1HB   GLU 103          2HB       GLU 103 -13.924  -1.525   5.472
  794   2HB   GLU 103          1HB       GLU 103 -15.159  -0.304   5.168
  795   1HG   GLU 103          2HG       GLU 103 -14.415   0.075   2.906
  796   2HG   GLU 103          1HG       GLU 103 -13.042  -1.007   3.096
  797    H    LYS 104           HN       LYS 104 -12.776  -0.497   7.730
  798    HA   LYS 104           HA       LYS 104 -14.776   0.870   9.200
  799   1HB   LYS 104          1HB       LYS 104 -14.047  -0.276  10.995
  800   2HB   LYS 104          2HB       LYS 104 -13.196  -1.217   9.771
  801   1HG   LYS 104          2HG       LYS 104 -11.200   0.408  10.246
  802   2HG   LYS 104          1HG       LYS 104 -12.101   0.895  11.682
  803   1HD   LYS 104          2HD       LYS 104 -11.176  -1.924  10.970
  804   2HD   LYS 104          1HD       LYS 104 -10.422  -0.848  12.152
  805   1HE   LYS 104          2HE       LYS 104 -12.548  -0.851  13.486
  806   2HE   LYS 104          1HE       LYS 104 -13.240  -2.019  12.341
  807   1HZ   LYS 104          1HZ       LYS 104 -10.843  -2.454  13.972
  808   2HZ   LYS 104          2HZ       LYS 104 -12.337  -3.089  14.252
  809   3HZ   LYS 104          3HZ       LYS 104 -11.494  -3.531  12.907
  810    H    TYR 105           H        TYR 105 -11.577   1.962   8.223
  811    HA   TYR 105           HA       TYR 105 -11.651   4.297  10.065
  812   1HB   TYR 105          2HB       TYR 105  -9.560   3.350   8.068
  813   2HB   TYR 105          1HB       TYR 105  -9.412   4.742   9.133
  814    HD1  TYR 105           HD1      TYR 105  -8.733   1.257   8.809
  815    HD2  TYR 105           HD2      TYR 105  -9.676   4.298  11.711
  816    HE1  TYR 105           HE1      TYR 105  -7.882  -0.205  10.620
  817    HE2  TYR 105           HE2      TYR 105  -8.815   2.843  13.515
  818    HH   TYR 105           HH       TYR 105  -7.815   0.823  14.031
  819    H    LEU 106           H        LEU 106 -11.690   3.431   6.598
  820    HA   LEU 106           HA       LEU 106 -12.334   6.256   5.857
  821   1HB   LEU 106          2HB       LEU 106 -11.594   3.831   4.167
  822   2HB   LEU 106          1HB       LEU 106 -11.908   5.468   3.558
  823    HG   LEU 106           HG       LEU 106  -9.622   4.594   5.380
  824   1HD1  LEU 106          1HD2      LEU 106  -8.723   6.896   4.951
  825   2HD1  LEU 106          2HD2      LEU 106 -10.175   6.906   5.955
  826   3HD1  LEU 106          3HD2      LEU 106 -10.284   7.347   4.234
  827   1HD2  LEU 106          1HD1      LEU 106  -9.498   3.866   3.016
  828   2HD2  LEU 106          2HD1      LEU 106  -9.670   5.545   2.481
  829   3HD2  LEU 106          3HD1      LEU 106  -8.234   5.048   3.405
  830    H    ASN 107           H        ASN 107 -13.519   3.759   3.713
  831    HA   ASN 107           HA       ASN 107 -16.041   3.262   4.792
  832   1HB   ASN 107          2HB       ASN 107 -16.207   5.784   4.070
  833   2HB   ASN 107          1HB       ASN 107 -16.041   5.186   2.420
  834   1HD2  ASN 107          1HD2      ASN 107 -17.667   2.800   2.629
  835   2HD2  ASN 107          2HD2      ASN 107 -19.329   3.343   2.907
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1   0.340  -3.287 -11.903
    2   2H    MET   1          2H        MET   1  -0.356  -2.106 -10.968
    3   3H    MET   1          3H        MET   1  -1.252  -3.374 -11.447
    4    HA   MET   1           HA       MET   1  -0.088  -1.223 -13.077
    5   1HB   MET   1          2HB       MET   1  -1.200  -2.123 -15.032
    6   2HB   MET   1          1HB       MET   1   0.041  -3.208 -14.415
    7   1HG   MET   1          1HG       MET   1  -2.955  -3.603 -14.061
    8   2HG   MET   1          2HG       MET   1  -1.946  -4.369 -15.273
    9   1HE   MET   1          1HE       MET   1  -3.964  -5.584 -12.932
   10   2HE   MET   1          2HE       MET   1  -3.103  -7.091 -12.548
   11   3HE   MET   1          3HE       MET   1  -3.316  -6.597 -14.244
   12    H    GLU   2           HN       GLU   2  -3.149  -2.805 -11.944
   13    HA   GLU   2           HA       GLU   2  -4.727  -0.380 -12.423
   14   1HB   GLU   2          1HB       GLU   2  -5.216  -2.842 -10.696
   15   2HB   GLU   2          2HB       GLU   2  -6.403  -1.569 -11.034
   16   1HG   GLU   2          2HG       GLU   2  -6.438  -2.154 -13.396
   17   2HG   GLU   2          1HG       GLU   2  -5.159  -3.355 -13.167
   18    H    ALA   3           H        ALA   3  -3.253  -2.172  -9.748
   19    HA   ALA   3           HA       ALA   3  -3.188   0.094  -7.903
   20   1HB   ALA   3          1HB       ALA   3  -3.244  -2.267  -7.069
   21   2HB   ALA   3          2HB       ALA   3  -1.735  -2.598  -7.931
   22   3HB   ALA   3          3HB       ALA   3  -1.744  -1.450  -6.576
   23    H    GLY   4           H        GLY   4  -1.399   1.621  -7.901
   24   1HA   GLY   4          1HA       GLY   4   0.389   1.485 -10.218
   25   2HA   GLY   4          2HA       GLY   4   0.373   2.705  -8.942
   26    H    ALA   5           H        ALA   5   2.811   2.166  -9.575
   27    HA   ALA   5           HA       ALA   5   3.886   0.341  -7.483
   28   1HB   ALA   5          1HB       ALA   5   4.395  -0.616  -9.699
   29   2HB   ALA   5          2HB       ALA   5   5.859   0.028  -8.927
   30   3HB   ALA   5          3HB       ALA   5   5.068   0.944 -10.228
   31    H    VAL   6           H        VAL   6   5.371   1.488  -6.126
   32    HA   VAL   6           HA       VAL   6   5.989   4.295  -6.950
   33    HB   VAL   6           HB       VAL   6   5.493   5.161  -4.782
   34   1HG1  VAL   6          1HG1      VAL   6   4.738   2.365  -3.890
   35   2HG1  VAL   6          2HG1      VAL   6   4.535   3.846  -2.946
   36   3HG1  VAL   6          3HG1      VAL   6   6.165   3.289  -3.339
   37   1HG2  VAL   6          1HG2      VAL   6   3.520   4.848  -6.304
   38   2HG2  VAL   6          2HG2      VAL   6   3.116   4.852  -4.562
   39   3HG2  VAL   6          3HG2      VAL   6   3.196   3.323  -5.438
   40    H    ASN   7           H        ASN   7   7.668   5.280  -5.747
   41    HA   ASN   7           HA       ASN   7   9.461   3.579  -4.228
   42   1HB   ASN   7          2HB       ASN   7  10.375   3.282  -6.463
   43   2HB   ASN   7          1HB       ASN   7  10.247   5.022  -6.814
   44   1HD2  ASN   7          1HD2      ASN   7  11.705   2.974  -4.185
   45   2HD2  ASN   7          2HD2      ASN   7  13.311   3.636  -4.359
   46    H    ASP   8           HN       ASP   8  11.240   5.042  -3.405
   47    HA   ASP   8           HA       ASP   8  10.342   6.835  -1.582
   48   1HB   ASP   8          2HB       ASP   8  12.980   7.082  -3.108
   49   2HB   ASP   8          1HB       ASP   8  12.623   7.857  -1.563
   50    H    ASP   9           HN       ASP   9  11.359   7.760  -4.842
   51    HA   ASP   9           HA       ASP   9  10.871  10.585  -4.563
   52   1HB   ASP   9          1HB       ASP   9  12.321   9.757  -6.311
   53   2HB   ASP   9          2HB       ASP   9  11.056   8.753  -7.004
   54    H    THR  10           H        THR  10   9.068   8.355  -6.683
   55    HA   THR  10           HA       THR  10   6.876   9.975  -7.188
   56    HB   THR  10           HB       THR  10   5.694   7.917  -7.830
   57    HG1  THR  10           HG1      THR  10   6.179   6.523  -6.237
   58   1HG2  THR  10          1HG2      THR  10   7.276   7.035  -9.439
   59   2HG2  THR  10          2HG2      THR  10   8.662   7.654  -8.531
   60   3HG2  THR  10          3HG2      THR  10   7.532   8.786  -9.302
   61    H    PHE  11           H        PHE  11   7.353   7.788  -4.487
   62    HA   PHE  11           HA       PHE  11   5.025   7.427  -3.193
   63   1HB   PHE  11          2HB       PHE  11   7.233   6.726  -2.450
   64   2HB   PHE  11          1HB       PHE  11   7.628   8.360  -1.974
   65    HD1  PHE  11           HD1      PHE  11   7.346   8.909   0.257
   66    HD2  PHE  11           HD2      PHE  11   5.116   5.615  -1.370
   67    HE1  PHE  11           HE1      PHE  11   6.582   8.325   2.540
   68    HE2  PHE  11           HE2      PHE  11   4.344   5.020   0.915
   69    HZ   PHE  11           HZ       PHE  11   5.096   6.356   2.871
   70    H    LYS  12           HN       LYS  12   6.996  10.267  -3.078
   71    HA   LYS  12           HA       LYS  12   5.646  12.009  -1.301
   72   1HB   LYS  12          1HB       LYS  12   7.040  12.656  -3.939
   73   2HB   LYS  12          2HB       LYS  12   6.561  13.826  -2.743
   74   1HG   LYS  12          1HG       LYS  12   8.559  11.518  -2.349
   75   2HG   LYS  12          2HG       LYS  12   8.989  13.174  -2.753
   76   1HD   LYS  12          1HD       LYS  12   9.286  13.462  -0.542
   77   2HD   LYS  12          2HD       LYS  12   7.529  13.617  -0.475
   78   1HE   LYS  12          1HE       LYS  12   8.290  12.041   1.226
   79   2HE   LYS  12          2HE       LYS  12   7.384  11.149  -0.006
   80   1HZ   LYS  12          1HZ       LYS  12   9.473  10.421  -0.930
   81   2HZ   LYS  12          2HZ       LYS  12   9.429  10.066   0.674
   82   3HZ   LYS  12          3HZ       LYS  12  10.317  11.344   0.143
   83    H    ASN  13           H        ASN  13   5.290  11.987  -4.853
   84    HA   ASN  13           HA       ASN  13   3.106  13.887  -4.893
   85   1HB   ASN  13          1HB       ASN  13   4.263  12.033  -7.015
   86   2HB   ASN  13          2HB       ASN  13   3.141  13.350  -7.314
   87   1HD2  ASN  13          2HD2      ASN  13   4.840  15.004  -5.100
   88   2HD2  ASN  13          1HD2      ASN  13   6.166  15.524  -6.119
   89    H    VAL  14           H        VAL  14   3.445  10.440  -5.104
   90    HA   VAL  14           HA       VAL  14   0.591   9.907  -5.959
   91    HB   VAL  14           HB       VAL  14   2.935   8.750  -6.603
   92   1HG1  VAL  14          1HG2      VAL  14   1.694   6.534  -6.951
   93   2HG1  VAL  14          2HG2      VAL  14   0.440   7.066  -5.824
   94   3HG1  VAL  14          3HG2      VAL  14   0.584   7.858  -7.416
   95   1HG2  VAL  14          1HG1      VAL  14   2.233   6.945  -4.459
   96   2HG2  VAL  14          2HG1      VAL  14   3.450   8.255  -4.360
   97   3HG2  VAL  14          3HG1      VAL  14   3.635   6.984  -5.556
   98    H    VAL  15           H        VAL  15   2.490   9.266  -3.048
   99    HA   VAL  15           HA       VAL  15   0.024   8.163  -1.802
  100    HB   VAL  15           HB       VAL  15   2.888   8.202  -0.876
  101   1HG1  VAL  15          1HG1      VAL  15   1.226   8.037   1.007
  102   2HG1  VAL  15          2HG1      VAL  15   2.178   6.572   0.821
  103   3HG1  VAL  15          3HG1      VAL  15   0.515   6.630   0.190
  104   1HG2  VAL  15          1HG2      VAL  15   1.466   6.121  -2.431
  105   2HG2  VAL  15          2HG2      VAL  15   2.755   5.701  -1.272
  106   3HG2  VAL  15          3HG2      VAL  15   3.107   6.807  -2.559
  107    H    LEU  16           H        LEU  16   2.650  10.515  -0.947
  108    HA   LEU  16           HA       LEU  16   1.160  11.348   1.401
  109   1HB   LEU  16          1HB       LEU  16   3.435  12.855   0.061
  110   2HB   LEU  16          2HB       LEU  16   2.837  13.021   1.704
  111    HG   LEU  16           HG       LEU  16   4.303  10.627   0.505
  112   1HD1  LEU  16          1HD2      LEU  16   5.001  12.525   2.786
  113   2HD1  LEU  16          2HD2      LEU  16   5.661  12.615   1.142
  114   3HD1  LEU  16          3HD2      LEU  16   6.011  11.204   2.165
  115   1HD2  LEU  16          1HD1      LEU  16   4.235   9.636   2.787
  116   2HD2  LEU  16          2HD1      LEU  16   2.629   9.719   2.066
  117   3HD2  LEU  16          3HD1      LEU  16   3.109  10.904   3.301
  118    H    GLU  17           HN       GLU  17   1.843  13.129  -1.673
  119    HA   GLU  17           HA       GLU  17  -0.110  15.182  -0.992
  120   1HB   GLU  17          2HB       GLU  17   1.402  14.556  -3.551
  121   2HB   GLU  17          1HB       GLU  17   0.534  16.051  -3.213
  122   1HG   GLU  17          1HG       GLU  17   2.049  16.628  -1.399
  123   2HG   GLU  17          2HG       GLU  17   2.898  15.084  -1.527
  124    H    SER  18           H        SER  18  -1.532  12.789  -0.859
  125    HA   SER  18           HA       SER  18  -2.944  12.365  -3.415
  126   1HB   SER  18          1HB       SER  18  -3.997  10.535  -2.054
  127   2HB   SER  18          2HB       SER  18  -2.236  10.403  -2.210
  128    HG   SER  18           HG       SER  18  -2.030  10.752  -0.122
  129    H    SER  19           H        SER  19  -5.320  12.273  -3.344
  130    HA   SER  19           HA       SER  19  -6.593  14.365  -1.651
  131   1HB   SER  19          1HB       SER  19  -8.345  14.108  -3.510
  132   2HB   SER  19          2HB       SER  19  -6.786  14.809  -3.995
  133    HG   SER  19           HG       SER  19  -7.391  13.159  -5.451
  134    H    VAL  20           H        VAL  20  -7.511  11.433  -3.347
  135    HA   VAL  20           HA       VAL  20  -9.288  10.446  -1.226
  136    HB   VAL  20           HB       VAL  20  -9.617   8.557  -2.786
  137   1HG1  VAL  20          1HG1      VAL  20  -7.652   9.912  -4.671
  138   2HG1  VAL  20          2HG1      VAL  20  -7.355   8.401  -3.785
  139   3HG1  VAL  20          3HG1      VAL  20  -8.643   8.481  -4.991
  140   1HG2  VAL  20          1HG2      VAL  20  -9.790  11.247  -4.194
  141   2HG2  VAL  20          2HG2      VAL  20 -10.961  10.615  -3.016
  142   3HG2  VAL  20          3HG2      VAL  20 -10.726   9.785  -4.563
  143    HA   PRO  21           HA       PRO  21  -6.424   7.924   0.970
  144   1HB   PRO  21          2HB       PRO  21  -8.084   5.519   0.319
  145   2HB   PRO  21          1HB       PRO  21  -7.437   5.995   1.905
  146   1HG   PRO  21          2HG       PRO  21 -10.034   6.348   1.202
  147   2HG   PRO  21          1HG       PRO  21  -9.185   7.597   2.136
  148   1HD   PRO  21          1HD       PRO  21  -9.863   7.577  -0.792
  149   2HD   PRO  21          2HD       PRO  21  -9.802   8.953   0.342
  150    H    VAL  22           H        VAL  22  -4.985   5.994   0.792
  151    HA   VAL  22           HA       VAL  22  -4.465   4.956  -1.927
  152    HB   VAL  22           HB       VAL  22  -2.413   6.468  -0.258
  153   1HG1  VAL  22          1HG1      VAL  22  -0.987   6.203  -2.258
  154   2HG1  VAL  22          2HG1      VAL  22  -1.473   4.637  -1.607
  155   3HG1  VAL  22          3HG1      VAL  22  -2.278   5.291  -3.053
  156   1HG2  VAL  22          1HG2      VAL  22  -3.874   7.349  -2.774
  157   2HG2  VAL  22          2HG2      VAL  22  -2.395   8.094  -2.151
  158   3HG2  VAL  22          3HG2      VAL  22  -3.867   8.145  -1.182
  159    H    LEU  23           H        LEU  23  -4.168   2.717  -1.659
  160    HA   LEU  23           HA       LEU  23  -3.298   1.696   1.005
  161   1HB   LEU  23          2HB       LEU  23  -5.365   0.916  -0.060
  162   2HB   LEU  23          1HB       LEU  23  -4.478   0.311  -1.440
  163    HG   LEU  23           HG       LEU  23  -3.968  -0.642   1.404
  164   1HD1  LEU  23          1HD1      LEU  23  -2.157  -1.355  -0.112
  165   2HD1  LEU  23          2HD1      LEU  23  -3.207  -2.742   0.148
  166   3HD1  LEU  23          3HD1      LEU  23  -3.333  -1.819  -1.357
  167   1HD2  LEU  23          1HD2      LEU  23  -5.840  -1.823  -0.684
  168   2HD2  LEU  23          2HD2      LEU  23  -6.333  -0.988   0.804
  169   3HD2  LEU  23          3HD2      LEU  23  -5.459  -2.525   0.904
  170    H    VAL  24           H        VAL  24  -1.057   1.771   1.070
  171    HA   VAL  24           HA       VAL  24   0.502   1.142  -1.403
  172    HB   VAL  24           HB       VAL  24   1.427   2.265   1.265
  173   1HG1  VAL  24          1HG1      VAL  24   2.789   2.080  -1.462
  174   2HG1  VAL  24          2HG1      VAL  24   3.229   1.142  -0.020
  175   3HG1  VAL  24          3HG1      VAL  24   3.449   2.894  -0.030
  176   1HG2  VAL  24          1HG2      VAL  24   1.563   4.407   0.162
  177   2HG2  VAL  24          2HG2      VAL  24   0.862   3.741  -1.329
  178   3HG2  VAL  24          3HG2      VAL  24  -0.111   3.856   0.160
  179    H    ASP  25           HN       ASP  25   0.920  -1.077  -1.600
  180    HA   ASP  25           HA       ASP  25   1.334  -2.671   0.878
  181   1HB   ASP  25          2HB       ASP  25  -0.011  -3.728  -0.844
  182   2HB   ASP  25          1HB       ASP  25   1.270  -3.465  -2.032
  183    H    PHE  26           H        PHE  26   3.363  -2.673   1.754
  184    HA   PHE  26           HA       PHE  26   5.697  -1.878   0.145
  185   1HB   PHE  26          2HB       PHE  26   5.338  -2.831   2.997
  186   2HB   PHE  26          1HB       PHE  26   6.904  -2.616   2.240
  187    HD1  PHE  26           HD1      PHE  26   3.762  -0.434   2.216
  188    HD2  PHE  26           HD2      PHE  26   7.977  -0.769   3.105
  189    HE1  PHE  26           HE1      PHE  26   3.855   1.962   2.719
  190    HE2  PHE  26           HE2      PHE  26   7.989   1.594   3.850
  191    HZ   PHE  26           HZ       PHE  26   5.910   2.957   3.685
  192    H    TRP  27           H        TRP  27   6.531  -3.367  -1.252
  193    HA   TRP  27           HA       TRP  27   6.319  -6.269  -0.578
  194   1HB   TRP  27          2HB       TRP  27   5.749  -6.791  -2.809
  195   2HB   TRP  27          1HB       TRP  27   4.614  -5.559  -2.285
  196    HD1  TRP  27           HD1      TRP  27   5.313  -3.018  -3.238
  197    HE1  TRP  27           HE1      TRP  27   6.446  -2.290  -5.458
  198    HE3  TRP  27           HE3      TRP  27   7.045  -7.568  -4.793
  199    HZ2  TRP  27           HZ2      TRP  27   8.027  -3.524  -7.505
  200    HZ3  TRP  27           HZ3      TRP  27   8.346  -7.764  -6.883
  201    HH2  TRP  27           HH2      TRP  27   8.848  -5.754  -8.246
  202    H    ALA  28           H        ALA  28   7.654  -7.409  -2.503
  203    HA   ALA  28           HA       ALA  28   9.915  -6.112  -3.563
  204   1HB   ALA  28          1HB       ALA  28  10.721  -6.237  -1.131
  205   2HB   ALA  28          2HB       ALA  28  10.483  -7.997  -1.208
  206   3HB   ALA  28          3HB       ALA  28  11.701  -7.215  -2.214
  207    HA   PRO  29           HA       PRO  29   9.375  -9.848  -5.941
  208   1HB   PRO  29          1HB       PRO  29  11.905 -10.591  -6.740
  209   2HB   PRO  29          2HB       PRO  29  10.980  -9.224  -7.436
  210   1HG   PRO  29          1HG       PRO  29  13.116  -9.114  -5.290
  211   2HG   PRO  29          2HG       PRO  29  12.952  -8.070  -6.731
  212   1HD   PRO  29          1HD       PRO  29  12.054  -7.224  -4.326
  213   2HD   PRO  29          2HD       PRO  29  11.073  -6.929  -5.769
  214    H    TRP  30           H        TRP  30  11.934  -9.907  -3.483
  215    HA   TRP  30           HA       TRP  30  11.812 -12.772  -3.025
  216   1HB   TRP  30          1HB       TRP  30  13.266 -12.157  -1.085
  217   2HB   TRP  30          2HB       TRP  30  13.862 -11.659  -2.658
  218    HD1  TRP  30           HD1      TRP  30  14.567  -9.231  -2.935
  219    HE1  TRP  30           HE1      TRP  30  14.652  -7.155  -1.424
  220    HE3  TRP  30           HE3      TRP  30  11.491 -10.847   0.853
  221    HZ2  TRP  30           HZ2      TRP  30  13.365  -6.242   0.989
  222    HZ3  TRP  30           HZ3      TRP  30  10.982  -9.371   2.741
  223    HH2  TRP  30           HH2      TRP  30  11.723  -7.008   2.726
  224    H    CYS  31           H        CYS  31   9.523 -10.362  -2.307
  225    HA   CYS  31           HA       CYS  31   9.008 -10.969   0.470
  226   1HB   CYS  31          1HB       CYS  31   8.059  -8.981  -0.521
  227   2HB   CYS  31          2HB       CYS  31   7.210  -9.957  -1.720
  228    H    GLY  32           H        GLY  32   7.239 -12.094  -2.455
  229   1HA   GLY  32          2HA       GLY  32   6.547 -14.318  -2.846
  230   2HA   GLY  32          1HA       GLY  32   6.571 -14.712  -1.139
  231    HA   PRO  33           HA       PRO  33   2.237 -14.121  -0.692
  232   1HB   PRO  33          2HB       PRO  33   2.840 -11.958   1.335
  233   2HB   PRO  33          1HB       PRO  33   1.591 -13.240   1.390
  234   1HG   PRO  33          1HG       PRO  33   3.917 -13.620   2.721
  235   2HG   PRO  33          2HG       PRO  33   3.280 -14.943   1.697
  236   1HD   PRO  33          2HD       PRO  33   5.403 -12.911   1.028
  237   2HD   PRO  33          1HD       PRO  33   5.441 -14.683   0.774
  238    H    CYS  34           H        CYS  34   3.992 -11.073  -0.601
  239    HA   CYS  34           HA       CYS  34   2.240  -9.152  -1.506
  240   1HB   CYS  34          2HB       CYS  34   5.094  -9.418  -2.448
  241   2HB   CYS  34          1HB       CYS  34   4.040  -8.000  -2.409
  242    H    ARG  35           HN       ARG  35   4.060 -11.534  -3.504
  243    HA   ARG  35           HA       ARG  35   3.299 -10.391  -6.058
  244   1HB   ARG  35          1HB       ARG  35   4.583 -13.025  -5.211
  245   2HB   ARG  35          2HB       ARG  35   4.263 -12.571  -6.876
  246   1HG   ARG  35          2HG       ARG  35   5.735 -10.673  -6.771
  247   2HG   ARG  35          1HG       ARG  35   5.834 -10.741  -5.008
  248   1HD   ARG  35          1HD       ARG  35   7.868 -11.545  -6.013
  249   2HD   ARG  35          2HD       ARG  35   7.084 -12.837  -5.085
  250    HE   ARG  35           HE       ARG  35   6.208 -13.096  -7.740
  251   1HH1  ARG  35          1HH2      ARG  35   9.291 -13.183  -5.980
  252   2HH1  ARG  35          2HH2      ARG  35  10.021 -14.349  -7.048
  253   1HH2  ARG  35          1HH1      ARG  35   7.178 -14.597  -9.164
  254   2HH2  ARG  35          2HH1      ARG  35   8.810 -15.149  -8.904
  255    H    ILE  36           H        ILE  36   2.193 -13.164  -4.056
  256    HA   ILE  36           HA       ILE  36   0.119 -13.792  -6.064
  257    HB   ILE  36           HB       ILE  36  -0.613 -15.532  -4.482
  258   1HG1  ILE  36          2HG1      ILE  36   1.070 -16.225  -2.728
  259   2HG1  ILE  36          1HG1      ILE  36   1.748 -14.612  -2.761
  260   1HG2  ILE  36          1HG2      ILE  36   1.334 -16.944  -4.912
  261   2HG2  ILE  36          2HG2      ILE  36   2.365 -15.519  -5.142
  262   3HG2  ILE  36          3HG2      ILE  36   1.058 -15.875  -6.291
  263   1HD1  ILE  36          1HD1      ILE  36  -0.556 -13.762  -2.056
  264   2HD1  ILE  36          2HD1      ILE  36  -1.157 -15.425  -2.128
  265   3HD1  ILE  36          3HD1      ILE  36   0.061 -14.974  -0.924
  266    H    ILE  37           H        ILE  37   0.371 -11.561  -3.456
  267    HA   ILE  37           HA       ILE  37  -2.502 -11.117  -3.192
  268    HB   ILE  37           HB       ILE  37   0.035  -9.790  -2.207
  269   1HG1  ILE  37          2HG1      ILE  37  -2.471 -10.720  -0.742
  270   2HG1  ILE  37          1HG1      ILE  37  -1.109 -11.783  -1.100
  271   1HG2  ILE  37          1HG2      ILE  37  -1.274  -7.865  -2.822
  272   2HG2  ILE  37          2HG2      ILE  37  -2.736  -8.553  -2.067
  273   3HG2  ILE  37          3HG2      ILE  37  -1.352  -8.042  -1.082
  274   1HD1  ILE  37          1HD1      ILE  37  -1.021  -9.325   0.686
  275   2HD1  ILE  37          2HD1      ILE  37  -0.851 -11.022   1.146
  276   3HD1  ILE  37          3HD1      ILE  37   0.409 -10.247   0.169
  277    H    ALA  38           H        ALA  38   0.170  -9.598  -5.010
  278    HA   ALA  38           HA       ALA  38  -0.640  -7.481  -6.156
  279   1HB   ALA  38          1HB       ALA  38   0.590  -7.986  -8.161
  280   2HB   ALA  38          2HB       ALA  38   1.412  -8.698  -6.761
  281   3HB   ALA  38          3HB       ALA  38   0.468  -9.715  -7.876
  282    HA   PRO  39           HA       PRO  39  -3.439  -9.342  -9.631
  283   1HB   PRO  39          2HB       PRO  39  -4.627 -11.794  -8.424
  284   2HB   PRO  39          1HB       PRO  39  -3.959 -11.572 -10.061
  285   1HG   PRO  39          1HG       PRO  39  -2.636 -13.060  -8.172
  286   2HG   PRO  39          2HG       PRO  39  -1.737 -11.989  -9.293
  287   1HD   PRO  39          2HD       PRO  39  -2.676 -11.338  -6.485
  288   2HD   PRO  39          1HD       PRO  39  -1.062 -11.197  -7.070
  289    H    VAL  40           H        VAL  40  -4.140 -10.034  -6.256
  290    HA   VAL  40           HA       VAL  40  -6.966  -9.329  -6.317
  291    HB   VAL  40           HB       VAL  40  -5.256 -11.033  -4.841
  292   1HG1  VAL  40          1HG1      VAL  40  -5.507 -10.571  -2.579
  293   2HG1  VAL  40          2HG1      VAL  40  -6.310  -9.015  -2.926
  294   3HG1  VAL  40          3HG1      VAL  40  -4.604  -9.257  -3.307
  295   1HG2  VAL  40          1HG2      VAL  40  -7.345 -11.673  -3.687
  296   2HG2  VAL  40          2HG2      VAL  40  -8.143 -10.211  -4.307
  297   3HG2  VAL  40          3HG2      VAL  40  -7.599 -11.483  -5.428
  298    H    VAL  41           H        VAL  41  -3.923  -7.869  -5.035
  299    HA   VAL  41           HA       VAL  41  -5.245  -5.404  -4.111
  300    HB   VAL  41           HB       VAL  41  -2.780  -6.497  -3.814
  301   1HG1  VAL  41          1HG2      VAL  41  -3.766  -4.524  -2.407
  302   2HG1  VAL  41          2HG2      VAL  41  -2.066  -4.247  -2.831
  303   3HG1  VAL  41          3HG2      VAL  41  -3.341  -3.446  -3.749
  304   1HG2  VAL  41          1HG1      VAL  41  -2.126  -6.035  -6.051
  305   2HG2  VAL  41          2HG1      VAL  41  -1.035  -5.502  -4.783
  306   3HG2  VAL  41          3HG1      VAL  41  -2.037  -4.321  -5.664
  307    H    ASP  42           HN       ASP  42  -3.888  -6.382  -7.237
  308    HA   ASP  42           HA       ASP  42  -4.424  -3.834  -8.469
  309   1HB   ASP  42          1HB       ASP  42  -3.922  -6.624  -9.533
  310   2HB   ASP  42          2HB       ASP  42  -4.549  -5.387 -10.601
  311    H    GLU  43           HN       GLU  43  -6.438  -6.927  -8.614
  312    HA   GLU  43           HA       GLU  43  -8.471  -5.595 -10.062
  313   1HB   GLU  43          1HB       GLU  43  -9.763  -7.412  -9.774
  314   2HB   GLU  43          2HB       GLU  43  -8.175  -8.134  -9.517
  315   1HG   GLU  43          2HG       GLU  43  -8.619  -7.879  -7.006
  316   2HG   GLU  43          1HG       GLU  43 -10.271  -7.380  -7.409
  317    H    ILE  44           H        ILE  44  -7.916  -5.869  -6.551
  318    HA   ILE  44           HA       ILE  44 -10.254  -4.526  -5.651
  319    HB   ILE  44           HB       ILE  44  -7.446  -4.832  -4.553
  320   1HG1  ILE  44          1HG1      ILE  44  -9.199  -6.746  -4.673
  321   2HG1  ILE  44          2HG1      ILE  44  -8.375  -6.439  -3.151
  322   1HG2  ILE  44          1HG2      ILE  44  -9.703  -3.340  -3.185
  323   2HG2  ILE  44          2HG2      ILE  44  -8.111  -2.709  -3.638
  324   3HG2  ILE  44          3HG2      ILE  44  -8.239  -3.945  -2.385
  325   1HD1  ILE  44          1HD1      ILE  44 -10.368  -5.320  -2.254
  326   2HD1  ILE  44          2HD1      ILE  44 -10.778  -6.924  -2.864
  327   3HD1  ILE  44          3HD1      ILE  44 -11.197  -5.491  -3.817
  328    H    ALA  45           H        ALA  45  -7.037  -3.219  -6.660
  329    HA   ALA  45           HA       ALA  45  -7.620  -0.499  -6.310
  330   1HB   ALA  45          1HB       ALA  45  -5.931  -0.057  -7.940
  331   2HB   ALA  45          2HB       ALA  45  -5.440  -1.603  -7.190
  332   3HB   ALA  45          3HB       ALA  45  -6.195  -1.570  -8.780
  333    H    GLY  46           H        GLY  46  -8.323  -2.633  -9.123
  334   1HA   GLY  46          2HA       GLY  46  -9.621  -0.851 -10.836
  335   2HA   GLY  46          1HA       GLY  46 -10.027  -2.568 -10.659
  336    H    GLU  47           HN       GLU  47 -11.160  -2.892  -8.265
  337    HA   GLU  47           HA       GLU  47 -13.768  -1.821  -8.584
  338   1HB   GLU  47          2HB       GLU  47 -12.628  -2.877  -5.975
  339   2HB   GLU  47          1HB       GLU  47 -14.291  -2.889  -6.531
  340   1HG   GLU  47          2HG       GLU  47 -11.965  -4.639  -7.376
  341   2HG   GLU  47          1HG       GLU  47 -13.487  -5.112  -6.690
  342    H    TYR  48           H        TYR  48 -11.325  -0.973  -6.151
  343    HA   TYR  48           HA       TYR  48 -13.059   1.108  -5.005
  344   1HB   TYR  48          1HB       TYR  48 -10.296   0.062  -4.329
  345   2HB   TYR  48          2HB       TYR  48 -11.020   1.432  -3.503
  346    HD1  TYR  48           HD1      TYR  48 -12.777   1.198  -1.879
  347    HD2  TYR  48           HD2      TYR  48 -11.438  -2.219  -4.130
  348    HE1  TYR  48           HE1      TYR  48 -14.097  -0.290  -0.416
  349    HE2  TYR  48           HE2      TYR  48 -12.788  -3.704  -2.695
  350    HH   TYR  48           HH       TYR  48 -14.818  -2.473  -0.024
  351    H    LYS  49           HN       LYS  49 -10.782   1.211  -7.552
  352    HA   LYS  49           HA       LYS  49  -9.207   3.258  -7.488
  353   1HB   LYS  49          2HB       LYS  49  -9.713   1.991  -9.523
  354   2HB   LYS  49          1HB       LYS  49 -11.307   2.751  -9.620
  355   1HG   LYS  49          1HG       LYS  49 -10.286   4.896 -10.193
  356   2HG   LYS  49          2HG       LYS  49  -8.670   4.247  -9.868
  357   1HD   LYS  49          1HD       LYS  49  -9.179   4.377 -12.270
  358   2HD   LYS  49          2HD       LYS  49  -8.842   2.717 -11.774
  359   1HE   LYS  49          2HE       LYS  49 -11.717   3.728 -11.896
  360   2HE   LYS  49          1HE       LYS  49 -10.869   3.267 -13.378
  361   1HZ   LYS  49          1HZ       LYS  49 -10.491   1.112 -12.486
  362   2HZ   LYS  49          2HZ       LYS  49 -11.284   1.467 -11.090
  363   3HZ   LYS  49          3HZ       LYS  49 -12.099   1.457 -12.512
  364    H    ASP  50           HN       ASP  50 -12.577   3.934  -8.392
  365    HA   ASP  50           HA       ASP  50 -12.538   6.695  -8.523
  366   1HB   ASP  50          1HB       ASP  50 -14.724   4.787  -7.566
  367   2HB   ASP  50          2HB       ASP  50 -14.985   6.491  -7.915
  368    H    LYS  51           HN       LYS  51 -12.851   4.701  -5.653
  369    HA   LYS  51           HA       LYS  51 -13.536   6.986  -3.905
  370   1HB   LYS  51          1HB       LYS  51 -13.087   4.217  -2.860
  371   2HB   LYS  51          2HB       LYS  51 -14.251   5.428  -2.354
  372   1HG   LYS  51          2HG       LYS  51 -15.569   4.983  -4.466
  373   2HG   LYS  51          1HG       LYS  51 -14.414   3.691  -4.862
  374   1HD   LYS  51          2HD       LYS  51 -14.948   2.587  -2.662
  375   2HD   LYS  51          1HD       LYS  51 -16.201   3.811  -2.406
  376   1HE   LYS  51          2HE       LYS  51 -17.238   1.811  -3.302
  377   2HE   LYS  51          1HE       LYS  51 -17.309   3.074  -4.542
  378   1HZ   LYS  51          1HZ       LYS  51 -15.422   2.036  -5.603
  379   2HZ   LYS  51          2HZ       LYS  51 -15.331   0.895  -4.419
  380   3HZ   LYS  51          3HZ       LYS  51 -16.638   0.948  -5.417
  381    H    LEU  52           H        LEU  52 -10.919   4.658  -4.462
  382    HA   LEU  52           HA       LEU  52  -9.041   6.059  -2.694
  383   1HB   LEU  52          1HB       LEU  52  -9.808   4.886  -0.880
  384   2HB   LEU  52          2HB       LEU  52 -10.759   3.839  -1.886
  385    HG   LEU  52           HG       LEU  52  -8.770   2.419  -2.356
  386   1HD1  LEU  52          1HD2      LEU  52  -6.901   2.377  -0.985
  387   2HD1  LEU  52          2HD2      LEU  52  -7.033   4.106  -1.349
  388   3HD1  LEU  52          3HD2      LEU  52  -7.568   3.463   0.220
  389   1HD2  LEU  52          1HD1      LEU  52  -9.814   2.774   0.498
  390   2HD2  LEU  52          2HD1      LEU  52  -9.083   1.286  -0.147
  391   3HD2  LEU  52          3HD1      LEU  52 -10.629   1.873  -0.791
  392    H    LYS  53           HN       LYS  53  -6.924   5.382  -3.078
  393    HA   LYS  53           HA       LYS  53  -6.478   4.135  -5.738
  394   1HB   LYS  53          1HB       LYS  53  -5.619   6.487  -4.606
  395   2HB   LYS  53          2HB       LYS  53  -4.281   5.439  -4.185
  396   1HG   LYS  53          2HG       LYS  53  -5.383   6.092  -6.965
  397   2HG   LYS  53          1HG       LYS  53  -3.910   6.715  -6.221
  398   1HD   LYS  53          1HD       LYS  53  -3.103   4.245  -6.137
  399   2HD   LYS  53          2HD       LYS  53  -4.460   3.914  -7.246
  400   1HE   LYS  53          1HE       LYS  53  -2.526   4.185  -8.584
  401   2HE   LYS  53          2HE       LYS  53  -3.529   5.624  -8.824
  402   1HZ   LYS  53          1HZ       LYS  53  -2.090   6.779  -7.286
  403   2HZ   LYS  53          2HZ       LYS  53  -1.214   6.148  -8.528
  404   3HZ   LYS  53          3HZ       LYS  53  -1.186   5.421  -7.050
  405    H    CYS  54           H        CYS  54  -4.723   2.507  -5.957
  406    HA   CYS  54           HA       CYS  54  -3.908   1.124  -3.435
  407   1HB   CYS  54          2HB       CYS  54  -5.427   0.090  -5.753
  408   2HB   CYS  54          1HB       CYS  54  -3.892  -0.739  -5.457
  409    HG   CYS  54           HG       CYS  54  -5.616  -2.222  -4.480
  410    H    VAL  55           H        VAL  55  -1.736   0.326  -3.536
  411    HA   VAL  55           HA       VAL  55  -0.212   0.740  -5.967
  412    HB   VAL  55           HB       VAL  55   1.245   2.339  -4.086
  413   1HG1  VAL  55          1HG1      VAL  55  -1.514   3.548  -4.424
  414   2HG1  VAL  55          2HG1      VAL  55  -0.902   2.827  -2.914
  415   3HG1  VAL  55          3HG1      VAL  55  -0.090   4.229  -3.635
  416   1HG2  VAL  55          1HG2      VAL  55   1.418   2.542  -6.475
  417   2HG2  VAL  55          2HG2      VAL  55   0.940   4.104  -5.802
  418   3HG2  VAL  55          3HG2      VAL  55  -0.267   3.090  -6.612
  419    H    LYS  56           HN       LYS  56   2.081   0.285  -5.682
  420    HA   LYS  56           HA       LYS  56   2.674  -1.531  -3.388
  421   1HB   LYS  56          2HB       LYS  56   2.518  -1.912  -6.324
  422   2HB   LYS  56          1HB       LYS  56   3.922  -2.642  -5.558
  423   1HG   LYS  56          1HG       LYS  56   2.552  -3.867  -3.980
  424   2HG   LYS  56          2HG       LYS  56   1.075  -3.078  -4.561
  425   1HD   LYS  56          1HD       LYS  56   2.877  -4.863  -6.270
  426   2HD   LYS  56          2HD       LYS  56   1.441  -5.416  -5.394
  427   1HE   LYS  56          2HE       LYS  56   0.082  -3.684  -6.663
  428   2HE   LYS  56          1HE       LYS  56   1.502  -3.384  -7.678
  429   1HZ   LYS  56          1HZ       LYS  56   1.456  -5.667  -8.327
  430   2HZ   LYS  56          2HZ       LYS  56  -0.022  -4.993  -8.626
  431   3HZ   LYS  56          3HZ       LYS  56   0.180  -5.974  -7.332
  432    H    LEU  57           H        LEU  57   4.376  -0.824  -2.278
  433    HA   LEU  57           HA       LEU  57   6.460   0.877  -3.595
  434   1HB   LEU  57          1HB       LEU  57   5.445   1.827  -1.645
  435   2HB   LEU  57          2HB       LEU  57   5.788   0.401  -0.668
  436    HG   LEU  57           HG       LEU  57   8.084   1.889  -1.961
  437   1HD1  LEU  57          1HD2      LEU  57   9.029   1.278   0.413
  438   2HD1  LEU  57          2HD2      LEU  57   8.785  -0.052  -0.728
  439   3HD1  LEU  57          3HD2      LEU  57   7.618   0.240   0.559
  440   1HD2  LEU  57          1HD1      LEU  57   6.693   3.658  -0.960
  441   2HD2  LEU  57          2HD1      LEU  57   6.647   2.766   0.576
  442   3HD2  LEU  57          3HD1      LEU  57   8.182   3.416  -0.044
  443    H    ASN  58           H        ASN  58   8.215  -0.146  -4.336
  444    HA   ASN  58           HA       ASN  58   8.853  -2.874  -3.423
  445   1HB   ASN  58          1HB       ASN  58   9.200  -2.237  -5.763
  446   2HB   ASN  58          2HB       ASN  58  10.390  -1.038  -5.275
  447   1HD2  ASN  58          2HD2      ASN  58  10.175  -4.116  -6.496
  448   2HD2  ASN  58          1HD2      ASN  58  11.676  -4.761  -5.857
  449    H    THR  59           H        THR  59   9.783  -3.191  -1.565
  450    HA   THR  59           HA       THR  59  10.778  -1.084   0.116
  451    HB   THR  59           HB       THR  59  11.005  -4.103   0.474
  452    HG1  THR  59           HG1      THR  59   8.872  -3.639   0.025
  453   1HG2  THR  59          1HG2      THR  59  10.603  -1.880   2.514
  454   2HG2  THR  59          2HG2      THR  59  12.165  -2.685   2.210
  455   3HG2  THR  59          3HG2      THR  59  10.793  -3.610   2.849
  456    H    ASP  60           HN       ASP  60  12.328  -3.229  -2.160
  457    HA   ASP  60           HA       ASP  60  14.992  -3.157  -0.950
  458   1HB   ASP  60          1HB       ASP  60  13.778  -5.024  -2.356
  459   2HB   ASP  60          2HB       ASP  60  14.260  -4.076  -3.753
  460    H    GLU  61           HN       GLU  61  13.148  -1.777  -3.581
  461    HA   GLU  61           HA       GLU  61  15.242  -0.068  -4.658
  462   1HB   GLU  61          2HB       GLU  61  13.217  -1.141  -5.882
  463   2HB   GLU  61          1HB       GLU  61  12.244   0.109  -5.077
  464   1HG   GLU  61          1HG       GLU  61  12.704   0.893  -7.244
  465   2HG   GLU  61          2HG       GLU  61  13.730   1.854  -6.185
  466    H    SER  62           H        SER  62  12.723   0.178  -2.235
  467    HA   SER  62           HA       SER  62  13.160   3.075  -1.824
  468   1HB   SER  62          1HB       SER  62  10.741   1.459  -0.972
  469   2HB   SER  62          2HB       SER  62  10.960   3.209  -1.098
  470    HG   SER  62           HG       SER  62  10.766   1.223  -3.104
  471    HA   PRO  63           HA       PRO  63  14.613   0.410   1.893
  472   1HB   PRO  63          1HB       PRO  63  17.227   1.145   1.952
  473   2HB   PRO  63          2HB       PRO  63  16.628  -0.136   0.853
  474   1HG   PRO  63          2HG       PRO  63  17.019   2.811   0.180
  475   2HG   PRO  63          1HG       PRO  63  17.658   1.420  -0.702
  476   1HD   PRO  63          1HD       PRO  63  15.367   2.514  -1.515
  477   2HD   PRO  63          2HD       PRO  63  15.453   0.730  -1.413
  478    H    ASN  64           H        ASN  64  15.147   3.661   0.705
  479    HA   ASN  64           HA       ASN  64  15.784   4.981   3.184
  480   1HB   ASN  64          1HB       ASN  64  14.280   6.177   0.831
  481   2HB   ASN  64          2HB       ASN  64  15.024   7.053   2.162
  482   1HD2  ASN  64          2HD2      ASN  64  15.606   5.599  -0.951
  483   2HD2  ASN  64          1HD2      ASN  64  17.350   5.845  -0.933
  484    H    VAL  65           H        VAL  65  12.575   4.970   1.570
  485    HA   VAL  65           HA       VAL  65  11.152   5.863   3.848
  486    HB   VAL  65           HB       VAL  65  10.405   4.312   1.343
  487   1HG1  VAL  65          1HG2      VAL  65   8.720   3.689   2.984
  488   2HG1  VAL  65          2HG2      VAL  65   8.036   4.883   1.873
  489   3HG1  VAL  65          3HG2      VAL  65   8.556   5.388   3.495
  490   1HG2  VAL  65          1HG1      VAL  65   9.534   6.514   0.686
  491   2HG2  VAL  65          2HG1      VAL  65   9.895   7.172   2.301
  492   3HG2  VAL  65          3HG1      VAL  65  11.212   6.721   1.221
  493    H    ALA  66           H        ALA  66  11.816   2.571   2.699
  494    HA   ALA  66           HA       ALA  66  10.467   1.115   4.643
  495   1HB   ALA  66          1HB       ALA  66  11.730   0.170   2.681
  496   2HB   ALA  66          2HB       ALA  66  12.065  -0.693   4.193
  497   3HB   ALA  66          3HB       ALA  66  13.238   0.458   3.576
  498    H    SER  67           H        SER  67  13.776   2.519   4.920
  499    HA   SER  67           HA       SER  67  14.246   1.541   7.583
  500   1HB   SER  67          2HB       SER  67  15.529   3.874   6.087
  501   2HB   SER  67          1HB       SER  67  16.130   3.121   7.577
  502    HG   SER  67           HG       SER  67  15.824   1.897   5.034
  503    H    GLU  68           HN       GLU  68  13.067   4.634   6.268
  504    HA   GLU  68           HA       GLU  68  12.924   6.116   8.674
  505   1HB   GLU  68          1HB       GLU  68  11.121   6.159   6.221
  506   2HB   GLU  68          2HB       GLU  68  11.039   7.351   7.514
  507   1HG   GLU  68          1HG       GLU  68  13.181   8.230   7.051
  508   2HG   GLU  68          2HG       GLU  68  13.676   6.835   6.096
  509    H    TYR  69           H        TYR  69  10.474   3.909   7.227
  510    HA   TYR  69           HA       TYR  69   8.707   4.209   9.553
  511   1HB   TYR  69          2HB       TYR  69   8.702   2.538   7.027
  512   2HB   TYR  69          1HB       TYR  69   7.598   2.181   8.342
  513    HD1  TYR  69           HD1      TYR  69   6.152   4.129   9.292
  514    HD2  TYR  69           HD2      TYR  69   8.082   4.230   5.447
  515    HE1  TYR  69           HE1      TYR  69   4.741   6.057   8.640
  516    HE2  TYR  69           HE2      TYR  69   6.672   6.177   4.796
  517    HH   TYR  69           HH       TYR  69   4.352   7.676   7.051
  518    H    GLY  70           H        GLY  70  11.135   1.832   8.524
  519   1HA   GLY  70          1HA       GLY  70  12.375   0.518  10.057
  520   2HA   GLY  70          2HA       GLY  70  11.097   0.658  11.271
  521    H    ILE  71           H        ILE  71  11.165  -0.278   7.820
  522    HA   ILE  71           HA       ILE  71   9.319  -2.487   8.231
  523    HB   ILE  71           HB       ILE  71  10.881  -1.593   5.800
  524   1HG1  ILE  71          1HG1      ILE  71   9.352   0.180   6.688
  525   2HG1  ILE  71          2HG1      ILE  71   8.918  -0.431   5.110
  526   1HG2  ILE  71          1HG2      ILE  71  10.136  -3.876   5.483
  527   2HG2  ILE  71          2HG2      ILE  71   9.048  -2.822   4.571
  528   3HG2  ILE  71          3HG2      ILE  71   8.528  -3.505   6.126
  529   1HD1  ILE  71          1HD1      ILE  71   7.072  -1.737   6.066
  530   2HD1  ILE  71          2HD1      ILE  71   6.988  -0.039   6.540
  531   3HD1  ILE  71          3HD1      ILE  71   7.550  -1.230   7.711
  532    H    ARG  72           HN       ARG  72  10.295  -3.899   9.600
  533    HA   ARG  72           HA       ARG  72  12.911  -5.076   9.100
  534   1HB   ARG  72          1HB       ARG  72  12.362  -6.522  10.933
  535   2HB   ARG  72          2HB       ARG  72  11.911  -4.883  11.389
  536   1HG   ARG  72          1HG       ARG  72   9.898  -6.984  10.368
  537   2HG   ARG  72          2HG       ARG  72  10.307  -6.838  11.996
  538   1HD   ARG  72          1HD       ARG  72   8.490  -5.469  12.035
  539   2HD   ARG  72          2HD       ARG  72   9.640  -4.222  11.556
  540    HE   ARG  72           HE       ARG  72   8.272  -5.868   9.470
  541   1HH1  ARG  72          2HH1      ARG  72   8.429  -2.645  10.986
  542   2HH1  ARG  72          1HH1      ARG  72   7.039  -2.073  10.118
  543   1HH2  ARG  72          2HH2      ARG  72   6.873  -4.922   8.014
  544   2HH2  ARG  72          1HH2      ARG  72   6.120  -3.411   8.370
  545    H    SER  73           H        SER  73   9.608  -5.676   8.085
  546    HA   SER  73           HA       SER  73  10.273  -8.037   6.532
  547   1HB   SER  73          2HB       SER  73   8.347  -8.211   8.898
  548   2HB   SER  73          1HB       SER  73   8.732  -9.517   7.816
  549    HG   SER  73           HG       SER  73  11.054  -8.810   8.653
  550    H    ILE  74           H        ILE  74   8.266  -8.728   5.363
  551    HA   ILE  74           HA       ILE  74   6.162  -6.723   5.073
  552    HB   ILE  74           HB       ILE  74   6.643  -6.694   2.544
  553   1HG1  ILE  74          1HG1      ILE  74   9.394  -7.663   3.349
  554   2HG1  ILE  74          2HG1      ILE  74   8.169  -8.649   2.527
  555   1HG2  ILE  74          1HG2      ILE  74   8.123  -4.831   2.706
  556   2HG2  ILE  74          2HG2      ILE  74   7.160  -4.822   4.183
  557   3HG2  ILE  74          3HG2      ILE  74   8.830  -5.436   4.214
  558   1HD1  ILE  74          1HD1      ILE  74   9.568  -7.787   0.820
  559   2HD1  ILE  74          2HD1      ILE  74   9.503  -6.135   1.454
  560   3HD1  ILE  74          3HD1      ILE  74   8.060  -6.881   0.731
  561    HA   PRO  75           HA       PRO  75   4.523  -6.896   2.680
  562   1HB   PRO  75          2HB       PRO  75   1.848  -7.354   2.942
  563   2HB   PRO  75          1HB       PRO  75   2.861  -8.121   1.698
  564   1HG   PRO  75          1HG       PRO  75   2.079  -9.234   4.390
  565   2HG   PRO  75          2HG       PRO  75   1.926 -10.043   2.797
  566   1HD   PRO  75          1HD       PRO  75   4.044 -10.539   4.431
  567   2HD   PRO  75          2HD       PRO  75   4.302 -10.368   2.675
  568    H    THR  76           H        THR  76   3.512  -5.067   3.300
  569    HA   THR  76           HA       THR  76   2.372  -4.673   5.934
  570    HB   THR  76           HB       THR  76   5.037  -3.426   5.177
  571    HG1  THR  76           HG1      THR  76   4.511  -5.490   6.516
  572   1HG2  THR  76          1HG2      THR  76   3.631  -1.580   5.953
  573   2HG2  THR  76          2HG2      THR  76   4.725  -2.045   7.261
  574   3HG2  THR  76          3HG2      THR  76   3.025  -2.558   7.304
  575    H    ILE  77           H        ILE  77   0.551  -3.938   5.178
  576    HA   ILE  77           HA       ILE  77   0.454  -2.209   2.768
  577    HB   ILE  77           HB       ILE  77  -1.574  -3.799   4.357
  578   1HG1  ILE  77          1HG1      ILE  77  -0.844  -3.807   1.392
  579   2HG1  ILE  77          2HG1      ILE  77  -0.021  -4.826   2.581
  580   1HG2  ILE  77          1HG2      ILE  77  -2.705  -1.711   3.854
  581   2HG2  ILE  77          2HG2      ILE  77  -2.026  -1.692   2.216
  582   3HG2  ILE  77          3HG2      ILE  77  -3.257  -2.894   2.676
  583   1HD1  ILE  77          1HD1      ILE  77  -1.700  -6.145   1.507
  584   2HD1  ILE  77          2HD1      ILE  77  -2.966  -4.965   1.877
  585   3HD1  ILE  77          3HD1      ILE  77  -2.174  -5.868   3.195
  586    H    MET  78           H        MET  78   0.534  -0.039   3.107
  587    HA   MET  78           HA       MET  78  -0.271   1.036   5.788
  588   1HB   MET  78          1HB       MET  78   1.432   2.193   3.581
  589   2HB   MET  78          2HB       MET  78   0.901   3.066   5.037
  590   1HG   MET  78          1HG       MET  78   2.012   1.230   6.402
  591   2HG   MET  78          2HG       MET  78   2.699   0.649   4.894
  592   1HE   MET  78          1HE       MET  78   4.517   1.224   7.420
  593   2HE   MET  78          2HE       MET  78   4.927   0.652   5.782
  594   3HE   MET  78          3HE       MET  78   5.829   2.001   6.498
  595    H    VAL  79           H        VAL  79  -2.016   2.234   5.915
  596    HA   VAL  79           HA       VAL  79  -3.540   2.886   3.431
  597    HB   VAL  79           HB       VAL  79  -4.367   3.047   6.366
  598   1HG1  VAL  79          1HG1      VAL  79  -5.070   1.079   4.156
  599   2HG1  VAL  79          2HG1      VAL  79  -5.894   1.172   5.732
  600   3HG1  VAL  79          3HG1      VAL  79  -4.184   0.718   5.652
  601   1HG2  VAL  79          1HG2      VAL  79  -5.924   3.522   3.777
  602   2HG2  VAL  79          2HG2      VAL  79  -5.478   4.770   4.948
  603   3HG2  VAL  79          3HG2      VAL  79  -6.619   3.508   5.413
  604    H    PHE  80           H        PHE  80  -3.030   4.825   2.626
  605    HA   PHE  80           HA       PHE  80  -2.224   7.070   4.434
  606   1HB   PHE  80          1HB       PHE  80  -1.326   6.230   1.676
  607   2HB   PHE  80          2HB       PHE  80  -1.148   7.895   2.211
  608    HD1  PHE  80           HD1      PHE  80   0.446   8.542   3.937
  609    HD2  PHE  80           HD2      PHE  80   0.154   4.477   2.528
  610    HE1  PHE  80           HE1      PHE  80   2.703   8.066   4.843
  611    HE2  PHE  80           HE2      PHE  80   2.511   4.091   3.242
  612    HZ   PHE  80           HZ       PHE  80   3.686   5.785   4.590
  613    H    LYS  81           HN       LYS  81  -2.750   9.179   3.488
  614    HA   LYS  81           HA       LYS  81  -4.688   9.465   1.434
  615   1HB   LYS  81          1HB       LYS  81  -6.612  10.112   2.623
  616   2HB   LYS  81          2HB       LYS  81  -6.123   8.631   3.419
  617   1HG   LYS  81          1HG       LYS  81  -5.967  11.470   4.468
  618   2HG   LYS  81          2HG       LYS  81  -6.824  10.077   5.114
  619   1HD   LYS  81          2HD       LYS  81  -4.707   8.981   5.686
  620   2HD   LYS  81          1HD       LYS  81  -3.797  10.383   5.079
  621   1HE   LYS  81          1HE       LYS  81  -5.769  10.464   7.385
  622   2HE   LYS  81          2HE       LYS  81  -4.005  10.423   7.522
  623   1HZ   LYS  81          1HZ       LYS  81  -4.755  12.641   7.685
  624   2HZ   LYS  81          2HZ       LYS  81  -3.953  12.495   6.249
  625   3HZ   LYS  81          3HZ       LYS  81  -5.598  12.548   6.275
  626    H    GLY  82           H        GLY  82  -5.539  12.024   2.294
  627   1HA   GLY  82          2HA       GLY  82  -3.849  13.896   1.547
  628   2HA   GLY  82          1HA       GLY  82  -4.888  14.098   2.970
  629    H    GLY  83           H        GLY  83  -1.589  13.672   1.881
  630   1HA   GLY  83          2HA       GLY  83   0.297  14.479   2.838
  631   2HA   GLY  83          1HA       GLY  83  -0.607  14.992   4.255
  632    H    LYS  84           HN       LYS  84  -1.497  12.907   5.475
  633    HA   LYS  84           HA       LYS  84   1.025  11.483   6.275
  634   1HB   LYS  84          2HB       LYS  84  -1.477  12.097   7.891
  635   2HB   LYS  84          1HB       LYS  84   0.036  11.439   8.519
  636   1HG   LYS  84          2HG       LYS  84  -0.362  14.230   7.359
  637   2HG   LYS  84          1HG       LYS  84  -0.155  13.787   9.055
  638   1HD   LYS  84          2HD       LYS  84   2.127  12.866   8.506
  639   2HD   LYS  84          1HD       LYS  84   1.933  13.469   6.846
  640   1HE   LYS  84          1HE       LYS  84   1.646  15.779   7.712
  641   2HE   LYS  84          2HE       LYS  84   1.873  15.184   9.369
  642   1HZ   LYS  84          1HZ       LYS  84   3.880  16.070   8.460
  643   2HZ   LYS  84          2HZ       LYS  84   3.845  15.008   7.201
  644   3HZ   LYS  84          3HZ       LYS  84   4.057  14.456   8.740
  645    H    LYS  85           HN       LYS  85   0.490   9.558   7.734
  646    HA   LYS  85           HA       LYS  85  -0.879   7.543   6.081
  647   1HB   LYS  85          2HB       LYS  85   1.484   7.273   7.060
  648   2HB   LYS  85          1HB       LYS  85   0.695   7.136   8.639
  649   1HG   LYS  85          1HG       LYS  85  -0.582   5.136   7.784
  650   2HG   LYS  85          2HG       LYS  85   0.138   5.389   6.187
  651   1HD   LYS  85          2HD       LYS  85   1.292   3.604   7.266
  652   2HD   LYS  85          1HD       LYS  85   2.397   4.983   7.174
  653   1HE   LYS  85          1HE       LYS  85   1.901   5.491   9.576
  654   2HE   LYS  85          2HE       LYS  85   0.767   4.130   9.625
  655   1HZ   LYS  85          1HZ       LYS  85   2.907   3.551  10.496
  656   2HZ   LYS  85          2HZ       LYS  85   2.592   2.673   9.136
  657   3HZ   LYS  85          3HZ       LYS  85   3.645   3.937   9.074
  658    H    CYS  86           H        CYS  86  -2.424   6.133   7.103
  659    HA   CYS  86           HA       CYS  86  -4.055   7.405   9.262
  660   1HB   CYS  86          2HB       CYS  86  -5.188   6.997   7.102
  661   2HB   CYS  86          1HB       CYS  86  -4.782   5.287   7.183
  662    HG   CYS  86           HG       CYS  86  -6.985   7.051   8.671
  663    H    GLU  87           HN       GLU  87  -3.348   4.117   8.054
  664    HA   GLU  87           HA       GLU  87  -2.522   3.111  10.684
  665   1HB   GLU  87          1HB       GLU  87  -4.977   2.117   9.154
  666   2HB   GLU  87          2HB       GLU  87  -4.248   1.224  10.487
  667   1HG   GLU  87          1HG       GLU  87  -5.381   4.036  10.868
  668   2HG   GLU  87          2HG       GLU  87  -6.331   2.606  10.969
  669    H    THR  88           H        THR  88  -2.110   0.530  10.275
  670    HA   THR  88           HA       THR  88  -1.462  -0.058   7.536
  671    HB   THR  88           HB       THR  88   0.530   1.234   8.184
  672    HG1  THR  88           HG1      THR  88   0.630  -0.813   6.934
  673   1HG2  THR  88          1HG2      THR  88   0.508   0.872  10.641
  674   2HG2  THR  88          2HG2      THR  88   0.943  -0.834  10.396
  675   3HG2  THR  88          3HG2      THR  88   2.073   0.445   9.928
  676    H    ILE  89           H        ILE  89  -1.100  -2.240   7.179
  677    HA   ILE  89           HA       ILE  89  -1.791  -4.114   9.378
  678    HB   ILE  89           HB       ILE  89  -2.493  -4.332   6.421
  679   1HG1  ILE  89          1HG1      ILE  89  -4.133  -3.279   8.756
  680   2HG1  ILE  89          2HG1      ILE  89  -3.567  -2.367   7.365
  681   1HG2  ILE  89          1HG2      ILE  89  -3.550  -5.798   8.884
  682   2HG2  ILE  89          2HG2      ILE  89  -2.348  -6.459   7.756
  683   3HG2  ILE  89          3HG2      ILE  89  -3.980  -6.110   7.188
  684   1HD1  ILE  89          1HD1      ILE  89  -4.894  -3.827   5.845
  685   2HD1  ILE  89          2HD1      ILE  89  -5.648  -4.559   7.287
  686   3HD1  ILE  89          3HD1      ILE  89  -5.848  -2.827   6.947
  687    H    ILE  90           H        ILE  90   0.058  -4.989   9.861
  688    HA   ILE  90           HA       ILE  90   2.180  -5.641   7.882
  689    HB   ILE  90           HB       ILE  90   2.088  -5.864  10.919
  690   1HG1  ILE  90          2HG1      ILE  90   3.581  -3.891   9.129
  691   2HG1  ILE  90          1HG1      ILE  90   2.086  -3.514   9.995
  692   1HG2  ILE  90          1HG2      ILE  90   3.629  -7.542   9.921
  693   2HG2  ILE  90          2HG2      ILE  90   4.536  -6.287  10.739
  694   3HG2  ILE  90          3HG2      ILE  90   4.412  -6.264   8.970
  695   1HD1  ILE  90          1HD1      ILE  90   3.879  -2.630  11.272
  696   2HD1  ILE  90          2HD1      ILE  90   4.781  -4.148  11.241
  697   3HD1  ILE  90          3HD1      ILE  90   3.256  -4.037  12.156
  698    H    GLY  91           H        GLY  91   2.556  -7.733   7.189
  699   1HA   GLY  91          2HA       GLY  91   2.622 -10.064   7.518
  700   2HA   GLY  91          1HA       GLY  91   1.286 -10.004   8.670
  701    H    ALA  92           H        ALA  92   1.578 -11.726   6.377
  702    HA   ALA  92           HA       ALA  92  -0.055 -10.778   4.174
  703   1HB   ALA  92          1HB       ALA  92   0.277 -13.069   3.342
  704   2HB   ALA  92          2HB       ALA  92   1.815 -12.358   3.879
  705   3HB   ALA  92          3HB       ALA  92   0.984 -13.553   4.897
  706    H    VAL  93           H        VAL  93  -1.815 -10.178   5.922
  707    HA   VAL  93           HA       VAL  93  -3.565 -12.444   6.612
  708    HB   VAL  93           HB       VAL  93  -5.102 -10.802   7.464
  709   1HG1  VAL  93          1HG2      VAL  93  -4.631  -8.403   7.450
  710   2HG1  VAL  93          2HG2      VAL  93  -3.229  -8.650   6.388
  711   3HG1  VAL  93          3HG2      VAL  93  -4.871  -9.018   5.811
  712   1HG2  VAL  93          1HG1      VAL  93  -3.162 -11.502   8.855
  713   2HG2  VAL  93          2HG1      VAL  93  -3.726  -9.867   9.240
  714   3HG2  VAL  93          3HG1      VAL  93  -2.251 -10.088   8.283
  715    HA   PRO  94           HA       PRO  94  -5.569 -12.642   2.683
  716   1HB   PRO  94          1HB       PRO  94  -8.230 -12.667   4.074
  717   2HB   PRO  94          2HB       PRO  94  -7.621 -13.790   2.833
  718   1HG   PRO  94          1HG       PRO  94  -7.652 -14.541   5.456
  719   2HG   PRO  94          2HG       PRO  94  -6.267 -14.947   4.402
  720   1HD   PRO  94          1HD       PRO  94  -6.449 -12.752   6.463
  721   2HD   PRO  94          2HD       PRO  94  -5.103 -13.852   6.060
  722    H    LYS  95           HN       LYS  95  -6.646 -11.355   1.162
  723    HA   LYS  95           HA       LYS  95  -6.610  -8.595   1.501
  724   1HB   LYS  95          2HB       LYS  95  -6.556  -9.680  -0.679
  725   2HB   LYS  95          1HB       LYS  95  -8.196 -10.277  -0.476
  726   1HG   LYS  95          1HG       LYS  95  -8.154  -8.317  -1.954
  727   2HG   LYS  95          2HG       LYS  95  -9.145  -8.081  -0.544
  728   1HD   LYS  95          1HD       LYS  95  -8.052  -6.045  -0.912
  729   2HD   LYS  95          2HD       LYS  95  -7.316  -6.696   0.525
  730   1HE   LYS  95          1HE       LYS  95  -6.095  -6.817  -2.283
  731   2HE   LYS  95          2HE       LYS  95  -5.763  -5.572  -1.077
  732   1HZ   LYS  95          1HZ       LYS  95  -5.123  -8.411  -0.801
  733   2HZ   LYS  95          2HZ       LYS  95  -4.942  -7.281   0.385
  734   3HZ   LYS  95          3HZ       LYS  95  -4.076  -7.163  -1.009
  735    H    ALA  96           H        ALA  96  -9.392 -10.786   1.615
  736    HA   ALA  96           HA       ALA  96 -11.516  -9.072   2.076
  737   1HB   ALA  96          1HB       ALA  96 -10.959 -11.677   3.572
  738   2HB   ALA  96          2HB       ALA  96 -11.733 -11.530   1.977
  739   3HB   ALA  96          3HB       ALA  96 -12.540 -10.882   3.418
  740    H    THR  97           H        THR  97  -9.096 -10.097   4.539
  741    HA   THR  97           HA       THR  97 -10.289  -8.803   6.771
  742    HB   THR  97           HB       THR  97  -7.291  -9.084   6.583
  743    HG1  THR  97           HG1      THR  97  -7.647 -10.868   5.531
  744   1HG2  THR  97          1HG2      THR  97  -7.584 -10.148   8.762
  745   2HG2  THR  97          2HG2      THR  97  -9.349 -10.128   8.576
  746   3HG2  THR  97          3HG2      THR  97  -8.450  -8.597   8.734
  747    H    ILE  98           H        ILE  98  -7.730  -7.887   4.457
  748    HA   ILE  98           HA       ILE  98  -7.098  -5.328   5.534
  749    HB   ILE  98           HB       ILE  98  -6.777  -6.622   2.811
  750   1HG1  ILE  98          1HG1      ILE  98  -4.472  -5.641   4.427
  751   2HG1  ILE  98          2HG1      ILE  98  -5.401  -6.938   5.172
  752   1HG2  ILE  98          1HG2      ILE  98  -5.299  -4.723   2.191
  753   2HG2  ILE  98          2HG2      ILE  98  -6.994  -4.253   2.286
  754   3HG2  ILE  98          3HG2      ILE  98  -5.884  -3.823   3.605
  755   1HD1  ILE  98          1HD1      ILE  98  -3.530  -7.800   3.800
  756   2HD1  ILE  98          2HD1      ILE  98  -4.261  -7.068   2.355
  757   3HD1  ILE  98          3HD1      ILE  98  -5.103  -8.366   3.225
  758    H    VAL  99           H        VAL  99  -9.398  -6.201   2.873
  759    HA   VAL  99           HA       VAL  99 -10.292  -3.623   2.272
  760    HB   VAL  99           HB       VAL  99 -11.763  -6.298   2.296
  761   1HG1  VAL  99          1HG1      VAL  99 -13.512  -4.616   2.369
  762   2HG1  VAL  99          2HG1      VAL  99 -13.364  -5.172   0.702
  763   3HG1  VAL  99          3HG1      VAL  99 -12.657  -3.612   1.175
  764   1HG2  VAL  99          1HG2      VAL  99 -10.580  -4.617   0.042
  765   2HG2  VAL  99          2HG2      VAL  99 -11.357  -6.209  -0.122
  766   3HG2  VAL  99          3HG2      VAL  99  -9.819  -6.058   0.738
  767    H    GLN 100           H        GLN 100 -11.779  -5.872   4.673
  768    HA   GLN 100           HA       GLN 100 -13.708  -4.044   5.665
  769   1HB   GLN 100          2HB       GLN 100 -12.231  -6.371   6.960
  770   2HB   GLN 100          1HB       GLN 100 -13.562  -5.512   7.753
  771   1HG   GLN 100          1HG       GLN 100 -15.133  -6.121   6.063
  772   2HG   GLN 100          2HG       GLN 100 -13.880  -6.739   4.980
  773   1HE2  GLN 100          1HE2      GLN 100 -12.601  -8.608   5.710
  774   2HE2  GLN 100          2HE2      GLN 100 -13.396  -9.819   6.727
  775    H    THR 101           H        THR 101 -10.379  -4.712   6.816
  776    HA   THR 101           HA       THR 101 -10.392  -2.888   8.982
  777    HB   THR 101           HB       THR 101  -8.051  -3.754   7.234
  778    HG1  THR 101           HG1      THR 101  -9.124  -5.525   8.088
  779   1HG2  THR 101          1HG2      THR 101  -8.198  -2.679  10.087
  780   2HG2  THR 101          2HG2      THR 101  -6.757  -3.421   9.367
  781   3HG2  THR 101          3HG2      THR 101  -7.397  -1.911   8.692
  782    H    VAL 102           H        VAL 102  -9.484  -2.309   5.519
  783    HA   VAL 102           HA       VAL 102  -8.663   0.407   5.912
  784    HB   VAL 102           HB       VAL 102  -9.839  -1.026   3.549
  785   1HG1  VAL 102          1HG1      VAL 102  -7.662  -1.406   2.724
  786   2HG1  VAL 102          2HG1      VAL 102  -7.505  -1.782   4.447
  787   3HG1  VAL 102          3HG1      VAL 102  -6.935  -0.230   3.834
  788   1HG2  VAL 102          1HG2      VAL 102 -10.146   1.348   3.110
  789   2HG2  VAL 102          2HG2      VAL 102  -8.771   0.790   2.153
  790   3HG2  VAL 102          3HG2      VAL 102  -8.489   1.701   3.648
  791    H    GLU 103           HN       GLU 103 -11.749  -1.044   4.853
  792    HA   GLU 103           HA       GLU 103 -13.243   1.310   4.485
  793   1HB   GLU 103          1HB       GLU 103 -14.000  -1.532   5.282
  794   2HB   GLU 103          2HB       GLU 103 -15.204  -0.280   4.965
  795   1HG   GLU 103          1HG       GLU 103 -14.357   0.087   2.720
  796   2HG   GLU 103          2HG       GLU 103 -13.052  -1.077   2.946
  797    H    LYS 104           HN       LYS 104 -12.720  -0.569   7.440
  798    HA   LYS 104           HA       LYS 104 -14.425   0.811   9.210
  799   1HB   LYS 104          2HB       LYS 104 -13.030  -1.197   9.749
  800   2HB   LYS 104          1HB       LYS 104 -11.592  -0.168   9.690
  801   1HG   LYS 104          1HG       LYS 104 -12.550   1.195  11.591
  802   2HG   LYS 104          2HG       LYS 104 -13.793  -0.069  11.745
  803   1HD   LYS 104          2HD       LYS 104 -11.863  -1.750  11.867
  804   2HD   LYS 104          1HD       LYS 104 -10.748  -0.381  11.896
  805   1HE   LYS 104          2HE       LYS 104 -12.930  -0.956  13.966
  806   2HE   LYS 104          1HE       LYS 104 -11.196  -1.253  14.176
  807   1HZ   LYS 104          1HZ       LYS 104 -11.851   0.789  15.183
  808   2HZ   LYS 104          2HZ       LYS 104 -12.438   1.374  13.760
  809   3HZ   LYS 104          3HZ       LYS 104 -10.823   1.092  13.931
  810    H    TYR 105           H        TYR 105 -11.348   1.839   7.781
  811    HA   TYR 105           HA       TYR 105 -11.196   4.270   9.493
  812   1HB   TYR 105          2HB       TYR 105  -9.189   2.834   7.741
  813   2HB   TYR 105          1HB       TYR 105  -8.832   4.226   8.773
  814    HD1  TYR 105           HD1      TYR 105  -7.954   1.023   8.464
  815    HD2  TYR 105           HD2      TYR 105 -10.122   3.435  11.299
  816    HE1  TYR 105           HE1      TYR 105  -7.056  -0.345  10.336
  817    HE2  TYR 105           HE2      TYR 105  -9.120   2.135  13.170
  818    HH   TYR 105           HH       TYR 105  -6.920   0.839  13.408
  819    H    LEU 106           H        LEU 106 -10.123   3.503   6.211
  820    HA   LEU 106           HA       LEU 106  -9.926   4.594   4.282
  821   1HB   LEU 106          2HB       LEU 106 -12.436   6.070   5.171
  822   2HB   LEU 106          1HB       LEU 106 -11.771   6.057   3.546
  823    HG   LEU 106           HG       LEU 106 -12.128   3.330   4.608
  824   1HD1  LEU 106          1HD1      LEU 106 -13.104   2.969   2.397
  825   2HD1  LEU 106          2HD1      LEU 106 -13.120   4.717   2.085
  826   3HD1  LEU 106          3HD1      LEU 106 -11.575   3.854   2.252
  827   1HD2  LEU 106          1HD2      LEU 106 -14.539   5.125   4.223
  828   2HD2  LEU 106          2HD2      LEU 106 -13.982   4.402   5.749
  829   3HD2  LEU 106          3HD2      LEU 106 -14.574   3.355   4.438
  830    H    ASN 107           H        ASN 107 -10.878   6.979   6.699
  831    HA   ASN 107           HA       ASN 107  -9.121   9.085   5.561
  832   1HB   ASN 107          1HB       ASN 107 -11.353   9.754   6.230
  833   2HB   ASN 107          2HB       ASN 107 -11.157   9.026   7.829
  834   1HD2  ASN 107          2HD2      ASN 107  -9.165   9.880   9.058
  835   2HD2  ASN 107          1HD2      ASN 107  -9.022  11.655   9.105
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1  -0.263  -2.309 -10.811
    2   2H    MET   1          2H        MET   1   0.479  -3.688 -11.366
    3   3H    MET   1          3H        MET   1  -1.044  -3.731 -10.700
    4    HA   MET   1           HA       MET   1  -0.295  -2.316 -13.164
    5   1HB   MET   1          1HB       MET   1  -1.811  -3.972 -14.299
    6   2HB   MET   1          2HB       MET   1  -0.236  -4.559 -13.776
    7   1HG   MET   1          2HG       MET   1  -1.228  -5.705 -11.859
    8   2HG   MET   1          1HG       MET   1  -2.849  -5.166 -12.335
    9   1HE   MET   1          1HE       MET   1  -4.259  -6.132 -14.185
   10   2HE   MET   1          2HE       MET   1  -3.091  -5.597 -15.422
   11   3HE   MET   1          3HE       MET   1  -3.670  -7.275 -15.411
   12    H    GLU   2           HN       GLU   2  -3.160  -3.514 -11.276
   13    HA   GLU   2           HA       GLU   2  -4.815  -1.273 -12.223
   14   1HB   GLU   2          1HB       GLU   2  -5.199  -3.278  -9.960
   15   2HB   GLU   2          2HB       GLU   2  -6.401  -2.112 -10.516
   16   1HG   GLU   2          1HG       GLU   2  -6.492  -3.214 -12.717
   17   2HG   GLU   2          2HG       GLU   2  -5.255  -4.377 -12.214
   18    H    ALA   3           H        ALA   3  -3.071  -2.430  -9.371
   19    HA   ALA   3           HA       ALA   3  -3.135   0.147  -7.966
   20   1HB   ALA   3          1HB       ALA   3  -3.053  -2.014  -6.728
   21   2HB   ALA   3          2HB       ALA   3  -1.518  -2.405  -7.522
   22   3HB   ALA   3          3HB       ALA   3  -1.609  -1.030  -6.399
   23    H    GLY   4           H        GLY   4  -1.338   1.672  -8.064
   24   1HA   GLY   4          2HA       GLY   4   0.298   1.428 -10.479
   25   2HA   GLY   4          1HA       GLY   4   0.334   2.731  -9.287
   26    H    ALA   5           H        ALA   5   2.726   1.864 -10.301
   27    HA   ALA   5           HA       ALA   5   3.986   0.212  -8.146
   28   1HB   ALA   5          1HB       ALA   5   4.382  -0.658 -10.413
   29   2HB   ALA   5          2HB       ALA   5   5.871   0.003  -9.708
   30   3HB   ALA   5          3HB       ALA   5   4.983   0.934 -10.932
   31    H    VAL   6           H        VAL   6   5.360   1.386  -6.759
   32    HA   VAL   6           HA       VAL   6   6.094   4.155  -7.561
   33    HB   VAL   6           HB       VAL   6   5.469   5.104  -5.494
   34   1HG1  VAL   6          1HG2      VAL   6   4.602   2.373  -4.486
   35   2HG1  VAL   6          2HG2      VAL   6   6.028   3.296  -3.942
   36   3HG1  VAL   6          3HG2      VAL   6   4.402   3.915  -3.641
   37   1HG2  VAL   6          1HG1      VAL   6   3.567   4.806  -7.083
   38   2HG2  VAL   6          2HG1      VAL   6   3.060   4.815  -5.376
   39   3HG2  VAL   6          3HG1      VAL   6   3.178   3.281  -6.251
   40    H    ASN   7           H        ASN   7   7.664   5.051  -5.910
   41    HA   ASN   7           HA       ASN   7   9.480   3.227  -4.580
   42   1HB   ASN   7          1HB       ASN   7  10.128   4.768  -7.162
   43   2HB   ASN   7          2HB       ASN   7  11.406   4.428  -6.020
   44   1HD2  ASN   7          2HD2      ASN   7  11.425   2.069  -5.180
   45   2HD2  ASN   7          1HD2      ASN   7  11.320   0.860  -6.462
   46    H    ASP   8           HN       ASP   8  11.361   4.908  -3.838
   47    HA   ASP   8           HA       ASP   8  10.221   6.669  -2.028
   48   1HB   ASP   8          2HB       ASP   8  12.619   5.935  -2.122
   49   2HB   ASP   8          1HB       ASP   8  12.915   7.067  -3.434
   50    H    ASP   9           HN       ASP   9  11.617   7.594  -5.109
   51    HA   ASP   9           HA       ASP   9  11.191  10.305  -5.283
   52   1HB   ASP   9          2HB       ASP   9  12.355   8.910  -6.962
   53   2HB   ASP   9          1HB       ASP   9  10.835   8.215  -7.497
   54    H    THR  10           H        THR  10   8.934   7.837  -6.530
   55    HA   THR  10           HA       THR  10   6.887   9.770  -7.189
   56    HB   THR  10           HB       THR  10   5.620   7.549  -7.632
   57    HG1  THR  10           HG1      THR  10   7.307   5.850  -7.874
   58   1HG2  THR  10          1HG2      THR  10   6.795   8.876  -9.380
   59   2HG2  THR  10          2HG2      THR  10   8.316   8.054  -8.988
   60   3HG2  THR  10          3HG2      THR  10   6.958   7.136  -9.672
   61    H    PHE  11           H        PHE  11   7.247   7.321  -4.661
   62    HA   PHE  11           HA       PHE  11   4.895   7.236  -3.320
   63   1HB   PHE  11          2HB       PHE  11   6.985   6.066  -2.718
   64   2HB   PHE  11          1HB       PHE  11   7.655   7.532  -2.045
   65    HD1  PHE  11           HD1      PHE  11   6.639   8.524   0.058
   66    HD2  PHE  11           HD2      PHE  11   5.572   4.626  -1.455
   67    HE1  PHE  11           HE1      PHE  11   5.756   7.895   2.276
   68    HE2  PHE  11           HE2      PHE  11   4.791   3.971   0.801
   69    HZ   PHE  11           HZ       PHE  11   4.795   5.632   2.650
   70    H    LYS  12           HN       LYS  12   7.401   9.633  -2.853
   71    HA   LYS  12           HA       LYS  12   6.438  11.368  -0.948
   72   1HB   LYS  12          1HB       LYS  12   7.794  11.821  -3.612
   73   2HB   LYS  12          2HB       LYS  12   7.265  13.204  -2.676
   74   1HG   LYS  12          2HG       LYS  12   8.628  12.444  -0.743
   75   2HG   LYS  12          1HG       LYS  12   8.956  10.894  -1.544
   76   1HD   LYS  12          1HD       LYS  12  10.236  12.038  -3.308
   77   2HD   LYS  12          2HD       LYS  12   9.946  13.606  -2.520
   78   1HE   LYS  12          2HE       LYS  12  11.096  12.788  -0.468
   79   2HE   LYS  12          1HE       LYS  12  11.343  11.206  -1.226
   80   1HZ   LYS  12          1HZ       LYS  12  13.284  12.558  -1.376
   81   2HZ   LYS  12          2HZ       LYS  12  12.688  12.268  -2.884
   82   3HZ   LYS  12          3HZ       LYS  12  12.469  13.744  -2.181
   83    H    ASN  13           H        ASN  13   5.376  11.469  -4.401
   84    HA   ASN  13           HA       ASN  13   3.374  13.548  -3.678
   85   1HB   ASN  13          2HB       ASN  13   4.742  13.594  -5.840
   86   2HB   ASN  13          1HB       ASN  13   3.788  12.233  -6.389
   87   1HD2  ASN  13          1HD2      ASN  13   3.382  15.559  -4.918
   88   2HD2  ASN  13          2HD2      ASN  13   1.901  15.875  -5.798
   89    H    VAL  14           H        VAL  14   3.670  10.317  -4.972
   90    HA   VAL  14           HA       VAL  14   0.950  10.060  -5.610
   91    HB   VAL  14           HB       VAL  14   3.106   7.935  -5.174
   92   1HG1  VAL  14          1HG1      VAL  14   3.485   9.556  -7.056
   93   2HG1  VAL  14          2HG1      VAL  14   1.889   9.145  -7.704
   94   3HG1  VAL  14          3HG1      VAL  14   3.171   7.921  -7.650
   95   1HG2  VAL  14          1HG2      VAL  14   1.651   6.459  -6.610
   96   2HG2  VAL  14          2HG2      VAL  14   1.015   6.710  -4.979
   97   3HG2  VAL  14          3HG2      VAL  14   0.313   7.588  -6.356
   98    H    VAL  15           H        VAL  15   2.694   9.388  -2.641
   99    HA   VAL  15           HA       VAL  15   0.273   8.269  -1.327
  100    HB   VAL  15           HB       VAL  15   3.184   8.030  -0.479
  101   1HG1  VAL  15          1HG1      VAL  15   0.695   6.558   0.453
  102   2HG1  VAL  15          2HG1      VAL  15   1.561   7.813   1.365
  103   3HG1  VAL  15          3HG1      VAL  15   2.362   6.286   0.998
  104   1HG2  VAL  15          1HG2      VAL  15   1.459   6.022  -1.977
  105   2HG2  VAL  15          2HG2      VAL  15   2.882   6.848  -2.613
  106   3HG2  VAL  15          3HG2      VAL  15   3.054   5.708  -1.279
  107    H    LEU  16           H        LEU  16   3.145  10.284  -0.405
  108    HA   LEU  16           HA       LEU  16   1.730  11.204   1.949
  109   1HB   LEU  16          1HB       LEU  16   4.246  12.393   0.732
  110   2HB   LEU  16          2HB       LEU  16   3.618  12.636   2.353
  111    HG   LEU  16           HG       LEU  16   4.587   9.976   1.204
  112   1HD1  LEU  16          1HD1      LEU  16   5.852  11.880   3.213
  113   2HD1  LEU  16          2HD1      LEU  16   6.385  11.627   1.537
  114   3HD1  LEU  16          3HD1      LEU  16   6.501  10.303   2.709
  115   1HD2  LEU  16          1HD2      LEU  16   3.608  10.762   3.991
  116   2HD2  LEU  16          2HD2      LEU  16   4.483   9.264   3.629
  117   3HD2  LEU  16          3HD2      LEU  16   2.900   9.545   2.903
  118    H    GLU  17           HN       GLU  17   2.957  13.232  -0.756
  119    HA   GLU  17           HA       GLU  17   0.992  15.336  -0.112
  120   1HB   GLU  17          2HB       GLU  17   3.419  15.738  -0.668
  121   2HB   GLU  17          1HB       GLU  17   3.095  15.124  -2.284
  122   1HG   GLU  17          2HG       GLU  17   1.381  17.051  -2.517
  123   2HG   GLU  17          1HG       GLU  17   2.044  17.668  -1.000
  124    H    SER  18           H        SER  18  -0.510  13.226  -0.632
  125    HA   SER  18           HA       SER  18  -1.183  13.060  -3.517
  126   1HB   SER  18          2HB       SER  18  -2.564  11.146  -2.767
  127   2HB   SER  18          1HB       SER  18  -0.885  11.002  -2.261
  128    HG   SER  18           HG       SER  18  -1.491  11.057  -0.259
  129    H    SER  19           H        SER  19  -3.964  12.410  -1.913
  130    HA   SER  19           HA       SER  19  -5.030  15.008  -1.403
  131   1HB   SER  19          2HB       SER  19  -6.673  15.001  -3.353
  132   2HB   SER  19          1HB       SER  19  -5.004  15.417  -3.772
  133    HG   SER  19           HG       SER  19  -4.694  13.309  -4.508
  134    H    VAL  20           H        VAL  20  -6.484  12.333  -3.132
  135    HA   VAL  20           HA       VAL  20  -8.380  11.732  -0.972
  136    HB   VAL  20           HB       VAL  20  -9.232  10.027  -2.537
  137   1HG1  VAL  20          1HG2      VAL  20  -7.143   9.226  -3.555
  138   2HG1  VAL  20          2HG2      VAL  20  -6.952  10.771  -4.410
  139   3HG1  VAL  20          3HG2      VAL  20  -8.326   9.711  -4.770
  140   1HG2  VAL  20          1HG1      VAL  20  -9.996  11.491  -4.306
  141   2HG2  VAL  20          2HG1      VAL  20  -8.683  12.641  -3.996
  142   3HG2  VAL  20          3HG1      VAL  20  -9.952  12.388  -2.778
  143    HA   PRO  21           HA       PRO  21  -6.143   8.607   1.124
  144   1HB   PRO  21          1HB       PRO  21  -8.288   6.631   0.260
  145   2HB   PRO  21          2HB       PRO  21  -7.520   6.762   1.871
  146   1HG   PRO  21          1HG       PRO  21  -9.922   7.865   1.411
  147   2HG   PRO  21          2HG       PRO  21  -8.705   8.820   2.306
  148   1HD   PRO  21          1HD       PRO  21  -9.562   9.092  -0.562
  149   2HD   PRO  21          2HD       PRO  21  -9.103  10.348   0.617
  150    H    VAL  22           H        VAL  22  -5.022   6.549   0.996
  151    HA   VAL  22           HA       VAL  22  -4.381   5.563  -1.695
  152    HB   VAL  22           HB       VAL  22  -2.278   6.633   0.221
  153   1HG1  VAL  22          1HG1      VAL  22  -1.572   4.860  -1.459
  154   2HG1  VAL  22          2HG1      VAL  22  -0.697   6.375  -1.505
  155   3HG1  VAL  22          3HG1      VAL  22  -1.912   6.059  -2.730
  156   1HG2  VAL  22          1HG2      VAL  22  -3.463   8.096  -2.165
  157   2HG2  VAL  22          2HG2      VAL  22  -3.442   8.620  -0.468
  158   3HG2  VAL  22          3HG2      VAL  22  -1.943   8.537  -1.380
  159    H    LEU  23           H        LEU  23  -3.556   3.450  -1.606
  160    HA   LEU  23           HA       LEU  23  -2.940   2.266   1.093
  161   1HB   LEU  23          1HB       LEU  23  -5.133   1.533   0.613
  162   2HB   LEU  23          2HB       LEU  23  -4.737   0.932  -0.991
  163    HG   LEU  23           HG       LEU  23  -3.304  -0.118   1.484
  164   1HD1  LEU  23          1HD1      LEU  23  -3.400  -2.291   0.128
  165   2HD1  LEU  23          2HD1      LEU  23  -2.399  -1.049  -0.601
  166   3HD1  LEU  23          3HD1      LEU  23  -4.047  -1.352  -1.211
  167   1HD2  LEU  23          1HD2      LEU  23  -5.986  -1.139   0.465
  168   2HD2  LEU  23          2HD2      LEU  23  -5.006  -1.863   1.751
  169   3HD2  LEU  23          3HD2      LEU  23  -5.713  -0.271   1.994
  170    H    VAL  24           H        VAL  24  -0.754   2.240   0.874
  171    HA   VAL  24           HA       VAL  24   0.403   1.335  -1.748
  172    HB   VAL  24           HB       VAL  24   1.265   3.418  -1.225
  173   1HG1  VAL  24          1HG2      VAL  24   1.894   2.429   1.566
  174   2HG1  VAL  24          2HG2      VAL  24   2.436   3.960   0.857
  175   3HG1  VAL  24          3HG2      VAL  24   0.712   3.685   1.113
  176   1HG2  VAL  24          1HG1      VAL  24   2.847   1.612  -1.981
  177   2HG2  VAL  24          2HG1      VAL  24   3.341   1.394  -0.287
  178   3HG2  VAL  24          3HG1      VAL  24   3.617   2.942  -1.101
  179    H    ASP  25           HN       ASP  25   1.226  -0.671  -1.825
  180    HA   ASP  25           HA       ASP  25   1.661  -2.211   0.698
  181   1HB   ASP  25          1HB       ASP  25   0.153  -3.311  -0.856
  182   2HB   ASP  25          2HB       ASP  25   1.316  -3.102  -2.169
  183    H    PHE  26           H        PHE  26   3.723  -2.230   1.395
  184    HA   PHE  26           HA       PHE  26   5.975  -1.559  -0.417
  185   1HB   PHE  26          1HB       PHE  26   5.750  -2.342   2.510
  186   2HB   PHE  26          2HB       PHE  26   7.275  -2.127   1.671
  187    HD1  PHE  26           HD1      PHE  26   4.033  -0.148   2.188
  188    HD2  PHE  26           HD2      PHE  26   8.347  -0.096   1.905
  189    HE1  PHE  26           HE1      PHE  26   4.059   2.208   2.870
  190    HE2  PHE  26           HE2      PHE  26   8.360   2.238   2.656
  191    HZ   PHE  26           HZ       PHE  26   6.215   3.375   3.268
  192    H    TRP  27           H        TRP  27   6.519  -3.129  -1.820
  193    HA   TRP  27           HA       TRP  27   6.453  -5.987  -0.887
  194   1HB   TRP  27          2HB       TRP  27   5.584  -6.697  -2.959
  195   2HB   TRP  27          1HB       TRP  27   4.565  -5.363  -2.483
  196    HD1  TRP  27           HD1      TRP  27   5.341  -2.945  -3.763
  197    HE1  TRP  27           HE1      TRP  27   6.411  -2.517  -6.085
  198    HE3  TRP  27           HE3      TRP  27   6.640  -7.743  -4.943
  199    HZ2  TRP  27           HZ2      TRP  27   7.881  -4.067  -8.037
  200    HZ3  TRP  27           HZ3      TRP  27   7.741  -8.249  -7.078
  201    HH2  TRP  27           HH2      TRP  27   8.313  -6.426  -8.672
  202    H    ALA  28           H        ALA  28   7.613  -7.268  -2.826
  203    HA   ALA  28           HA       ALA  28   9.753  -5.983  -4.172
  204   1HB   ALA  28          1HB       ALA  28  10.816  -5.865  -1.909
  205   2HB   ALA  28          2HB       ALA  28  11.689  -6.960  -2.991
  206   3HB   ALA  28          3HB       ALA  28  10.612  -7.629  -1.757
  207    HA   PRO  29           HA       PRO  29   9.379 -10.062  -6.070
  208   1HB   PRO  29          1HB       PRO  29  11.349 -10.069  -7.776
  209   2HB   PRO  29          2HB       PRO  29   9.882  -9.079  -8.101
  210   1HG   PRO  29          1HG       PRO  29  12.562  -8.100  -7.051
  211   2HG   PRO  29          2HG       PRO  29  11.488  -7.298  -8.227
  212   1HD   PRO  29          2HD       PRO  29  11.511  -6.636  -5.531
  213   2HD   PRO  29          1HD       PRO  29  10.054  -6.538  -6.519
  214    H    TRP  30           H        TRP  30   9.950 -11.529  -4.776
  215    HA   TRP  30           HA       TRP  30  11.685 -13.294  -4.272
  216   1HB   TRP  30          1HB       TRP  30  13.356 -12.721  -2.606
  217   2HB   TRP  30          2HB       TRP  30  13.675 -11.929  -4.127
  218    HD1  TRP  30           HD1      TRP  30  14.470  -9.549  -3.892
  219    HE1  TRP  30           HE1      TRP  30  14.488  -7.708  -2.119
  220    HE3  TRP  30           HE3      TRP  30  11.853 -11.957  -0.200
  221    HZ2  TRP  30           HZ2      TRP  30  13.319  -7.257   0.477
  222    HZ3  TRP  30           HZ3      TRP  30  11.246 -10.761   1.869
  223    HH2  TRP  30           HH2      TRP  30  11.856  -8.376   2.171
  224    H    CYS  31           H        CYS  31   9.911 -10.639  -2.847
  225    HA   CYS  31           HA       CYS  31   9.428 -11.981  -0.269
  226   1HB   CYS  31          2HB       CYS  31   9.387  -9.545  -0.384
  227   2HB   CYS  31          1HB       CYS  31   8.060  -9.608  -1.549
  228    H    GLY  32           H        GLY  32   8.775 -14.052  -1.183
  229   1HA   GLY  32          1HA       GLY  32   6.670 -14.791  -2.699
  230   2HA   GLY  32          2HA       GLY  32   7.010 -15.608  -1.172
  231    HA   PRO  33           HA       PRO  33   3.365 -14.121   0.901
  232   1HB   PRO  33          2HB       PRO  33   5.088 -12.065   2.330
  233   2HB   PRO  33          1HB       PRO  33   3.734 -13.012   3.020
  234   1HG   PRO  33          2HG       PRO  33   6.254 -13.842   3.421
  235   2HG   PRO  33          1HG       PRO  33   5.027 -15.017   2.853
  236   1HD   PRO  33          1HD       PRO  33   7.124 -13.516   1.231
  237   2HD   PRO  33          2HD       PRO  33   6.692 -15.248   1.141
  238    H    CYS  34           H        CYS  34   5.381 -11.513  -0.483
  239    HA   CYS  34           HA       CYS  34   3.139  -9.631  -0.605
  240   1HB   CYS  34          1HB       CYS  34   5.738  -9.433  -2.126
  241   2HB   CYS  34          2HB       CYS  34   4.569  -8.214  -1.700
  242    H    ARG  35           HN       ARG  35   5.098 -11.711  -2.750
  243    HA   ARG  35           HA       ARG  35   4.123 -11.009  -5.249
  244   1HB   ARG  35          2HB       ARG  35   6.026 -12.543  -4.694
  245   2HB   ARG  35          1HB       ARG  35   4.889 -13.799  -4.259
  246   1HG   ARG  35          1HG       ARG  35   5.831 -14.168  -6.457
  247   2HG   ARG  35          2HG       ARG  35   4.076 -14.030  -6.519
  248   1HD   ARG  35          1HD       ARG  35   5.881 -11.648  -7.116
  249   2HD   ARG  35          2HD       ARG  35   5.496 -12.880  -8.338
  250    HE   ARG  35           HE       ARG  35   3.076 -11.974  -7.119
  251   1HH1  ARG  35          1HH1      ARG  35   5.573 -10.893  -9.373
  252   2HH1  ARG  35          2HH1      ARG  35   4.483  -9.943 -10.346
  253   1HH2  ARG  35          1HH2      ARG  35   1.648 -10.779  -8.371
  254   2HH2  ARG  35          2HH2      ARG  35   2.191  -9.866  -9.756
  255    H    ILE  36           H        ILE  36   2.950 -13.552  -3.089
  256    HA   ILE  36           HA       ILE  36   0.729 -14.322  -4.770
  257    HB   ILE  36           HB       ILE  36  -0.104 -15.568  -2.852
  258   1HG1  ILE  36          1HG1      ILE  36   1.948 -13.977  -1.258
  259   2HG1  ILE  36          2HG1      ILE  36   0.184 -13.965  -1.078
  260   1HG2  ILE  36          1HG2      ILE  36   2.948 -15.728  -2.955
  261   2HG2  ILE  36          2HG2      ILE  36   1.805 -17.032  -2.588
  262   3HG2  ILE  36          3HG2      ILE  36   1.871 -16.351  -4.216
  263   1HD1  ILE  36          1HD1      ILE  36   2.045 -16.240  -0.408
  264   2HD1  ILE  36          2HD1      ILE  36   0.258 -16.345  -0.412
  265   3HD1  ILE  36          3HD1      ILE  36   1.090 -15.226   0.694
  266    H    ILE  37           H        ILE  37   0.996 -11.881  -2.210
  267    HA   ILE  37           HA       ILE  37  -1.811 -11.201  -2.209
  268    HB   ILE  37           HB       ILE  37   0.731  -9.982  -1.075
  269   1HG1  ILE  37          2HG1      ILE  37  -0.223 -12.048  -0.035
  270   2HG1  ILE  37          1HG1      ILE  37  -0.101 -10.650   1.020
  271   1HG2  ILE  37          1HG2      ILE  37  -0.453  -8.021  -1.353
  272   2HG2  ILE  37          2HG2      ILE  37  -0.843  -8.497   0.290
  273   3HG2  ILE  37          3HG2      ILE  37  -2.040  -8.764  -0.998
  274   1HD1  ILE  37          1HD1      ILE  37  -2.672 -11.682  -0.268
  275   2HD1  ILE  37          2HD1      ILE  37  -2.550 -10.257   0.789
  276   3HD1  ILE  37          3HD1      ILE  37  -2.178 -11.867   1.416
  277    H    ALA  38           H        ALA  38   0.988  -9.808  -3.960
  278    HA   ALA  38           HA       ALA  38   0.132  -7.480  -4.894
  279   1HB   ALA  38          1HB       ALA  38   2.241  -8.448  -5.531
  280   2HB   ALA  38          2HB       ALA  38   1.461  -9.662  -6.548
  281   3HB   ALA  38          3HB       ALA  38   1.388  -7.959  -7.005
  282    HA   PRO  39           HA       PRO  39  -2.733  -9.050  -8.452
  283   1HB   PRO  39          2HB       PRO  39  -3.819 -11.626  -7.405
  284   2HB   PRO  39          1HB       PRO  39  -3.297 -11.228  -9.063
  285   1HG   PRO  39          2HG       PRO  39  -1.796 -12.861  -7.458
  286   2HG   PRO  39          1HG       PRO  39  -1.012 -11.649  -8.520
  287   1HD   PRO  39          1HD       PRO  39  -1.765 -11.319  -5.594
  288   2HD   PRO  39          2HD       PRO  39  -0.161 -11.094  -6.345
  289    H    VAL  40           H        VAL  40  -3.258  -9.978  -5.074
  290    HA   VAL  40           HA       VAL  40  -6.080  -9.403  -4.972
  291    HB   VAL  40           HB       VAL  40  -4.143  -9.511  -2.620
  292   1HG1  VAL  40          1HG1      VAL  40  -6.094 -10.230  -1.414
  293   2HG1  VAL  40          2HG1      VAL  40  -7.080 -10.163  -2.899
  294   3HG1  VAL  40          3HG1      VAL  40  -6.399  -8.671  -2.204
  295   1HG2  VAL  40          1HG2      VAL  40  -4.755 -11.932  -2.460
  296   2HG2  VAL  40          2HG2      VAL  40  -5.542 -11.824  -4.048
  297   3HG2  VAL  40          3HG2      VAL  40  -3.786 -11.609  -3.897
  298    H    VAL  41           H        VAL  41  -3.012  -7.705  -4.170
  299    HA   VAL  41           HA       VAL  41  -4.148  -5.271  -3.240
  300    HB   VAL  41           HB       VAL  41  -1.586  -5.585  -4.890
  301   1HG1  VAL  41          1HG1      VAL  41  -0.427  -5.686  -2.728
  302   2HG1  VAL  41          2HG1      VAL  41  -1.991  -5.720  -1.877
  303   3HG1  VAL  41          3HG1      VAL  41  -1.518  -7.044  -2.955
  304   1HG2  VAL  41          1HG2      VAL  41  -2.237  -3.255  -4.733
  305   2HG2  VAL  41          2HG2      VAL  41  -2.527  -3.414  -2.980
  306   3HG2  VAL  41          3HG2      VAL  41  -0.888  -3.542  -3.633
  307    H    ASP  42           HN       ASP  42  -3.303  -6.311  -6.570
  308    HA   ASP  42           HA       ASP  42  -4.251  -3.979  -7.893
  309   1HB   ASP  42          1HB       ASP  42  -3.930  -6.873  -8.767
  310   2HB   ASP  42          2HB       ASP  42  -4.546  -5.645  -9.864
  311    H    GLU  43           HN       GLU  43  -6.103  -7.107  -7.352
  312    HA   GLU  43           HA       GLU  43  -8.405  -6.010  -8.620
  313   1HB   GLU  43          1HB       GLU  43  -9.502  -7.899  -8.036
  314   2HB   GLU  43          2HB       GLU  43  -7.830  -8.453  -8.053
  315   1HG   GLU  43          2HG       GLU  43  -7.898  -8.054  -5.467
  316   2HG   GLU  43          1HG       GLU  43  -9.642  -7.896  -5.667
  317    H    ILE  44           H        ILE  44  -7.354  -5.936  -5.193
  318    HA   ILE  44           HA       ILE  44  -9.677  -4.671  -4.140
  319    HB   ILE  44           HB       ILE  44  -6.741  -4.641  -3.325
  320   1HG1  ILE  44          2HG1      ILE  44  -9.268  -5.946  -2.200
  321   2HG1  ILE  44          1HG1      ILE  44  -8.040  -6.790  -3.108
  322   1HG2  ILE  44          1HG2      ILE  44  -9.084  -3.489  -1.763
  323   2HG2  ILE  44          2HG2      ILE  44  -7.815  -2.518  -2.549
  324   3HG2  ILE  44          3HG2      ILE  44  -7.391  -3.582  -1.227
  325   1HD1  ILE  44          1HD1      ILE  44  -7.729  -5.562  -0.348
  326   2HD1  ILE  44          2HD1      ILE  44  -7.633  -7.259  -0.787
  327   3HD1  ILE  44          3HD1      ILE  44  -6.353  -6.152  -1.317
  328    H    ALA  45           H        ALA  45  -6.721  -3.309  -5.696
  329    HA   ALA  45           HA       ALA  45  -7.429  -0.600  -5.528
  330   1HB   ALA  45          1HB       ALA  45  -6.013  -0.224  -7.403
  331   2HB   ALA  45          2HB       ALA  45  -6.240  -1.828  -8.053
  332   3HB   ALA  45          3HB       ALA  45  -5.312  -1.638  -6.559
  333    H    GLY  46           H        GLY  46  -8.322  -3.005  -8.086
  334   1HA   GLY  46          1HA       GLY  46  -9.951  -1.349  -9.657
  335   2HA   GLY  46          2HA       GLY  46 -10.196  -3.094  -9.431
  336    H    GLU  47           HN       GLU  47 -10.892  -3.277  -6.760
  337    HA   GLU  47           HA       GLU  47 -13.636  -2.591  -6.793
  338   1HB   GLU  47          1HB       GLU  47 -11.770  -3.442  -4.547
  339   2HB   GLU  47          2HB       GLU  47 -13.516  -3.291  -4.378
  340   1HG   GLU  47          1HG       GLU  47 -13.888  -4.991  -6.104
  341   2HG   GLU  47          2HG       GLU  47 -12.154  -5.154  -6.374
  342    H    TYR  48           H        TYR  48 -10.955  -0.970  -5.081
  343    HA   TYR  48           HA       TYR  48 -12.921   1.137  -4.150
  344   1HB   TYR  48          2HB       TYR  48 -10.336   0.160  -2.900
  345   2HB   TYR  48          1HB       TYR  48 -11.377   1.424  -2.246
  346    HD1  TYR  48           HD1      TYR  48 -13.749   0.901  -1.558
  347    HD2  TYR  48           HD2      TYR  48 -10.905  -2.177  -2.550
  348    HE1  TYR  48           HE1      TYR  48 -15.299  -0.812  -0.676
  349    HE2  TYR  48           HE2      TYR  48 -12.491  -3.901  -1.733
  350    HH   TYR  48           HH       TYR  48 -15.598  -3.066  -0.200
  351    H    LYS  49           HN       LYS  49 -10.697   0.984  -6.517
  352    HA   LYS  49           HA       LYS  49  -8.884   2.876  -6.504
  353   1HB   LYS  49          1HB       LYS  49 -10.618   1.724  -8.519
  354   2HB   LYS  49          2HB       LYS  49 -10.374   3.424  -8.914
  355   1HG   LYS  49          1HG       LYS  49  -7.956   3.173  -8.842
  356   2HG   LYS  49          2HG       LYS  49  -8.110   1.494  -8.298
  357   1HD   LYS  49          1HD       LYS  49  -9.427   1.008 -10.420
  358   2HD   LYS  49          2HD       LYS  49  -8.985   2.622 -10.999
  359   1HE   LYS  49          2HE       LYS  49  -7.044   0.395 -10.197
  360   2HE   LYS  49          1HE       LYS  49  -7.471   0.822 -11.860
  361   1HZ   LYS  49          1HZ       LYS  49  -6.472   2.937 -11.552
  362   2HZ   LYS  49          2HZ       LYS  49  -6.178   2.640  -9.955
  363   3HZ   LYS  49          3HZ       LYS  49  -5.394   1.763 -11.099
  364    H    ASP  50           HN       ASP  50 -12.285   3.603  -6.908
  365    HA   ASP  50           HA       ASP  50 -12.701   6.147  -7.484
  366   1HB   ASP  50          2HB       ASP  50 -14.389   4.500  -6.712
  367   2HB   ASP  50          1HB       ASP  50 -13.862   4.695  -5.048
  368    H    LYS  51           HN       LYS  51 -11.979   5.225  -4.161
  369    HA   LYS  51           HA       LYS  51 -11.132   8.053  -3.495
  370   1HB   LYS  51          1HB       LYS  51 -12.311   5.838  -1.784
  371   2HB   LYS  51          2HB       LYS  51 -11.639   7.338  -1.131
  372   1HG   LYS  51          1HG       LYS  51 -13.234   8.693  -2.336
  373   2HG   LYS  51          2HG       LYS  51 -13.948   7.285  -3.121
  374   1HD   LYS  51          2HD       LYS  51 -13.794   7.631  -0.090
  375   2HD   LYS  51          1HD       LYS  51 -15.153   8.236  -1.039
  376   1HE   LYS  51          2HE       LYS  51 -14.309   5.298  -0.965
  377   2HE   LYS  51          1HE       LYS  51 -15.575   6.016   0.034
  378   1HZ   LYS  51          1HZ       LYS  51 -16.452   4.978  -1.924
  379   2HZ   LYS  51          2HZ       LYS  51 -16.762   6.595  -1.931
  380   3HZ   LYS  51          3HZ       LYS  51 -15.594   5.982  -2.910
  381    H    LEU  52           H        LEU  52 -10.261   4.642  -3.376
  382    HA   LEU  52           HA       LEU  52  -7.913   5.223  -1.676
  383   1HB   LEU  52          1HB       LEU  52  -9.636   3.379  -1.209
  384   2HB   LEU  52          2HB       LEU  52  -8.986   2.557  -2.629
  385    HG   LEU  52           HG       LEU  52  -6.672   2.750  -1.492
  386   1HD1  LEU  52          1HD1      LEU  52  -8.487   3.452   0.872
  387   2HD1  LEU  52          2HD1      LEU  52  -6.808   2.922   1.036
  388   3HD1  LEU  52          3HD1      LEU  52  -7.159   4.437   0.224
  389   1HD2  LEU  52          1HD2      LEU  52  -8.926   1.110  -0.227
  390   2HD2  LEU  52          2HD2      LEU  52  -7.198   0.746  -0.082
  391   3HD2  LEU  52          3HD2      LEU  52  -7.981   0.659  -1.663
  392    H    LYS  53           HN       LYS  53  -6.264   5.993  -2.883
  393    HA   LYS  53           HA       LYS  53  -5.699   5.018  -5.566
  394   1HB   LYS  53          1HB       LYS  53  -5.256   7.335  -4.384
  395   2HB   LYS  53          2HB       LYS  53  -3.755   6.609  -3.868
  396   1HG   LYS  53          2HG       LYS  53  -4.750   6.895  -6.743
  397   2HG   LYS  53          1HG       LYS  53  -3.554   7.922  -5.943
  398   1HD   LYS  53          2HD       LYS  53  -2.028   5.977  -5.686
  399   2HD   LYS  53          1HD       LYS  53  -3.191   4.945  -6.549
  400   1HE   LYS  53          1HE       LYS  53  -3.054   6.433  -8.534
  401   2HE   LYS  53          2HE       LYS  53  -1.881   7.460  -7.688
  402   1HZ   LYS  53          1HZ       LYS  53  -0.410   5.592  -7.588
  403   2HZ   LYS  53          2HZ       LYS  53  -1.501   4.630  -8.363
  404   3HZ   LYS  53          3HZ       LYS  53  -0.827   5.913  -9.149
  405    H    CYS  54           H        CYS  54  -5.460   2.750  -5.258
  406    HA   CYS  54           HA       CYS  54  -3.654   1.746  -3.256
  407   1HB   CYS  54          1HB       CYS  54  -5.594   0.471  -3.988
  408   2HB   CYS  54          2HB       CYS  54  -4.869   0.356  -5.617
  409    HG   CYS  54           HG       CYS  54  -3.177  -0.390  -2.912
  410    H    VAL  55           H        VAL  55  -1.459   1.092  -3.466
  411    HA   VAL  55           HA       VAL  55  -0.199   1.064  -6.102
  412    HB   VAL  55           HB       VAL  55   1.601   2.642  -4.648
  413   1HG1  VAL  55          1HG1      VAL  55   0.540   4.565  -3.800
  414   2HG1  VAL  55          2HG1      VAL  55  -0.229   3.203  -2.974
  415   3HG1  VAL  55          3HG1      VAL  55  -1.064   4.025  -4.310
  416   1HG2  VAL  55          1HG2      VAL  55   1.153   2.829  -6.996
  417   2HG2  VAL  55          2HG2      VAL  55  -0.501   3.384  -6.710
  418   3HG2  VAL  55          3HG2      VAL  55   0.879   4.405  -6.262
  419    H    LYS  56           HN       LYS  56   2.144   0.556  -5.920
  420    HA   LYS  56           HA       LYS  56   2.741  -1.237  -3.634
  421   1HB   LYS  56          1HB       LYS  56   2.118  -1.795  -6.430
  422   2HB   LYS  56          2HB       LYS  56   3.727  -2.393  -6.039
  423   1HG   LYS  56          1HG       LYS  56   2.810  -3.573  -4.038
  424   2HG   LYS  56          2HG       LYS  56   1.198  -2.950  -4.429
  425   1HD   LYS  56          2HD       LYS  56   2.820  -4.800  -6.237
  426   2HD   LYS  56          1HD       LYS  56   1.592  -5.328  -5.073
  427   1HE   LYS  56          1HE       LYS  56  -0.091  -3.846  -6.246
  428   2HE   LYS  56          2HE       LYS  56   1.125  -3.543  -7.504
  429   1HZ   LYS  56          1HZ       LYS  56  -0.025  -6.136  -6.753
  430   2HZ   LYS  56          2HZ       LYS  56  -0.310  -5.315  -8.137
  431   3HZ   LYS  56          3HZ       LYS  56   1.190  -5.932  -7.853
  432    H    LEU  57           H        LEU  57   4.646  -0.600  -2.696
  433    HA   LEU  57           HA       LEU  57   6.607   0.935  -4.341
  434   1HB   LEU  57          2HB       LEU  57   6.006   1.928  -2.196
  435   2HB   LEU  57          1HB       LEU  57   6.522   0.501  -1.353
  436    HG   LEU  57           HG       LEU  57   8.634   1.572  -3.104
  437   1HD1  LEU  57          1HD2      LEU  57   8.551   1.104  -0.104
  438   2HD1  LEU  57          2HD2      LEU  57   8.813  -0.217  -1.249
  439   3HD1  LEU  57          3HD2      LEU  57   9.975   1.111  -1.130
  440   1HD2  LEU  57          1HD1      LEU  57   9.189   3.459  -1.581
  441   2HD2  LEU  57          2HD1      LEU  57   7.632   3.247  -0.763
  442   3HD2  LEU  57          3HD1      LEU  57   7.690   3.742  -2.471
  443    H    ASN  58           H        ASN  58   8.440  -0.035  -5.124
  444    HA   ASN  58           HA       ASN  58   9.040  -2.789  -4.237
  445   1HB   ASN  58          2HB       ASN  58   9.368  -2.171  -6.587
  446   2HB   ASN  58          1HB       ASN  58  10.586  -0.984  -6.117
  447   1HD2  ASN  58          2HD2      ASN  58  10.287  -4.034  -7.323
  448   2HD2  ASN  58          1HD2      ASN  58  11.793  -4.721  -6.734
  449    H    THR  59           H        THR  59   9.886  -3.058  -2.375
  450    HA   THR  59           HA       THR  59  11.053  -0.977  -0.756
  451    HB   THR  59           HB       THR  59  10.912  -3.980  -0.287
  452    HG1  THR  59           HG1      THR  59   8.869  -3.216  -0.769
  453   1HG2  THR  59          1HG2      THR  59  12.297  -2.789   1.384
  454   2HG2  THR  59          2HG2      THR  59  10.766  -3.321   2.098
  455   3HG2  THR  59          3HG2      THR  59  10.981  -1.622   1.635
  456    H    ASP  60           HN       ASP  60  12.371  -3.560  -2.763
  457    HA   ASP  60           HA       ASP  60  14.997  -3.646  -1.552
  458   1HB   ASP  60          1HB       ASP  60  13.701  -5.325  -3.094
  459   2HB   ASP  60          2HB       ASP  60  14.315  -4.358  -4.430
  460    H    GLU  61           HN       GLU  61  13.449  -2.006  -4.215
  461    HA   GLU  61           HA       GLU  61  15.725  -0.410  -5.088
  462   1HB   GLU  61          2HB       GLU  61  14.005  -1.404  -6.568
  463   2HB   GLU  61          1HB       GLU  61  12.769  -0.439  -5.745
  464   1HG   GLU  61          2HG       GLU  61  13.777   1.638  -6.638
  465   2HG   GLU  61          1HG       GLU  61  15.089   0.690  -7.361
  466    H    SER  62           H        SER  62  12.999   0.046  -2.850
  467    HA   SER  62           HA       SER  62  13.939   2.839  -2.305
  468   1HB   SER  62          1HB       SER  62  11.075   1.946  -2.823
  469   2HB   SER  62          2HB       SER  62  11.594   3.451  -2.070
  470    HG   SER  62           HG       SER  62  13.116   3.052  -4.222
  471    HA   PRO  63           HA       PRO  63  13.660   0.260   1.574
  472   1HB   PRO  63          1HB       PRO  63  16.280   0.508   2.317
  473   2HB   PRO  63          2HB       PRO  63  15.705  -0.787   1.215
  474   1HG   PRO  63          1HG       PRO  63  16.994   1.862   0.484
  475   2HG   PRO  63          2HG       PRO  63  17.397   0.234  -0.140
  476   1HD   PRO  63          1HD       PRO  63  15.744   1.913  -1.511
  477   2HD   PRO  63          2HD       PRO  63  15.428   0.166  -1.463
  478    H    ASN  64           H        ASN  64  15.012   3.286   0.495
  479    HA   ASN  64           HA       ASN  64  15.536   4.844   2.670
  480   1HB   ASN  64          2HB       ASN  64  13.921   5.508   0.166
  481   2HB   ASN  64          1HB       ASN  64  14.377   6.714   1.369
  482   1HD2  ASN  64          1HD2      ASN  64  15.349   7.528  -0.824
  483   2HD2  ASN  64          2HD2      ASN  64  17.021   7.039  -1.105
  484    H    VAL  65           H        VAL  65  12.292   4.980   1.269
  485    HA   VAL  65           HA       VAL  65  10.944   6.195   3.386
  486    HB   VAL  65           HB       VAL  65  10.010   4.205   1.261
  487   1HG1  VAL  65          1HG2      VAL  65   8.322   6.159   2.857
  488   2HG1  VAL  65          2HG2      VAL  65   7.791   5.018   1.587
  489   3HG1  VAL  65          3HG2      VAL  65   8.362   4.412   3.139
  490   1HG2  VAL  65          1HG1      VAL  65  10.088   7.254   1.345
  491   2HG2  VAL  65          2HG1      VAL  65   9.268   6.292   0.096
  492   3HG2  VAL  65          3HG1      VAL  65  11.026   6.197   0.275
  493    H    ALA  66           H        ALA  66  11.364   2.805   2.599
  494    HA   ALA  66           HA       ALA  66   9.755   1.616   4.613
  495   1HB   ALA  66          1HB       ALA  66  11.121  -0.408   4.238
  496   2HB   ALA  66          2HB       ALA  66  10.702   0.385   2.700
  497   3HB   ALA  66          3HB       ALA  66  12.330   0.534   3.391
  498    H    SER  67           H        SER  67  13.162   2.675   4.740
  499    HA   SER  67           HA       SER  67  13.604   1.743   7.449
  500   1HB   SER  67          2HB       SER  67  15.193   3.743   5.777
  501   2HB   SER  67          1HB       SER  67  15.735   2.902   7.241
  502    HG   SER  67           HG       SER  67  15.014   1.720   4.755
  503    H    GLU  68           HN       GLU  68  12.883   4.868   5.905
  504    HA   GLU  68           HA       GLU  68  13.080   6.554   8.174
  505   1HB   GLU  68          1HB       GLU  68  11.256   6.685   5.736
  506   2HB   GLU  68          2HB       GLU  68  11.374   7.976   6.932
  507   1HG   GLU  68          1HG       GLU  68  13.656   8.425   6.428
  508   2HG   GLU  68          2HG       GLU  68  13.852   6.938   5.503
  509    H    TYR  69           H        TYR  69  10.227   4.739   6.927
  510    HA   TYR  69           HA       TYR  69   8.665   5.432   9.323
  511   1HB   TYR  69          2HB       TYR  69   8.209   3.778   6.826
  512   2HB   TYR  69          1HB       TYR  69   7.156   3.567   8.206
  513    HD1  TYR  69           HD1      TYR  69   7.366   5.307   5.196
  514    HD2  TYR  69           HD2      TYR  69   6.362   5.920   9.344
  515    HE1  TYR  69           HE1      TYR  69   6.051   7.340   4.598
  516    HE2  TYR  69           HE2      TYR  69   5.147   7.995   8.748
  517    HH   TYR  69           HH       TYR  69   4.608   9.467   7.054
  518    H    GLY  70           H        GLY  70  10.586   2.663   8.194
  519   1HA   GLY  70          2HA       GLY  70  11.622   1.041   9.432
  520   2HA   GLY  70          1HA       GLY  70  10.955   1.731  10.932
  521    H    ILE  71           H        ILE  71   9.751   0.301   7.880
  522    HA   ILE  71           HA       ILE  71   7.468  -0.939   9.102
  523    HB   ILE  71           HB       ILE  71   7.239  -2.043   6.916
  524   1HG1  ILE  71          2HG1      ILE  71   9.896  -0.738   6.191
  525   2HG1  ILE  71          1HG1      ILE  71   9.604  -2.461   6.382
  526   1HG2  ILE  71          1HG2      ILE  71   7.994   0.904   6.590
  527   2HG2  ILE  71          2HG2      ILE  71   6.507   0.353   7.384
  528   3HG2  ILE  71          3HG2      ILE  71   6.770   0.000   5.678
  529   1HD1  ILE  71          1HD1      ILE  71   9.496  -2.020   4.033
  530   2HD1  ILE  71          2HD1      ILE  71   8.474  -0.598   4.289
  531   3HD1  ILE  71          3HD1      ILE  71   7.812  -2.227   4.550
  532    H    ARG  72           HN       ARG  72   7.078  -3.056   9.715
  533    HA   ARG  72           HA       ARG  72   9.420  -4.584  10.586
  534   1HB   ARG  72          2HB       ARG  72   7.302  -4.253  11.937
  535   2HB   ARG  72          1HB       ARG  72   6.481  -5.299  10.775
  536   1HG   ARG  72          2HG       ARG  72   8.318  -7.065  11.343
  537   2HG   ARG  72          1HG       ARG  72   8.745  -5.990  12.684
  538   1HD   ARG  72          2HD       ARG  72   7.202  -7.679  13.494
  539   2HD   ARG  72          1HD       ARG  72   6.346  -6.119  13.455
  540    HE   ARG  72           HE       ARG  72   6.024  -7.564  10.981
  541   1HH1  ARG  72          2HH1      ARG  72   4.878  -7.523  14.319
  542   2HH1  ARG  72          1HH1      ARG  72   3.336  -8.250  13.954
  543   1HH2  ARG  72          1HH2      ARG  72   4.037  -8.552  10.490
  544   2HH2  ARG  72          2HH2      ARG  72   2.844  -8.838  11.726
  545    H    SER  73           H        SER  73  10.074  -4.677   8.240
  546    HA   SER  73           HA       SER  73  10.596  -5.972   6.428
  547   1HB   SER  73          2HB       SER  73  10.521  -7.912   8.060
  548   2HB   SER  73          1HB       SER  73   8.835  -8.197   7.575
  549    HG   SER  73           HG       SER  73  10.346  -9.446   6.366
  550    H    ILE  74           H        ILE  74   8.811  -7.809   5.051
  551    HA   ILE  74           HA       ILE  74   6.501  -6.119   4.339
  552    HB   ILE  74           HB       ILE  74   7.145  -6.476   1.874
  553   1HG1  ILE  74          1HG1      ILE  74   9.954  -6.854   2.922
  554   2HG1  ILE  74          2HG1      ILE  74   8.933  -8.176   2.327
  555   1HG2  ILE  74          1HG2      ILE  74   7.282  -4.316   3.208
  556   2HG2  ILE  74          2HG2      ILE  74   8.382  -4.415   1.840
  557   3HG2  ILE  74          3HG2      ILE  74   9.001  -4.671   3.480
  558   1HD1  ILE  74          1HD1      ILE  74  10.302  -7.387   0.492
  559   2HD1  ILE  74          2HD1      ILE  74   9.787  -5.723   0.736
  560   3HD1  ILE  74          3HD1      ILE  74   8.630  -6.944   0.164
  561    HA   PRO  75           HA       PRO  75   4.989  -6.455   2.283
  562   1HB   PRO  75          1HB       PRO  75   2.322  -7.004   2.410
  563   2HB   PRO  75          2HB       PRO  75   3.435  -7.692   1.208
  564   1HG   PRO  75          1HG       PRO  75   2.510  -8.902   3.832
  565   2HG   PRO  75          2HG       PRO  75   2.523  -9.703   2.232
  566   1HD   PRO  75          1HD       PRO  75   4.538 -10.102   4.037
  567   2HD   PRO  75          2HD       PRO  75   4.880  -9.931   2.291
  568    H    THR  76           H        THR  76   4.136  -4.648   2.944
  569    HA   THR  76           HA       THR  76   2.926  -4.335   5.616
  570    HB   THR  76           HB       THR  76   5.452  -2.897   4.723
  571    HG1  THR  76           HG1      THR  76   6.176  -4.375   6.068
  572   1HG2  THR  76          1HG2      THR  76   4.186  -1.117   5.516
  573   2HG2  THR  76          2HG2      THR  76   3.305  -2.105   6.711
  574   3HG2  THR  76          3HG2      THR  76   4.994  -1.658   6.989
  575    H    ILE  77           H        ILE  77   1.027  -3.658   5.000
  576    HA   ILE  77           HA       ILE  77   0.622  -1.997   2.571
  577    HB   ILE  77           HB       ILE  77  -1.254  -3.696   4.263
  578   1HG1  ILE  77          2HG1      ILE  77  -0.338  -4.025   1.372
  579   2HG1  ILE  77          1HG1      ILE  77   0.366  -4.901   2.733
  580   1HG2  ILE  77          1HG2      ILE  77  -2.951  -3.110   2.509
  581   2HG2  ILE  77          2HG2      ILE  77  -1.761  -2.000   1.786
  582   3HG2  ILE  77          3HG2      ILE  77  -2.428  -1.690   3.401
  583   1HD1  ILE  77          1HD1      ILE  77  -1.886  -5.867   3.253
  584   2HD1  ILE  77          2HD1      ILE  77  -2.497  -5.135   1.748
  585   3HD1  ILE  77          3HD1      ILE  77  -1.212  -6.348   1.684
  586    H    MET  78           H        MET  78   0.805   0.090   3.074
  587    HA   MET  78           HA       MET  78  -0.152   1.047   5.751
  588   1HB   MET  78          1HB       MET  78   1.828   2.250   3.816
  589   2HB   MET  78          2HB       MET  78   1.247   3.019   5.314
  590   1HG   MET  78          2HG       MET  78   2.123   1.071   6.599
  591   2HG   MET  78          1HG       MET  78   2.714   0.387   5.082
  592   1HE   MET  78          1HE       MET  78   2.887   4.027   6.700
  593   2HE   MET  78          2HE       MET  78   3.283   2.835   7.968
  594   3HE   MET  78          3HE       MET  78   4.537   3.939   7.359
  595    H    VAL  79           H        VAL  79  -1.859   2.312   5.814
  596    HA   VAL  79           HA       VAL  79  -3.073   3.191   3.229
  597    HB   VAL  79           HB       VAL  79  -4.363   2.921   5.963
  598   1HG1  VAL  79          1HG1      VAL  79  -4.765   1.310   3.416
  599   2HG1  VAL  79          2HG1      VAL  79  -3.942   0.724   4.879
  600   3HG1  VAL  79          3HG1      VAL  79  -5.662   1.103   4.934
  601   1HG2  VAL  79          1HG2      VAL  79  -5.494   3.829   3.279
  602   2HG2  VAL  79          2HG2      VAL  79  -5.328   4.822   4.727
  603   3HG2  VAL  79          3HG2      VAL  79  -6.467   3.488   4.720
  604    H    PHE  80           H        PHE  80  -3.223   5.341   2.901
  605    HA   PHE  80           HA       PHE  80  -2.612   7.223   5.112
  606   1HB   PHE  80          1HB       PHE  80  -1.748   7.468   2.200
  607   2HB   PHE  80          2HB       PHE  80  -1.626   8.726   3.407
  608    HD1  PHE  80           HD1      PHE  80   0.459   8.995   4.494
  609    HD2  PHE  80           HD2      PHE  80  -0.502   5.183   2.740
  610    HE1  PHE  80           HE1      PHE  80   2.689   8.140   5.134
  611    HE2  PHE  80           HE2      PHE  80   1.765   4.373   3.300
  612    HZ   PHE  80           HZ       PHE  80   3.332   5.790   4.581
  613    H    LYS  81           HN       LYS  81  -4.135   8.904   5.142
  614    HA   LYS  81           HA       LYS  81  -6.484   8.497   3.282
  615   1HB   LYS  81          2HB       LYS  81  -7.998   9.071   4.943
  616   2HB   LYS  81          1HB       LYS  81  -7.015   7.721   5.448
  617   1HG   LYS  81          1HG       LYS  81  -7.391  10.361   6.740
  618   2HG   LYS  81          2HG       LYS  81  -7.225   8.761   7.401
  619   1HD   LYS  81          1HD       LYS  81  -4.783   8.791   7.047
  620   2HD   LYS  81          2HD       LYS  81  -4.865  10.390   6.323
  621   1HE   LYS  81          1HE       LYS  81  -4.188  10.741   8.546
  622   2HE   LYS  81          2HE       LYS  81  -5.882  11.256   8.475
  623   1HZ   LYS  81          1HZ       LYS  81  -5.478   9.936  10.394
  624   2HZ   LYS  81          2HZ       LYS  81  -6.427   9.042   9.381
  625   3HZ   LYS  81          3HZ       LYS  81  -4.805   8.729   9.500
  626    H    GLY  82           H        GLY  82  -6.421  11.241   5.389
  627   1HA   GLY  82          1HA       GLY  82  -6.213  13.075   3.191
  628   2HA   GLY  82          2HA       GLY  82  -6.279  13.485   4.915
  629    H    GLY  83           H        GLY  83  -4.110  12.042   2.456
  630   1HA   GLY  83          2HA       GLY  83  -1.915  12.521   1.942
  631   2HA   GLY  83          1HA       GLY  83  -1.877  13.784   3.168
  632    H    LYS  84           HN       LYS  84  -2.230  12.619   5.484
  633    HA   LYS  84           HA       LYS  84   0.226  10.992   5.772
  634   1HB   LYS  84          2HB       LYS  84  -1.574  12.227   7.888
  635   2HB   LYS  84          1HB       LYS  84   0.014  11.478   8.143
  636   1HG   LYS  84          1HG       LYS  84   0.913  13.163   6.384
  637   2HG   LYS  84          2HG       LYS  84  -0.627  14.009   6.596
  638   1HD   LYS  84          2HD       LYS  84  -0.081  14.002   9.136
  639   2HD   LYS  84          1HD       LYS  84   1.499  13.334   8.702
  640   1HE   LYS  84          2HE       LYS  84   1.732  15.726   9.017
  641   2HE   LYS  84          1HE       LYS  84   1.961  15.357   7.300
  642   1HZ   LYS  84          1HZ       LYS  84  -0.517  16.366   8.525
  643   2HZ   LYS  84          2HZ       LYS  84  -0.293  16.065   6.920
  644   3HZ   LYS  84          3HZ       LYS  84   0.561  17.262   7.660
  645    H    LYS  85           HN       LYS  85   0.176   9.386   7.614
  646    HA   LYS  85           HA       LYS  85  -1.009   7.040   6.711
  647   1HB   LYS  85          2HB       LYS  85   0.147   7.802   9.424
  648   2HB   LYS  85          1HB       LYS  85  -0.364   6.164   8.981
  649   1HG   LYS  85          1HG       LYS  85   1.224   6.106   7.119
  650   2HG   LYS  85          2HG       LYS  85   1.758   7.753   7.487
  651   1HD   LYS  85          1HD       LYS  85   3.305   6.052   8.363
  652   2HD   LYS  85          2HD       LYS  85   2.636   7.055   9.661
  653   1HE   LYS  85          2HE       LYS  85   1.137   5.267  10.358
  654   2HE   LYS  85          1HE       LYS  85   1.513   4.322   8.905
  655   1HZ   LYS  85          1HZ       LYS  85   2.664   3.511  10.794
  656   2HZ   LYS  85          2HZ       LYS  85   3.761   4.130   9.733
  657   3HZ   LYS  85          3HZ       LYS  85   3.362   4.976  11.090
  658    H    CYS  86           H        CYS  86  -2.505   5.674   7.528
  659    HA   CYS  86           HA       CYS  86  -4.576   6.630   9.457
  660   1HB   CYS  86          2HB       CYS  86  -5.362   6.680   7.006
  661   2HB   CYS  86          1HB       CYS  86  -5.114   4.939   6.976
  662    HG   CYS  86           HG       CYS  86  -7.460   4.818   7.458
  663    H    GLU  87           HN       GLU  87  -3.335   3.815   7.627
  664    HA   GLU  87           HA       GLU  87  -3.398   2.140  10.105
  665   1HB   GLU  87          2HB       GLU  87  -4.329   1.206   7.368
  666   2HB   GLU  87          1HB       GLU  87  -4.312   0.261   8.842
  667   1HG   GLU  87          2HG       GLU  87  -6.296   1.000   9.522
  668   2HG   GLU  87          1HG       GLU  87  -5.955   2.690   9.187
  669    H    THR  88           H        THR  88  -2.160   0.127   9.803
  670    HA   THR  88           HA       THR  88  -0.150  -0.056   7.686
  671    HB   THR  88           HB       THR  88   0.567   0.480  10.595
  672    HG1  THR  88           HG1      THR  88   0.279   2.074   8.557
  673   1HG2  THR  88          1HG2      THR  88   2.332  -0.460   8.286
  674   2HG2  THR  88          2HG2      THR  88   2.938   0.215   9.811
  675   3HG2  THR  88          3HG2      THR  88   2.037  -1.307   9.816
  676    H    ILE  89           H        ILE  89  -0.992  -2.009   7.125
  677    HA   ILE  89           HA       ILE  89  -1.395  -4.115   9.204
  678    HB   ILE  89           HB       ILE  89  -2.275  -3.994   6.278
  679   1HG1  ILE  89          2HG1      ILE  89  -4.575  -4.145   7.692
  680   2HG1  ILE  89          1HG1      ILE  89  -3.626  -3.237   8.864
  681   1HG2  ILE  89          1HG2      ILE  89  -2.865  -6.029   8.469
  682   2HG2  ILE  89          2HG2      ILE  89  -1.854  -6.305   7.030
  683   3HG2  ILE  89          3HG2      ILE  89  -3.578  -6.003   6.842
  684   1HD1  ILE  89          1HD1      ILE  89  -3.206  -1.488   7.107
  685   2HD1  ILE  89          2HD1      ILE  89  -4.107  -2.473   5.937
  686   3HD1  ILE  89          3HD1      ILE  89  -4.937  -1.779   7.340
  687    H    ILE  90           H        ILE  90  -0.097  -6.032   8.999
  688    HA   ILE  90           HA       ILE  90   2.079  -5.945   6.977
  689    HB   ILE  90           HB       ILE  90   2.490  -6.358   9.972
  690   1HG1  ILE  90          1HG1      ILE  90   3.050  -3.990   8.139
  691   2HG1  ILE  90          2HG1      ILE  90   2.048  -4.021   9.600
  692   1HG2  ILE  90          1HG2      ILE  90   4.521  -6.163   7.698
  693   2HG2  ILE  90          2HG2      ILE  90   4.050  -7.673   8.495
  694   3HG2  ILE  90          3HG2      ILE  90   4.878  -6.431   9.411
  695   1HD1  ILE  90          1HD1      ILE  90   4.047  -2.899  10.168
  696   2HD1  ILE  90          2HD1      ILE  90   5.059  -4.141   9.426
  697   3HD1  ILE  90          3HD1      ILE  90   4.149  -4.504  10.924
  698    H    GLY  91           H        GLY  91   2.728  -7.919   6.274
  699   1HA   GLY  91          2HA       GLY  91   2.900 -10.256   6.256
  700   2HA   GLY  91          1HA       GLY  91   1.710 -10.402   7.558
  701    H    ALA  92           H        ALA  92   1.685 -11.935   5.107
  702    HA   ALA  92           HA       ALA  92  -0.193 -10.793   3.239
  703   1HB   ALA  92          1HB       ALA  92  -0.142 -13.092   2.276
  704   2HB   ALA  92          2HB       ALA  92   1.481 -12.446   2.574
  705   3HB   ALA  92          3HB       ALA  92   0.787 -13.651   3.681
  706    H    VAL  93           H        VAL  93  -1.760 -10.136   5.033
  707    HA   VAL  93           HA       VAL  93  -3.408 -12.281   6.103
  708    HB   VAL  93           HB       VAL  93  -4.818 -10.573   7.019
  709   1HG1  VAL  93          1HG2      VAL  93  -3.313  -8.564   5.293
  710   2HG1  VAL  93          2HG2      VAL  93  -5.028  -9.020   5.205
  711   3HG1  VAL  93          3HG2      VAL  93  -4.434  -8.165   6.619
  712   1HG2  VAL  93          1HG1      VAL  93  -3.238  -9.392   8.416
  713   2HG2  VAL  93          2HG1      VAL  93  -1.925  -9.641   7.256
  714   3HG2  VAL  93          3HG1      VAL  93  -2.625 -11.028   8.118
  715    HA   PRO  94           HA       PRO  94  -6.038 -12.910   2.641
  716   1HB   PRO  94          1HB       PRO  94  -8.426 -12.711   4.473
  717   2HB   PRO  94          2HB       PRO  94  -8.049 -13.987   3.282
  718   1HG   PRO  94          2HG       PRO  94  -7.603 -14.430   5.921
  719   2HG   PRO  94          1HG       PRO  94  -6.373 -14.920   4.717
  720   1HD   PRO  94          2HD       PRO  94  -6.392 -12.436   6.447
  721   2HD   PRO  94          1HD       PRO  94  -5.070 -13.585   6.099
  722    H    LYS  95           HN       LYS  95  -7.434 -11.985   1.166
  723    HA   LYS  95           HA       LYS  95  -7.637  -9.308   0.739
  724   1HB   LYS  95          1HB       LYS  95  -8.224 -11.155  -0.882
  725   2HB   LYS  95          2HB       LYS  95  -9.697 -11.472   0.010
  726   1HG   LYS  95          1HG       LYS  95 -10.496  -9.143  -0.492
  727   2HG   LYS  95          2HG       LYS  95  -9.053  -8.900  -1.490
  728   1HD   LYS  95          1HD       LYS  95  -9.722 -10.766  -2.950
  729   2HD   LYS  95          2HD       LYS  95 -11.139 -11.090  -1.941
  730   1HE   LYS  95          2HE       LYS  95 -10.629  -8.468  -3.433
  731   2HE   LYS  95          1HE       LYS  95 -11.663  -9.785  -4.014
  732   1HZ   LYS  95          1HZ       LYS  95 -12.920  -8.092  -2.977
  733   2HZ   LYS  95          2HZ       LYS  95 -13.056  -9.504  -2.136
  734   3HZ   LYS  95          3HZ       LYS  95 -12.117  -8.282  -1.551
  735    H    ALA  96           H        ALA  96 -10.121 -11.396   2.131
  736    HA   ALA  96           HA       ALA  96 -12.184  -9.676   2.748
  737   1HB   ALA  96          1HB       ALA  96 -11.066 -11.920   4.502
  738   2HB   ALA  96          2HB       ALA  96 -12.692 -11.221   4.627
  739   3HB   ALA  96          3HB       ALA  96 -12.224 -12.107   3.167
  740    H    THR  97           H        THR  97  -9.378 -10.363   4.950
  741    HA   THR  97           HA       THR  97 -10.037  -8.478   6.904
  742    HB   THR  97           HB       THR  97  -7.237  -9.394   6.113
  743    HG1  THR  97           HG1      THR  97  -7.855 -11.199   7.535
  744   1HG2  THR  97          1HG2      THR  97  -8.538  -8.863   8.823
  745   2HG2  THR  97          2HG2      THR  97  -7.397  -7.776   8.001
  746   3HG2  THR  97          3HG2      THR  97  -6.859  -9.373   8.545
  747    H    ILE  98           H        ILE  98  -7.781  -8.202   4.094
  748    HA   ILE  98           HA       ILE  98  -6.846  -5.578   4.614
  749    HB   ILE  98           HB       ILE  98  -7.307  -6.958   1.914
  750   1HG1  ILE  98          1HG1      ILE  98  -4.805  -6.763   3.643
  751   2HG1  ILE  98          2HG1      ILE  98  -5.822  -8.191   3.403
  752   1HG2  ILE  98          1HG2      ILE  98  -7.044  -4.443   1.713
  753   2HG2  ILE  98          2HG2      ILE  98  -5.658  -5.288   1.053
  754   3HG2  ILE  98          3HG2      ILE  98  -5.552  -4.552   2.662
  755   1HD1  ILE  98          1HD1      ILE  98  -3.922  -8.448   2.015
  756   2HD1  ILE  98          2HD1      ILE  98  -5.333  -8.171   0.978
  757   3HD1  ILE  98          3HD1      ILE  98  -4.149  -6.871   1.257
  758    H    VAL  99           H        VAL  99  -9.503  -6.591   2.473
  759    HA   VAL  99           HA       VAL  99 -10.464  -4.050   1.739
  760    HB   VAL  99           HB       VAL  99 -11.799  -6.788   1.922
  761   1HG1  VAL  99          1HG1      VAL  99 -12.885  -4.160   0.858
  762   2HG1  VAL  99          2HG1      VAL  99 -13.638  -5.224   2.060
  763   3HG1  VAL  99          3HG1      VAL  99 -13.533  -5.745   0.377
  764   1HG2  VAL  99          1HG2      VAL  99 -11.550  -6.655  -0.555
  765   2HG2  VAL  99          2HG2      VAL  99  -9.979  -6.550   0.252
  766   3HG2  VAL  99          3HG2      VAL  99 -10.748  -5.085  -0.389
  767    H    GLN 100           H        GLN 100 -11.810  -6.267   4.279
  768    HA   GLN 100           HA       GLN 100 -13.797  -4.552   5.237
  769   1HB   GLN 100          1HB       GLN 100 -12.034  -6.603   6.638
  770   2HB   GLN 100          2HB       GLN 100 -13.366  -5.769   7.458
  771   1HG   GLN 100          2HG       GLN 100 -15.008  -6.660   6.017
  772   2HG   GLN 100          1HG       GLN 100 -13.836  -7.231   4.833
  773   1HE2  GLN 100          1HE2      GLN 100 -13.785  -7.631   8.430
  774   2HE2  GLN 100          2HE2      GLN 100 -13.819  -9.385   8.354
  775    H    THR 101           H        THR 101 -10.356  -4.712   6.242
  776    HA   THR 101           HA       THR 101 -10.648  -2.785   8.343
  777    HB   THR 101           HB       THR 101  -8.124  -3.490   6.777
  778    HG1  THR 101           HG1      THR 101  -9.039  -5.345   7.622
  779   1HG2  THR 101          1HG2      THR 101  -6.993  -2.900   8.894
  780   2HG2  THR 101          2HG2      THR 101  -8.550  -2.471   9.630
  781   3HG2  THR 101          3HG2      THR 101  -7.904  -1.507   8.288
  782    H    VAL 102           H        VAL 102  -9.303  -2.377   4.943
  783    HA   VAL 102           HA       VAL 102  -9.021   0.432   5.424
  784    HB   VAL 102           HB       VAL 102  -7.939  -1.052   3.680
  785   1HG1  VAL 102          1HG2      VAL 102  -7.632   1.456   3.932
  786   2HG1  VAL 102          2HG2      VAL 102  -7.546   0.974   2.233
  787   3HG1  VAL 102          3HG2      VAL 102  -9.020   1.715   2.869
  788   1HG2  VAL 102          1HG1      VAL 102  -9.907  -1.865   2.501
  789   2HG2  VAL 102          2HG1      VAL 102  -8.771  -1.021   1.434
  790   3HG2  VAL 102          3HG1      VAL 102 -10.264  -0.206   1.937
  791    H    GLU 103           HN       GLU 103 -11.560  -1.413   3.869
  792    HA   GLU 103           HA       GLU 103 -13.277   0.575   2.933
  793   1HB   GLU 103          1HB       GLU 103 -13.516  -1.898   2.656
  794   2HB   GLU 103          2HB       GLU 103 -14.132  -2.025   4.302
  795   1HG   GLU 103          1HG       GLU 103 -16.071  -0.615   3.693
  796   2HG   GLU 103          2HG       GLU 103 -15.399  -0.366   2.072
  797    H    LYS 104           HN       LYS 104 -13.276  -0.929   6.138
  798    HA   LYS 104           HA       LYS 104 -15.285   0.589   7.431
  799   1HB   LYS 104          2HB       LYS 104 -14.301  -1.241   8.603
  800   2HB   LYS 104          1HB       LYS 104 -12.675  -0.626   8.353
  801   1HG   LYS 104          1HG       LYS 104 -13.327   1.357   9.919
  802   2HG   LYS 104          2HG       LYS 104 -14.683   0.337  10.384
  803   1HD   LYS 104          1HD       LYS 104 -11.679  -0.280  10.456
  804   2HD   LYS 104          2HD       LYS 104 -12.670   0.139  11.851
  805   1HE   LYS 104          2HE       LYS 104 -12.893  -2.407  10.160
  806   2HE   LYS 104          1HE       LYS 104 -12.248  -2.279  11.800
  807   1HZ   LYS 104          1HZ       LYS 104 -14.419  -1.586  12.536
  808   2HZ   LYS 104          2HZ       LYS 104 -14.480  -3.067  11.814
  809   3HZ   LYS 104          3HZ       LYS 104 -15.020  -1.737  11.007
  810    H    TYR 105           H        TYR 105 -11.823   1.326   6.988
  811    HA   TYR 105           HA       TYR 105 -11.967   3.811   8.482
  812   1HB   TYR 105          1HB       TYR 105  -9.863   2.222   6.997
  813   2HB   TYR 105          2HB       TYR 105  -9.595   3.908   7.380
  814    HD1  TYR 105           HD1      TYR 105  -9.353   0.587   8.713
  815    HD2  TYR 105           HD2      TYR 105  -9.692   4.751   9.679
  816    HE1  TYR 105           HE1      TYR 105  -8.452   0.117  10.959
  817    HE2  TYR 105           HE2      TYR 105  -8.635   4.321  11.888
  818    HH   TYR 105           HH       TYR 105  -7.745   2.723  13.298
  819    H    LEU 106           H        LEU 106 -10.811   3.289   5.220
  820    HA   LEU 106           HA       LEU 106  -9.804   5.057   4.002
  821   1HB   LEU 106          1HB       LEU 106 -11.546   5.210   2.085
  822   2HB   LEU 106          2HB       LEU 106 -10.738   3.711   2.506
  823    HG   LEU 106           HG       LEU 106 -12.700   2.836   3.580
  824   1HD1  LEU 106          1HD1      LEU 106 -12.333   2.526   1.163
  825   2HD1  LEU 106          2HD1      LEU 106 -14.063   2.587   1.541
  826   3HD1  LEU 106          3HD1      LEU 106 -13.260   4.003   0.831
  827   1HD2  LEU 106          1HD2      LEU 106 -14.917   4.002   3.257
  828   2HD2  LEU 106          2HD2      LEU 106 -14.001   5.499   2.967
  829   3HD2  LEU 106          3HD2      LEU 106 -13.892   4.632   4.530
  830    H    ASN 107           H        ASN 107 -12.953   6.186   5.044
  831    HA   ASN 107           HA       ASN 107 -14.062   8.169   4.811
  832   1HB   ASN 107          1HB       ASN 107 -13.022  10.019   5.879
  833   2HB   ASN 107          2HB       ASN 107 -12.530   8.548   6.709
  834   1HD2  ASN 107          1HD2      ASN 107 -11.359  10.598   4.007
  835   2HD2  ASN 107          2HD2      ASN 107  -9.679  10.707   4.576
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1   0.157  -3.276 -11.984
    2   2H    MET   1          2H        MET   1  -1.294  -3.373 -11.175
    3   3H    MET   1          3H        MET   1  -0.578  -1.925 -11.343
    4    HA   MET   1           HA       MET   1  -0.831  -1.990 -13.708
    5   1HB   MET   1          1HB       MET   1  -0.875  -4.390 -14.042
    6   2HB   MET   1          2HB       MET   1  -2.331  -4.582 -13.068
    7   1HG   MET   1          2HG       MET   1  -2.778  -4.694 -15.495
    8   2HG   MET   1          1HG       MET   1  -3.657  -3.373 -14.732
    9   1HE   MET   1          1HE       MET   1  -3.643  -3.412 -17.737
   10   2HE   MET   1          2HE       MET   1  -3.119  -1.766 -18.166
   11   3HE   MET   1          3HE       MET   1  -4.238  -2.012 -16.806
   12    H    GLU   2           HN       GLU   2  -3.793  -3.338 -12.070
   13    HA   GLU   2           HA       GLU   2  -5.256  -0.892 -12.496
   14   1HB   GLU   2          1HB       GLU   2  -5.698  -3.113 -10.466
   15   2HB   GLU   2          2HB       GLU   2  -6.869  -1.866 -10.914
   16   1HG   GLU   2          2HG       GLU   2  -7.054  -2.745 -13.167
   17   2HG   GLU   2          1HG       GLU   2  -5.777  -3.935 -12.871
   18    H    ALA   3           H        ALA   3  -3.309  -2.252  -9.870
   19    HA   ALA   3           HA       ALA   3  -3.473   0.239  -8.259
   20   1HB   ALA   3          1HB       ALA   3  -1.948  -1.000  -6.735
   21   2HB   ALA   3          2HB       ALA   3  -3.450  -1.890  -7.035
   22   3HB   ALA   3          3HB       ALA   3  -1.951  -2.370  -7.865
   23    H    GLY   4           H        GLY   4  -1.617   1.618  -8.051
   24   1HA   GLY   4          1HA       GLY   4   0.113   1.643 -10.420
   25   2HA   GLY   4          2HA       GLY   4   0.116   2.792  -9.078
   26    H    ALA   5           H        ALA   5   2.517   2.028 -10.072
   27    HA   ALA   5           HA       ALA   5   3.691   0.238  -7.986
   28   1HB   ALA   5          1HB       ALA   5   3.972  -0.747 -10.229
   29   2HB   ALA   5          2HB       ALA   5   4.660   0.781 -10.826
   30   3HB   ALA   5          3HB       ALA   5   5.519  -0.158  -9.586
   31    H    VAL   6           H        VAL   6   5.150   1.374  -6.675
   32    HA   VAL   6           HA       VAL   6   6.035   4.076  -7.598
   33    HB   VAL   6           HB       VAL   6   5.745   4.759  -5.119
   34   1HG1  VAL   6          1HG1      VAL   6   5.142   2.547  -4.223
   35   2HG1  VAL   6          2HG1      VAL   6   3.906   3.764  -3.888
   36   3HG1  VAL   6          3HG1      VAL   6   3.639   2.556  -5.158
   37   1HG2  VAL   6          1HG2      VAL   6   3.364   4.486  -6.958
   38   2HG2  VAL   6          2HG2      VAL   6   4.517   5.829  -6.859
   39   3HG2  VAL   6          3HG2      VAL   6   3.439   5.504  -5.494
   40    H    ASN   7           H        ASN   7   7.738   4.930  -6.382
   41    HA   ASN   7           HA       ASN   7   9.486   3.112  -4.901
   42   1HB   ASN   7          1HB       ASN   7  10.195   4.482  -7.543
   43   2HB   ASN   7          2HB       ASN   7  11.445   4.073  -6.377
   44   1HD2  ASN   7          1HD2      ASN   7  11.312   1.748  -5.476
   45   2HD2  ASN   7          2HD2      ASN   7  11.106   0.519  -6.738
   46    H    ASP   8           HN       ASP   8  11.418   4.603  -4.220
   47    HA   ASP   8           HA       ASP   8  10.648   6.393  -2.349
   48   1HB   ASP   8          2HB       ASP   8  12.982   5.677  -2.722
   49   2HB   ASP   8          1HB       ASP   8  13.114   6.711  -4.134
   50    H    ASP   9           HN       ASP   9  11.676   7.463  -5.541
   51    HA   ASP   9           HA       ASP   9  11.228  10.208  -5.310
   52   1HB   ASP   9          1HB       ASP   9  11.460  10.241  -7.709
   53   2HB   ASP   9          2HB       ASP   9  12.547   9.024  -7.043
   54    H    THR  10           H        THR  10   9.141   7.849  -6.855
   55    HA   THR  10           HA       THR  10   7.028   9.666  -7.569
   56    HB   THR  10           HB       THR  10   5.854   7.327  -7.911
   57    HG1  THR  10           HG1      THR  10   8.568   6.482  -7.864
   58   1HG2  THR  10          1HG2      THR  10   7.126   6.989 -10.011
   59   2HG2  THR  10          2HG2      THR  10   6.705   8.692  -9.752
   60   3HG2  THR  10          3HG2      THR  10   8.361   8.134  -9.448
   61    H    PHE  11           H        PHE  11   7.411   7.272  -5.006
   62    HA   PHE  11           HA       PHE  11   5.032   7.139  -3.712
   63   1HB   PHE  11          1HB       PHE  11   7.093   6.001  -3.073
   64   2HB   PHE  11          2HB       PHE  11   7.802   7.483  -2.513
   65    HD1  PHE  11           HD1      PHE  11   6.978   8.599  -0.431
   66    HD2  PHE  11           HD2      PHE  11   5.683   4.667  -1.641
   67    HE1  PHE  11           HE1      PHE  11   6.406   8.074   1.898
   68    HE2  PHE  11           HE2      PHE  11   5.010   4.179   0.680
   69    HZ   PHE  11           HZ       PHE  11   5.347   5.886   2.472
   70    H    LYS  12           HN       LYS  12   7.457   9.614  -3.138
   71    HA   LYS  12           HA       LYS  12   6.259  11.251  -1.235
   72   1HB   LYS  12          2HB       LYS  12   7.546  12.386  -3.758
   73   2HB   LYS  12          1HB       LYS  12   7.388  13.174  -2.199
   74   1HG   LYS  12          1HG       LYS  12   9.096  10.743  -2.832
   75   2HG   LYS  12          2HG       LYS  12   9.677  12.382  -2.585
   76   1HD   LYS  12          1HD       LYS  12   8.941  12.295  -0.213
   77   2HD   LYS  12          2HD       LYS  12   8.332  10.644  -0.461
   78   1HE   LYS  12          2HE       LYS  12  10.615   9.888  -1.110
   79   2HE   LYS  12          1HE       LYS  12  11.235  11.518  -0.802
   80   1HZ   LYS  12          1HZ       LYS  12  11.584  10.057   1.039
   81   2HZ   LYS  12          2HZ       LYS  12   9.973   9.756   1.181
   82   3HZ   LYS  12          3HZ       LYS  12  10.558  11.269   1.477
   83    H    ASN  13           H        ASN  13   5.645  11.416  -4.751
   84    HA   ASN  13           HA       ASN  13   3.611  13.488  -4.424
   85   1HB   ASN  13          2HB       ASN  13   5.130  13.117  -6.471
   86   2HB   ASN  13          1HB       ASN  13   4.103  11.790  -6.924
   87   1HD2  ASN  13          1HD2      ASN  13   4.070  15.259  -6.052
   88   2HD2  ASN  13          2HD2      ASN  13   2.672  15.666  -7.045
   89    H    VAL  14           H        VAL  14   3.687  10.140  -5.580
   90    HA   VAL  14           HA       VAL  14   0.978  10.013  -6.121
   91    HB   VAL  14           HB       VAL  14   3.080   7.847  -5.650
   92   1HG1  VAL  14          1HG1      VAL  14   1.887   9.007  -8.209
   93   2HG1  VAL  14          2HG1      VAL  14   3.503   9.369  -7.578
   94   3HG1  VAL  14          3HG1      VAL  14   3.120   7.734  -8.123
   95   1HG2  VAL  14          1HG2      VAL  14   1.589   6.322  -6.991
   96   2HG2  VAL  14          2HG2      VAL  14   0.958   6.685  -5.381
   97   3HG2  VAL  14          3HG2      VAL  14   0.284   7.505  -6.810
   98    H    VAL  15           H        VAL  15   2.803   9.000  -3.250
   99    HA   VAL  15           HA       VAL  15   0.407   7.895  -1.935
  100    HB   VAL  15           HB       VAL  15   3.323   7.860  -1.036
  101   1HG1  VAL  15          1HG1      VAL  15   2.664   6.195   0.529
  102   2HG1  VAL  15          2HG1      VAL  15   0.974   6.243  -0.026
  103   3HG1  VAL  15          3HG1      VAL  15   1.691   7.631   0.814
  104   1HG2  VAL  15          1HG2      VAL  15   3.295   5.512  -1.781
  105   2HG2  VAL  15          2HG2      VAL  15   3.003   6.587  -3.151
  106   3HG2  VAL  15          3HG2      VAL  15   1.651   5.720  -2.412
  107    H    LEU  16           H        LEU  16   3.092  10.192  -1.028
  108    HA   LEU  16           HA       LEU  16   1.554  10.961   1.326
  109   1HB   LEU  16          1HB       LEU  16   3.901  12.511   0.200
  110   2HB   LEU  16          2HB       LEU  16   3.247  12.520   1.822
  111    HG   LEU  16           HG       LEU  16   4.664  10.174   0.475
  112   1HD1  LEU  16          1HD1      LEU  16   5.455  11.980   2.796
  113   2HD1  LEU  16          2HD1      LEU  16   6.407  10.627   2.144
  114   3HD1  LEU  16          3HD1      LEU  16   6.115  12.067   1.149
  115   1HD2  LEU  16          1HD2      LEU  16   3.480  10.429   3.276
  116   2HD2  LEU  16          2HD2      LEU  16   4.552   9.124   2.753
  117   3HD2  LEU  16          3HD2      LEU  16   2.964   9.295   2.008
  118    H    GLU  17           HN       GLU  17   2.487  12.952  -1.568
  119    HA   GLU  17           HA       GLU  17   0.442  14.930  -0.811
  120   1HB   GLU  17          1HB       GLU  17   2.158  14.826  -3.316
  121   2HB   GLU  17          2HB       GLU  17   1.287  16.213  -2.660
  122   1HG   GLU  17          1HG       GLU  17   3.709  14.833  -1.407
  123   2HG   GLU  17          2HG       GLU  17   3.638  16.446  -2.110
  124    H    SER  18           H        SER  18  -0.989  12.759  -1.025
  125    HA   SER  18           HA       SER  18  -2.165  12.429  -3.700
  126   1HB   SER  18          1HB       SER  18  -3.534  10.739  -2.297
  127   2HB   SER  18          2HB       SER  18  -1.803  10.421  -2.513
  128    HG   SER  18           HG       SER  18  -1.469  10.728  -0.451
  129    H    SER  19           H        SER  19  -4.468  12.731  -4.040
  130    HA   SER  19           HA       SER  19  -5.648  14.993  -2.574
  131   1HB   SER  19          2HB       SER  19  -7.380  14.607  -4.444
  132   2HB   SER  19          1HB       SER  19  -5.753  15.108  -4.953
  133    HG   SER  19           HG       SER  19  -6.453  13.315  -6.185
  134    H    VAL  20           H        VAL  20  -6.932  11.981  -3.868
  135    HA   VAL  20           HA       VAL  20  -8.744  11.574  -1.580
  136    HB   VAL  20           HB       VAL  20  -9.481   9.574  -2.840
  137   1HG1  VAL  20          1HG2      VAL  20  -8.676   9.076  -5.077
  138   2HG1  VAL  20          2HG2      VAL  20  -7.431  10.330  -4.965
  139   3HG1  VAL  20          3HG2      VAL  20  -7.360   8.900  -3.914
  140   1HG2  VAL  20          1HG1      VAL  20 -10.483  11.793  -3.302
  141   2HG2  VAL  20          2HG1      VAL  20 -10.491  10.739  -4.727
  142   3HG2  VAL  20          3HG1      VAL  20  -9.305  12.051  -4.607
  143    HA   PRO  21           HA       PRO  21  -6.167   8.902   0.790
  144   1HB   PRO  21          2HB       PRO  21  -8.314   6.780   0.418
  145   2HB   PRO  21          1HB       PRO  21  -7.360   7.118   1.884
  146   1HG   PRO  21          1HG       PRO  21  -9.829   8.165   1.637
  147   2HG   PRO  21          2HG       PRO  21  -8.508   9.243   2.178
  148   1HD   PRO  21          1HD       PRO  21  -9.758   9.051  -0.564
  149   2HD   PRO  21          2HD       PRO  21  -9.203  10.487   0.335
  150    H    VAL  22           H        VAL  22  -5.002   6.838   0.857
  151    HA   VAL  22           HA       VAL  22  -4.497   5.583  -1.786
  152    HB   VAL  22           HB       VAL  22  -2.413   6.519   0.194
  153   1HG1  VAL  22          1HG2      VAL  22  -1.783   4.712  -1.430
  154   2HG1  VAL  22          2HG2      VAL  22  -0.829   6.181  -1.514
  155   3HG1  VAL  22          3HG2      VAL  22  -2.060   5.881  -2.733
  156   1HG2  VAL  22          1HG1      VAL  22  -3.431   8.027  -2.248
  157   2HG2  VAL  22          2HG1      VAL  22  -3.415   8.586  -0.561
  158   3HG2  VAL  22          3HG1      VAL  22  -1.895   8.358  -1.428
  159    H    LEU  23           H        LEU  23  -3.644   3.465  -1.652
  160    HA   LEU  23           HA       LEU  23  -3.219   2.209   1.027
  161   1HB   LEU  23          2HB       LEU  23  -5.355   1.442   0.066
  162   2HB   LEU  23          1HB       LEU  23  -4.578   0.871  -1.382
  163    HG   LEU  23           HG       LEU  23  -3.838  -0.104   1.405
  164   1HD1  LEU  23          1HD2      LEU  23  -3.375  -1.257  -1.395
  165   2HD1  LEU  23          2HD2      LEU  23  -3.151  -2.205   0.079
  166   3HD1  LEU  23          3HD2      LEU  23  -2.126  -0.814  -0.212
  167   1HD2  LEU  23          1HD1      LEU  23  -5.887  -1.282  -0.502
  168   2HD2  LEU  23          2HD1      LEU  23  -6.174  -0.603   1.123
  169   3HD2  LEU  23          3HD1      LEU  23  -5.262  -2.096   0.947
  170    H    VAL  24           H        VAL  24  -0.900   2.164   0.880
  171    HA   VAL  24           HA       VAL  24   0.208   1.184  -1.747
  172    HB   VAL  24           HB       VAL  24   1.059   3.299  -1.448
  173   1HG1  VAL  24          1HG2      VAL  24   1.594   2.571   1.429
  174   2HG1  VAL  24          2HG2      VAL  24   0.523   3.847   0.805
  175   3HG1  VAL  24          3HG2      VAL  24   2.283   3.986   0.618
  176   1HG2  VAL  24          1HG1      VAL  24   3.429   2.916  -1.247
  177   2HG2  VAL  24          2HG1      VAL  24   2.702   1.505  -2.040
  178   3HG2  VAL  24          3HG1      VAL  24   3.184   1.421  -0.330
  179    H    ASP  25           HN       ASP  25   0.906  -0.839  -1.759
  180    HA   ASP  25           HA       ASP  25   1.342  -2.277   0.809
  181   1HB   ASP  25          2HB       ASP  25  -0.109  -3.410  -0.774
  182   2HB   ASP  25          1HB       ASP  25   1.110  -3.249  -2.045
  183    H    PHE  26           H        PHE  26   3.385  -2.236   1.593
  184    HA   PHE  26           HA       PHE  26   5.676  -1.661  -0.182
  185   1HB   PHE  26          2HB       PHE  26   5.386  -2.210   2.781
  186   2HB   PHE  26          1HB       PHE  26   6.933  -2.047   1.979
  187    HD1  PHE  26           HD1      PHE  26   3.643  -0.131   2.225
  188    HD2  PHE  26           HD2      PHE  26   7.953   0.078   1.938
  189    HE1  PHE  26           HE1      PHE  26   3.580   2.259   2.744
  190    HE2  PHE  26           HE2      PHE  26   7.860   2.470   2.578
  191    HZ   PHE  26           HZ       PHE  26   5.651   3.466   3.263
  192    H    TRP  27           H        TRP  27   6.169  -3.327  -1.517
  193    HA   TRP  27           HA       TRP  27   6.000  -6.142  -0.499
  194   1HB   TRP  27          2HB       TRP  27   5.328  -6.839  -2.686
  195   2HB   TRP  27          1HB       TRP  27   4.287  -5.500  -2.257
  196    HD1  TRP  27           HD1      TRP  27   5.148  -3.079  -3.418
  197    HE1  TRP  27           HE1      TRP  27   6.382  -2.595  -5.646
  198    HE3  TRP  27           HE3      TRP  27   6.469  -7.867  -4.686
  199    HZ2  TRP  27           HZ2      TRP  27   7.967  -4.091  -7.538
  200    HZ3  TRP  27           HZ3      TRP  27   7.701  -8.296  -6.760
  201    HH2  TRP  27           HH2      TRP  27   8.455  -6.425  -8.203
  202    H    ALA  28           H        ALA  28   7.283  -7.446  -2.456
  203    HA   ALA  28           HA       ALA  28   9.514  -6.212  -3.620
  204   1HB   ALA  28          1HB       ALA  28  10.189  -7.917  -1.177
  205   2HB   ALA  28          2HB       ALA  28  10.529  -6.174  -1.342
  206   3HB   ALA  28          3HB       ALA  28  11.353  -7.340  -2.383
  207    HA   PRO  29           HA       PRO  29   8.937  -9.992  -5.907
  208   1HB   PRO  29          1HB       PRO  29  11.517 -10.525  -6.808
  209   2HB   PRO  29          2HB       PRO  29  10.351  -9.374  -7.542
  210   1HG   PRO  29          1HG       PRO  29  12.586  -8.762  -5.577
  211   2HG   PRO  29          2HG       PRO  29  12.188  -7.896  -7.092
  212   1HD   PRO  29          2HD       PRO  29  11.286  -6.872  -4.788
  213   2HD   PRO  29          1HD       PRO  29  10.171  -7.023  -6.134
  214    H    TRP  30           H        TRP  30  11.692  -9.983  -3.584
  215    HA   TRP  30           HA       TRP  30  11.677 -12.884  -3.343
  216   1HB   TRP  30          2HB       TRP  30  13.085 -12.424  -1.335
  217   2HB   TRP  30          1HB       TRP  30  13.692 -11.777  -2.852
  218    HD1  TRP  30           HD1      TRP  30  14.294  -9.323  -2.944
  219    HE1  TRP  30           HE1      TRP  30  14.236  -7.340  -1.341
  220    HE3  TRP  30           HE3      TRP  30  11.490 -11.411   0.810
  221    HZ2  TRP  30           HZ2      TRP  30  13.018  -6.687   1.198
  222    HZ3  TRP  30           HZ3      TRP  30  10.885 -10.070   2.796
  223    HH2  TRP  30           HH2      TRP  30  11.574  -7.695   2.970
  224    H    CYS  31           H        CYS  31   9.531 -10.418  -2.155
  225    HA   CYS  31           HA       CYS  31   8.907 -11.885   0.349
  226   1HB   CYS  31          2HB       CYS  31   8.850  -9.493   0.458
  227   2HB   CYS  31          1HB       CYS  31   7.681  -9.404  -0.866
  228    H    GLY  32           H        GLY  32   8.431 -13.855  -0.771
  229   1HA   GLY  32          2HA       GLY  32   6.643 -14.572  -2.620
  230   2HA   GLY  32          1HA       GLY  32   6.714 -15.449  -1.091
  231    HA   PRO  33           HA       PRO  33   2.692 -14.317   0.207
  232   1HB   PRO  33          1HB       PRO  33   3.629 -12.275   2.213
  233   2HB   PRO  33          2HB       PRO  33   2.448 -13.601   2.409
  234   1HG   PRO  33          1HG       PRO  33   4.960 -13.880   3.363
  235   2HG   PRO  33          2HG       PRO  33   4.199 -15.236   2.474
  236   1HD   PRO  33          1HD       PRO  33   6.156 -13.193   1.406
  237   2HD   PRO  33          2HD       PRO  33   6.165 -14.969   1.182
  238    H    CYS  34           H        CYS  34   4.694 -11.380   0.103
  239    HA   CYS  34           HA       CYS  34   2.613  -9.491  -0.426
  240   1HB   CYS  34          2HB       CYS  34   5.429  -9.261  -1.564
  241   2HB   CYS  34          1HB       CYS  34   4.232  -8.017  -1.224
  242    H    ARG  35           HN       ARG  35   4.823 -11.322  -2.530
  243    HA   ARG  35           HA       ARG  35   3.948 -10.349  -5.016
  244   1HB   ARG  35          1HB       ARG  35   5.988 -11.797  -4.268
  245   2HB   ARG  35          2HB       ARG  35   4.969 -13.191  -4.603
  246   1HG   ARG  35          2HG       ARG  35   4.739 -12.554  -6.940
  247   2HG   ARG  35          1HG       ARG  35   5.469 -10.962  -6.630
  248   1HD   ARG  35          1HD       ARG  35   7.553 -12.028  -5.921
  249   2HD   ARG  35          2HD       ARG  35   6.907 -13.632  -6.321
  250    HE   ARG  35           HE       ARG  35   6.581 -12.204  -8.646
  251   1HH1  ARG  35          2HH1      ARG  35   9.387 -12.764  -6.527
  252   2HH1  ARG  35          1HH1      ARG  35  10.515 -12.878  -7.848
  253   1HH2  ARG  35          1HH2      ARG  35   8.089 -12.228 -10.349
  254   2HH2  ARG  35          2HH2      ARG  35   9.784 -12.491 -10.044
  255    H    ILE  36           H        ILE  36   2.925 -13.340  -3.280
  256    HA   ILE  36           HA       ILE  36   0.964 -13.922  -5.370
  257    HB   ILE  36           HB       ILE  36   0.238 -15.789  -4.029
  258   1HG1  ILE  36          2HG1      ILE  36   1.808 -16.243  -1.930
  259   2HG1  ILE  36          1HG1      ILE  36   1.819 -14.490  -1.825
  260   1HG2  ILE  36          1HG2      ILE  36   2.326 -17.017  -4.085
  261   2HG2  ILE  36          2HG2      ILE  36   2.280 -15.892  -5.448
  262   3HG2  ILE  36          3HG2      ILE  36   3.276 -15.523  -4.026
  263   1HD1  ILE  36          1HD1      ILE  36  -0.592 -16.367  -1.787
  264   2HD1  ILE  36          2HD1      ILE  36  -0.749 -14.604  -1.791
  265   3HD1  ILE  36          3HD1      ILE  36   0.036 -15.419  -0.426
  266    H    ILE  37           H        ILE  37   0.777 -11.933  -2.442
  267    HA   ILE  37           HA       ILE  37  -2.158 -11.798  -2.587
  268    HB   ILE  37           HB       ILE  37  -0.085 -10.216  -1.023
  269   1HG1  ILE  37          2HG1      ILE  37  -2.152 -12.239  -0.024
  270   2HG1  ILE  37          1HG1      ILE  37  -0.533 -12.731  -0.492
  271   1HG2  ILE  37          1HG2      ILE  37  -2.024  -9.385   0.322
  272   2HG2  ILE  37          2HG2      ILE  37  -3.137 -10.191  -0.797
  273   3HG2  ILE  37          3HG2      ILE  37  -2.127  -8.839  -1.333
  274   1HD1  ILE  37          1HD1      ILE  37  -0.578 -12.451   1.882
  275   2HD1  ILE  37          2HD1      ILE  37  -1.191 -10.797   1.756
  276   3HD1  ILE  37          3HD1      ILE  37   0.447 -11.180   1.189
  277    H    ALA  38           H        ALA  38   0.597  -9.995  -3.882
  278    HA   ALA  38           HA       ALA  38  -0.274  -7.592  -4.613
  279   1HB   ALA  38          1HB       ALA  38   1.936  -8.582  -5.205
  280   2HB   ALA  38          2HB       ALA  38   1.199  -7.651  -6.515
  281   3HB   ALA  38          3HB       ALA  38   1.166  -9.414  -6.577
  282    HA   PRO  39           HA       PRO  39  -2.640  -9.009  -8.579
  283   1HB   PRO  39          2HB       PRO  39  -3.912 -11.565  -7.647
  284   2HB   PRO  39          1HB       PRO  39  -3.296 -11.147  -9.270
  285   1HG   PRO  39          2HG       PRO  39  -1.880 -12.825  -7.662
  286   2HG   PRO  39          1HG       PRO  39  -1.020 -11.536  -8.567
  287   1HD   PRO  39          1HD       PRO  39  -2.071 -11.416  -5.730
  288   2HD   PRO  39          2HD       PRO  39  -0.412 -11.108  -6.255
  289    H    VAL  40           H        VAL  40  -3.773  -9.982  -5.284
  290    HA   VAL  40           HA       VAL  40  -6.408  -9.069  -6.004
  291    HB   VAL  40           HB       VAL  40  -6.686  -9.121  -3.391
  292   1HG1  VAL  40          1HG2      VAL  40  -7.276 -11.683  -3.738
  293   2HG1  VAL  40          2HG2      VAL  40  -6.440 -11.569  -5.289
  294   3HG1  VAL  40          3HG2      VAL  40  -7.932 -10.655  -5.015
  295   1HG2  VAL  40          1HG1      VAL  40  -5.701 -10.794  -2.213
  296   2HG2  VAL  40          2HG1      VAL  40  -4.632  -9.460  -2.635
  297   3HG2  VAL  40          3HG1      VAL  40  -4.502 -11.044  -3.498
  298    H    VAL  41           H        VAL  41  -3.492  -7.842  -4.268
  299    HA   VAL  41           HA       VAL  41  -4.510  -5.355  -3.332
  300    HB   VAL  41           HB       VAL  41  -1.789  -5.730  -4.668
  301   1HG1  VAL  41          1HG1      VAL  41  -1.993  -7.346  -2.883
  302   2HG1  VAL  41          2HG1      VAL  41  -0.927  -6.051  -2.356
  303   3HG1  VAL  41          3HG1      VAL  41  -2.601  -6.115  -1.756
  304   1HG2  VAL  41          1HG2      VAL  41  -2.330  -3.380  -4.400
  305   2HG2  VAL  41          2HG2      VAL  41  -1.128  -3.836  -3.197
  306   3HG2  VAL  41          3HG2      VAL  41  -2.823  -3.642  -2.712
  307    H    ASP  42           HN       ASP  42  -3.389  -6.366  -6.571
  308    HA   ASP  42           HA       ASP  42  -3.844  -3.901  -7.877
  309   1HB   ASP  42          2HB       ASP  42  -2.693  -6.154  -8.701
  310   2HB   ASP  42          1HB       ASP  42  -4.307  -6.510  -9.324
  311    H    GLU  43           HN       GLU  43  -6.028  -6.804  -7.795
  312    HA   GLU  43           HA       GLU  43  -8.125  -5.511  -9.140
  313   1HB   GLU  43          1HB       GLU  43  -9.376  -7.330  -8.767
  314   2HB   GLU  43          2HB       GLU  43  -7.782  -8.004  -8.439
  315   1HG   GLU  43          2HG       GLU  43  -8.362  -7.566  -5.912
  316   2HG   GLU  43          1HG       GLU  43  -9.987  -7.190  -6.480
  317    H    ILE  44           H        ILE  44  -7.536  -5.572  -5.580
  318    HA   ILE  44           HA       ILE  44  -9.793  -4.207  -4.696
  319    HB   ILE  44           HB       ILE  44  -6.883  -4.063  -3.836
  320   1HG1  ILE  44          2HG1      ILE  44  -9.359  -5.305  -2.545
  321   2HG1  ILE  44          1HG1      ILE  44  -8.225  -6.205  -3.522
  322   1HG2  ILE  44          1HG2      ILE  44  -7.926  -1.929  -3.145
  323   2HG2  ILE  44          2HG2      ILE  44  -7.628  -2.958  -1.761
  324   3HG2  ILE  44          3HG2      ILE  44  -9.275  -2.837  -2.415
  325   1HD1  ILE  44          1HD1      ILE  44  -7.508  -6.618  -1.314
  326   2HD1  ILE  44          2HD1      ILE  44  -7.721  -4.944  -0.808
  327   3HD1  ILE  44          3HD1      ILE  44  -6.380  -5.393  -1.890
  328    H    ALA  45           H        ALA  45  -7.034  -2.869  -6.544
  329    HA   ALA  45           HA       ALA  45  -7.616  -0.111  -6.155
  330   1HB   ALA  45          1HB       ALA  45  -6.240   0.258  -8.054
  331   2HB   ALA  45          2HB       ALA  45  -5.587  -1.236  -7.327
  332   3HB   ALA  45          3HB       ALA  45  -6.623  -1.318  -8.752
  333    H    GLY  46           H        GLY  46  -8.954  -2.565  -8.448
  334   1HA   GLY  46          1HA       GLY  46 -10.416  -0.646 -10.071
  335   2HA   GLY  46          2HA       GLY  46 -10.624  -2.410 -10.012
  336    H    GLU  47           HN       GLU  47 -11.039  -2.814  -7.311
  337    HA   GLU  47           HA       GLU  47 -13.809  -2.361  -7.061
  338   1HB   GLU  47          2HB       GLU  47 -11.801  -2.967  -4.849
  339   2HB   GLU  47          1HB       GLU  47 -13.545  -3.143  -4.767
  340   1HG   GLU  47          2HG       GLU  47 -13.269  -4.734  -6.831
  341   2HG   GLU  47          1HG       GLU  47 -11.562  -4.721  -6.460
  342    H    TYR  48           H        TYR  48 -11.176  -0.554  -5.490
  343    HA   TYR  48           HA       TYR  48 -13.212   1.519  -4.610
  344   1HB   TYR  48          2HB       TYR  48 -10.656   0.580  -3.267
  345   2HB   TYR  48          1HB       TYR  48 -11.703   1.859  -2.661
  346    HD1  TYR  48           HD1      TYR  48 -13.951   1.403  -1.768
  347    HD2  TYR  48           HD2      TYR  48 -11.297  -1.761  -2.983
  348    HE1  TYR  48           HE1      TYR  48 -15.398  -0.248  -0.622
  349    HE2  TYR  48           HE2      TYR  48 -12.823  -3.433  -1.954
  350    HH   TYR  48           HH       TYR  48 -15.581  -2.482   0.052
  351    H    LYS  49           HN       LYS  49 -11.035   1.485  -7.005
  352    HA   LYS  49           HA       LYS  49  -9.130   3.228  -6.807
  353   1HB   LYS  49          1HB       LYS  49 -10.322   2.217  -8.992
  354   2HB   LYS  49          2HB       LYS  49 -11.113   3.770  -9.052
  355   1HG   LYS  49          1HG       LYS  49  -9.226   3.925 -10.458
  356   2HG   LYS  49          2HG       LYS  49  -8.804   4.852  -9.010
  357   1HD   LYS  49          2HD       LYS  49  -7.465   2.884  -8.179
  358   2HD   LYS  49          1HD       LYS  49  -7.992   1.951  -9.583
  359   1HE   LYS  49          1HE       LYS  49  -5.728   2.784  -9.925
  360   2HE   LYS  49          2HE       LYS  49  -6.823   3.540 -11.091
  361   1HZ   LYS  49          1HZ       LYS  49  -5.872   4.756  -8.587
  362   2HZ   LYS  49          2HZ       LYS  49  -6.860   5.479  -9.691
  363   3HZ   LYS  49          3HZ       LYS  49  -5.311   5.099 -10.099
  364    H    ASP  50           HN       ASP  50 -12.427   4.423  -7.273
  365    HA   ASP  50           HA       ASP  50 -12.171   7.118  -7.443
  366   1HB   ASP  50          1HB       ASP  50 -14.197   5.561  -5.764
  367   2HB   ASP  50          2HB       ASP  50 -14.389   7.227  -6.311
  368    H    LYS  51           HN       LYS  51 -12.106   5.270  -4.433
  369    HA   LYS  51           HA       LYS  51 -11.693   7.750  -2.804
  370   1HB   LYS  51          1HB       LYS  51 -12.235   4.882  -2.001
  371   2HB   LYS  51          2HB       LYS  51 -12.153   6.254  -0.899
  372   1HG   LYS  51          2HG       LYS  51 -14.214   7.132  -1.586
  373   2HG   LYS  51          1HG       LYS  51 -14.198   6.288  -3.137
  374   1HD   LYS  51          1HD       LYS  51 -15.834   5.284  -1.600
  375   2HD   LYS  51          2HD       LYS  51 -14.581   4.140  -2.099
  376   1HE   LYS  51          2HE       LYS  51 -13.411   4.458   0.084
  377   2HE   LYS  51          1HE       LYS  51 -14.659   5.614   0.581
  378   1HZ   LYS  51          1HZ       LYS  51 -16.244   3.852   0.479
  379   2HZ   LYS  51          2HZ       LYS  51 -14.969   3.389   1.417
  380   3HZ   LYS  51          3HZ       LYS  51 -15.120   2.795  -0.106
  381    H    LEU  52           H        LEU  52 -10.222   4.644  -3.664
  382    HA   LEU  52           HA       LEU  52  -7.954   5.182  -1.792
  383   1HB   LEU  52          1HB       LEU  52  -9.653   3.329  -1.392
  384   2HB   LEU  52          2HB       LEU  52  -9.038   2.560  -2.859
  385    HG   LEU  52           HG       LEU  52  -6.734   2.556  -1.718
  386   1HD1  LEU  52          1HD1      LEU  52  -6.924   2.722   0.857
  387   2HD1  LEU  52          2HD1      LEU  52  -8.515   3.439   0.605
  388   3HD1  LEU  52          3HD1      LEU  52  -7.060   4.262   0.011
  389   1HD2  LEU  52          1HD2      LEU  52  -9.113   1.099  -0.447
  390   2HD2  LEU  52          2HD2      LEU  52  -8.224   0.584  -1.897
  391   3HD2  LEU  52          3HD2      LEU  52  -7.426   0.585  -0.324
  392    H    LYS  53           HN       LYS  53  -6.128   5.836  -2.857
  393    HA   LYS  53           HA       LYS  53  -5.691   5.059  -5.645
  394   1HB   LYS  53          2HB       LYS  53  -5.108   7.308  -4.246
  395   2HB   LYS  53          1HB       LYS  53  -3.619   6.458  -3.973
  396   1HG   LYS  53          2HG       LYS  53  -4.795   6.972  -6.727
  397   2HG   LYS  53          1HG       LYS  53  -3.501   7.902  -5.955
  398   1HD   LYS  53          2HD       LYS  53  -2.065   5.899  -5.846
  399   2HD   LYS  53          1HD       LYS  53  -3.323   4.918  -6.628
  400   1HE   LYS  53          1HE       LYS  53  -3.218   6.355  -8.639
  401   2HE   LYS  53          2HE       LYS  53  -1.961   7.344  -7.873
  402   1HZ   LYS  53          1HZ       LYS  53  -1.744   4.478  -8.482
  403   2HZ   LYS  53          2HZ       LYS  53  -1.046   5.702  -9.337
  404   3HZ   LYS  53          3HZ       LYS  53  -0.573   5.407  -7.786
  405    H    CYS  54           H        CYS  54  -5.513   2.789  -5.507
  406    HA   CYS  54           HA       CYS  54  -3.889   1.560  -3.462
  407   1HB   CYS  54          1HB       CYS  54  -5.865   0.474  -4.472
  408   2HB   CYS  54          2HB       CYS  54  -4.952   0.364  -6.004
  409    HG   CYS  54           HG       CYS  54  -4.895  -1.943  -4.849
  410    H    VAL  55           H        VAL  55  -1.739   0.923  -3.540
  411    HA   VAL  55           HA       VAL  55  -0.285   1.049  -6.094
  412    HB   VAL  55           HB       VAL  55   1.287   2.449  -4.078
  413   1HG1  VAL  55          1HG1      VAL  55   0.116   4.534  -3.850
  414   2HG1  VAL  55          2HG1      VAL  55  -1.293   3.904  -4.708
  415   3HG1  VAL  55          3HG1      VAL  55  -0.843   3.251  -3.110
  416   1HG2  VAL  55          1HG2      VAL  55   1.702   2.549  -6.477
  417   2HG2  VAL  55          2HG2      VAL  55   0.115   3.313  -6.744
  418   3HG2  VAL  55          3HG2      VAL  55   1.378   4.168  -5.839
  419    H    LYS  56           HN       LYS  56   1.963   0.339  -5.902
  420    HA   LYS  56           HA       LYS  56   2.540  -1.418  -3.564
  421   1HB   LYS  56          2HB       LYS  56   2.270  -2.004  -6.476
  422   2HB   LYS  56          1HB       LYS  56   3.634  -2.772  -5.663
  423   1HG   LYS  56          1HG       LYS  56   2.262  -3.809  -4.018
  424   2HG   LYS  56          2HG       LYS  56   0.829  -2.881  -4.487
  425   1HD   LYS  56          2HD       LYS  56   2.198  -4.867  -6.349
  426   2HD   LYS  56          1HD       LYS  56   0.914  -5.309  -5.206
  427   1HE   LYS  56          1HE       LYS  56  -0.591  -3.596  -6.242
  428   2HE   LYS  56          2HE       LYS  56   0.646  -3.281  -7.472
  429   1HZ   LYS  56          1HZ       LYS  56  -0.973  -4.806  -8.248
  430   2HZ   LYS  56          2HZ       LYS  56   0.466  -5.598  -8.102
  431   3HZ   LYS  56          3HZ       LYS  56  -0.731  -5.837  -6.990
  432    H    LEU  57           H        LEU  57   4.346  -0.819  -2.591
  433    HA   LEU  57           HA       LEU  57   6.409   0.772  -4.053
  434   1HB   LEU  57          1HB       LEU  57   5.421   1.820  -2.091
  435   2HB   LEU  57          2HB       LEU  57   5.919   0.442  -1.082
  436    HG   LEU  57           HG       LEU  57   7.168   2.460  -0.736
  437   1HD1  LEU  57          1HD1      LEU  57   8.377   1.948  -3.459
  438   2HD1  LEU  57          2HD1      LEU  57   8.816   3.248  -2.322
  439   3HD1  LEU  57          3HD1      LEU  57   7.226   3.257  -3.104
  440   1HD2  LEU  57          1HD2      LEU  57   8.052   0.038  -0.394
  441   2HD2  LEU  57          2HD2      LEU  57   9.165   1.407  -0.320
  442   3HD2  LEU  57          3HD2      LEU  57   9.099   0.395  -1.770
  443    H    ASN  58           H        ASN  58   8.185  -0.224  -4.697
  444    HA   ASN  58           HA       ASN  58   8.736  -2.980  -3.886
  445   1HB   ASN  58          1HB       ASN  58   9.131  -2.228  -6.186
  446   2HB   ASN  58          2HB       ASN  58  10.328  -1.062  -5.606
  447   1HD2  ASN  58          2HD2      ASN  58   9.936  -4.292  -6.734
  448   2HD2  ASN  58          1HD2      ASN  58  11.516  -4.860  -6.227
  449    H    THR  59           H        THR  59   9.389  -3.250  -1.873
  450    HA   THR  59           HA       THR  59  11.062  -1.387  -0.412
  451    HB   THR  59           HB       THR  59  10.164  -4.160   0.454
  452    HG1  THR  59           HG1      THR  59   8.347  -3.236  -0.323
  453   1HG2  THR  59          1HG2      THR  59  10.620  -1.517   1.887
  454   2HG2  THR  59          2HG2      THR  59  11.620  -2.970   2.047
  455   3HG2  THR  59          3HG2      THR  59   9.962  -2.973   2.666
  456    H    ASP  60           HN       ASP  60  12.482  -2.228  -2.578
  457    HA   ASP  60           HA       ASP  60  14.800  -3.561  -1.278
  458   1HB   ASP  60          1HB       ASP  60  13.342  -5.231  -2.527
  459   2HB   ASP  60          2HB       ASP  60  13.786  -4.417  -4.030
  460    H    GLU  61           HN       GLU  61  13.437  -2.116  -4.175
  461    HA   GLU  61           HA       GLU  61  15.720  -0.454  -4.847
  462   1HB   GLU  61          2HB       GLU  61  14.117  -1.447  -6.492
  463   2HB   GLU  61          1HB       GLU  61  12.814  -0.498  -5.769
  464   1HG   GLU  61          1HG       GLU  61  13.564   0.545  -7.815
  465   2HG   GLU  61          2HG       GLU  61  13.957   1.607  -6.470
  466    H    SER  62           H        SER  62  12.762  -0.143  -2.878
  467    HA   SER  62           HA       SER  62  13.617   2.585  -2.106
  468   1HB   SER  62          1HB       SER  62  10.712   1.725  -2.656
  469   2HB   SER  62          2HB       SER  62  11.301   3.315  -2.146
  470    HG   SER  62           HG       SER  62  12.825   2.800  -4.156
  471    HA   PRO  63           HA       PRO  63  12.932   0.084   1.723
  472   1HB   PRO  63          1HB       PRO  63  15.503   0.086   2.625
  473   2HB   PRO  63          2HB       PRO  63  14.908  -1.148   1.467
  474   1HG   PRO  63          1HG       PRO  63  16.482   1.377   0.882
  475   2HG   PRO  63          2HG       PRO  63  16.756  -0.265   0.231
  476   1HD   PRO  63          2HD       PRO  63  15.376   1.621  -1.197
  477   2HD   PRO  63          1HD       PRO  63  14.871  -0.068  -1.222
  478    H    ASN  64           H        ASN  64  14.660   2.930   0.669
  479    HA   ASN  64           HA       ASN  64  15.141   4.610   2.727
  480   1HB   ASN  64          2HB       ASN  64  13.543   5.191   0.201
  481   2HB   ASN  64          1HB       ASN  64  14.109   6.428   1.329
  482   1HD2  ASN  64          1HD2      ASN  64  15.041   7.108  -0.829
  483   2HD2  ASN  64          2HD2      ASN  64  16.675   6.531  -1.198
  484    H    VAL  65           H        VAL  65  11.910   4.665   1.287
  485    HA   VAL  65           HA       VAL  65  10.929   6.103   3.420
  486    HB   VAL  65           HB       VAL  65   8.618   5.147   2.261
  487   1HG1  VAL  65          1HG1      VAL  65   9.076   7.144   0.622
  488   2HG1  VAL  65          2HG1      VAL  65  10.761   7.111   1.159
  489   3HG1  VAL  65          3HG1      VAL  65   9.488   7.563   2.308
  490   1HG2  VAL  65          1HG2      VAL  65   9.787   3.532   0.885
  491   2HG2  VAL  65          2HG2      VAL  65   8.775   4.700   0.024
  492   3HG2  VAL  65          3HG2      VAL  65  10.530   4.878  -0.023
  493    H    ALA  66           H        ALA  66  11.075   2.649   2.779
  494    HA   ALA  66           HA       ALA  66   9.183   1.768   4.775
  495   1HB   ALA  66          1HB       ALA  66  10.113   0.345   2.962
  496   2HB   ALA  66          2HB       ALA  66  10.279  -0.399   4.565
  497   3HB   ALA  66          3HB       ALA  66  11.686   0.322   3.789
  498    H    SER  67           H        SER  67  12.618   2.666   4.865
  499    HA   SER  67           HA       SER  67  13.041   1.930   7.629
  500   1HB   SER  67          2HB       SER  67  14.657   3.850   5.893
  501   2HB   SER  67          1HB       SER  67  15.182   3.011   7.360
  502    HG   SER  67           HG       SER  67  14.405   1.792   4.900
  503    H    GLU  68           HN       GLU  68  12.386   4.964   5.884
  504    HA   GLU  68           HA       GLU  68  12.488   6.777   8.050
  505   1HB   GLU  68          1HB       GLU  68  10.715   6.769   5.576
  506   2HB   GLU  68          2HB       GLU  68  10.838   8.131   6.685
  507   1HG   GLU  68          1HG       GLU  68  13.109   8.555   6.170
  508   2HG   GLU  68          2HG       GLU  68  13.339   6.995   5.386
  509    H    TYR  69           H        TYR  69   9.682   4.843   6.853
  510    HA   TYR  69           HA       TYR  69   7.991   5.794   9.057
  511   1HB   TYR  69          2HB       TYR  69   7.672   3.793   6.808
  512   2HB   TYR  69          1HB       TYR  69   6.556   3.840   8.171
  513    HD1  TYR  69           HD1      TYR  69   7.742   5.759   5.211
  514    HD2  TYR  69           HD2      TYR  69   5.039   5.700   8.569
  515    HE1  TYR  69           HE1      TYR  69   6.756   7.881   4.447
  516    HE2  TYR  69           HE2      TYR  69   4.011   7.809   7.762
  517    HH   TYR  69           HH       TYR  69   5.323   9.618   4.978
  518    H    GLY  70           H        GLY  70   9.958   2.877   8.400
  519   1HA   GLY  70          1HA       GLY  70  11.074   1.737  10.139
  520   2HA   GLY  70          2HA       GLY  70   9.865   2.268  11.310
  521    H    ILE  71           H        ILE  71   9.811   0.535   8.172
  522    HA   ILE  71           HA       ILE  71   7.676  -1.243   9.071
  523    HB   ILE  71           HB       ILE  71   9.373  -1.136   6.546
  524   1HG1  ILE  71          2HG1      ILE  71   6.571  -0.197   7.317
  525   2HG1  ILE  71          1HG1      ILE  71   7.945   0.825   6.889
  526   1HG2  ILE  71          1HG2      ILE  71   8.550  -3.431   6.906
  527   2HG2  ILE  71          2HG2      ILE  71   7.672  -2.679   5.588
  528   3HG2  ILE  71          3HG2      ILE  71   6.910  -2.805   7.191
  529   1HD1  ILE  71          1HD1      ILE  71   6.322  -0.960   5.045
  530   2HD1  ILE  71          2HD1      ILE  71   7.900  -0.283   4.588
  531   3HD1  ILE  71          3HD1      ILE  71   6.542   0.789   4.990
  532    H    ARG  72           HN       ARG  72   7.981  -2.989  10.281
  533    HA   ARG  72           HA       ARG  72  10.630  -3.983  10.852
  534   1HB   ARG  72          2HB       ARG  72   8.924  -3.853  12.583
  535   2HB   ARG  72          1HB       ARG  72   7.835  -4.893  11.654
  536   1HG   ARG  72          1HG       ARG  72   8.849  -6.118  13.494
  537   2HG   ARG  72          2HG       ARG  72   9.316  -6.815  11.951
  538   1HD   ARG  72          2HD       ARG  72  11.544  -5.529  12.160
  539   2HD   ARG  72          1HD       ARG  72  10.993  -5.003  13.749
  540    HE   ARG  72           HE       ARG  72  11.467  -7.077  14.603
  541   1HH1  ARG  72          2HH1      ARG  72  11.434  -7.305  11.054
  542   2HH1  ARG  72          1HH1      ARG  72  12.024  -8.942  11.029
  543   1HH2  ARG  72          1HH2      ARG  72  12.268  -9.204  14.557
  544   2HH2  ARG  72          2HH2      ARG  72  12.530 -10.028  13.044
  545    H    SER  73           H        SER  73   7.937  -5.102   8.778
  546    HA   SER  73           HA       SER  73   9.638  -6.950   7.371
  547   1HB   SER  73          1HB       SER  73   7.303  -8.028   9.032
  548   2HB   SER  73          2HB       SER  73   8.159  -8.942   7.784
  549    HG   SER  73           HG       SER  73   9.926  -7.886   9.520
  550    H    ILE  74           H        ILE  74   8.098  -8.054   5.607
  551    HA   ILE  74           HA       ILE  74   5.933  -6.190   4.919
  552    HB   ILE  74           HB       ILE  74   6.666  -6.452   2.515
  553   1HG1  ILE  74          1HG1      ILE  74   9.344  -7.254   3.676
  554   2HG1  ILE  74          2HG1      ILE  74   8.231  -8.323   2.806
  555   1HG2  ILE  74          1HG2      ILE  74   8.133  -4.529   2.658
  556   2HG2  ILE  74          2HG2      ILE  74   8.582  -4.928   4.331
  557   3HG2  ILE  74          3HG2      ILE  74   6.934  -4.391   3.936
  558   1HD1  ILE  74          1HD1      ILE  74   9.711  -5.908   1.751
  559   2HD1  ILE  74          2HD1      ILE  74   8.271  -6.538   0.911
  560   3HD1  ILE  74          3HD1      ILE  74   9.695  -7.548   1.108
  561    HA   PRO  75           HA       PRO  75   4.492  -6.526   2.669
  562   1HB   PRO  75          2HB       PRO  75   1.795  -6.995   2.803
  563   2HB   PRO  75          1HB       PRO  75   2.883  -7.721   1.606
  564   1HG   PRO  75          1HG       PRO  75   1.879  -8.872   4.199
  565   2HG   PRO  75          2HG       PRO  75   1.968  -9.703   2.617
  566   1HD   PRO  75          2HD       PRO  75   3.858 -10.059   4.587
  567   2HD   PRO  75          1HD       PRO  75   4.327 -10.051   2.880
  568    H    THR  76           H        THR  76   3.573  -4.647   3.223
  569    HA   THR  76           HA       THR  76   2.347  -4.232   5.839
  570    HB   THR  76           HB       THR  76   5.023  -3.015   5.114
  571    HG1  THR  76           HG1      THR  76   5.301  -4.634   6.573
  572   1HG2  THR  76          1HG2      THR  76   4.593  -1.508   7.106
  573   2HG2  THR  76          2HG2      THR  76   3.645  -1.096   5.666
  574   3HG2  THR  76          3HG2      THR  76   2.885  -1.967   7.018
  575    H    ILE  77           H        ILE  77   0.524  -3.477   5.087
  576    HA   ILE  77           HA       ILE  77   0.379  -1.804   2.640
  577    HB   ILE  77           HB       ILE  77  -1.697  -3.184   4.403
  578   1HG1  ILE  77          2HG1      ILE  77  -2.321  -4.263   2.212
  579   2HG1  ILE  77          1HG1      ILE  77  -0.864  -3.572   1.491
  580   1HG2  ILE  77          1HG2      ILE  77  -2.014  -1.225   2.126
  581   2HG2  ILE  77          2HG2      ILE  77  -3.332  -2.292   2.678
  582   3HG2  ILE  77          3HG2      ILE  77  -2.675  -1.076   3.767
  583   1HD1  ILE  77          1HD1      ILE  77  -0.893  -5.467   3.892
  584   2HD1  ILE  77          2HD1      ILE  77  -0.700  -5.983   2.204
  585   3HD1  ILE  77          3HD1      ILE  77   0.531  -4.963   2.948
  586    H    MET  78           H        MET  78   0.595   0.398   2.994
  587    HA   MET  78           HA       MET  78  -0.237   1.477   5.681
  588   1HB   MET  78          1HB       MET  78   1.631   2.630   3.616
  589   2HB   MET  78          2HB       MET  78   1.064   3.468   5.066
  590   1HG   MET  78          1HG       MET  78   2.093   1.639   6.441
  591   2HG   MET  78          2HG       MET  78   2.764   0.978   4.958
  592   1HE   MET  78          1HE       MET  78   5.811   2.206   6.834
  593   2HE   MET  78          2HE       MET  78   4.388   2.196   7.908
  594   3HE   MET  78          3HE       MET  78   4.594   0.930   6.676
  595    H    VAL  79           H        VAL  79  -1.859   2.908   5.711
  596    HA   VAL  79           HA       VAL  79  -3.179   3.565   3.120
  597    HB   VAL  79           HB       VAL  79  -4.240   3.623   5.969
  598   1HG1  VAL  79          1HG1      VAL  79  -5.831   1.952   5.100
  599   2HG1  VAL  79          2HG1      VAL  79  -5.007   1.969   3.524
  600   3HG1  VAL  79          3HG1      VAL  79  -4.162   1.369   4.970
  601   1HG2  VAL  79          1HG2      VAL  79  -5.147   5.572   4.704
  602   2HG2  VAL  79          2HG2      VAL  79  -6.385   4.344   4.904
  603   3HG2  VAL  79          3HG2      VAL  79  -5.541   4.519   3.350
  604    H    PHE  80           H        PHE  80  -3.404   5.765   2.591
  605    HA   PHE  80           HA       PHE  80  -2.492   7.765   4.617
  606   1HB   PHE  80          2HB       PHE  80  -1.688   7.870   1.690
  607   2HB   PHE  80          1HB       PHE  80  -1.531   9.111   2.888
  608    HD1  PHE  80           HD1      PHE  80  -0.465   5.532   2.359
  609    HD2  PHE  80           HD2      PHE  80   0.531   9.415   3.942
  610    HE1  PHE  80           HE1      PHE  80   1.794   4.722   2.994
  611    HE2  PHE  80           HE2      PHE  80   2.644   8.514   4.828
  612    HZ   PHE  80           HZ       PHE  80   3.307   6.150   4.331
  613    H    LYS  81           HN       LYS  81  -3.270   9.873   4.180
  614    HA   LYS  81           HA       LYS  81  -5.655  10.157   2.480
  615   1HB   LYS  81          1HB       LYS  81  -7.241  10.408   4.196
  616   2HB   LYS  81          2HB       LYS  81  -6.401   8.903   4.524
  617   1HG   LYS  81          2HG       LYS  81  -6.458  11.461   6.074
  618   2HG   LYS  81          1HG       LYS  81  -6.647   9.802   6.621
  619   1HD   LYS  81          1HD       LYS  81  -4.138   9.488   6.312
  620   2HD   LYS  81          2HD       LYS  81  -4.030  11.208   5.891
  621   1HE   LYS  81          2HE       LYS  81  -5.094  11.804   8.057
  622   2HE   LYS  81          1HE       LYS  81  -5.043  10.093   8.533
  623   1HZ   LYS  81          1HZ       LYS  81  -3.196  11.387   9.358
  624   2HZ   LYS  81          2HZ       LYS  81  -2.719  11.732   7.817
  625   3HZ   LYS  81          3HZ       LYS  81  -2.679  10.179   8.373
  626    H    GLY  82           H        GLY  82  -3.486  11.502   1.952
  627   1HA   GLY  82          2HA       GLY  82  -3.180  13.789   1.451
  628   2HA   GLY  82          1HA       GLY  82  -4.180  14.240   2.839
  629    H    GLY  83           H        GLY  83  -0.957  13.485   1.755
  630   1HA   GLY  83          2HA       GLY  83   1.045  14.090   2.637
  631   2HA   GLY  83          1HA       GLY  83   0.228  14.857   3.996
  632    H    LYS  84           HN       LYS  84  -0.810  13.222   5.536
  633    HA   LYS  84           HA       LYS  84   1.406  11.383   6.331
  634   1HB   LYS  84          2HB       LYS  84  -0.865  12.600   7.931
  635   2HB   LYS  84          1HB       LYS  84   0.384  11.525   8.584
  636   1HG   LYS  84          1HG       LYS  84   2.130  13.150   7.733
  637   2HG   LYS  84          2HG       LYS  84   0.833  14.284   7.358
  638   1HD   LYS  84          1HD       LYS  84   1.540  13.113  10.094
  639   2HD   LYS  84          2HD       LYS  84   1.875  14.756   9.546
  640   1HE   LYS  84          2HE       LYS  84  -0.881  13.535  10.065
  641   2HE   LYS  84          1HE       LYS  84  -0.061  14.766  11.027
  642   1HZ   LYS  84          1HZ       LYS  84  -0.171  16.235   9.140
  643   2HZ   LYS  84          2HZ       LYS  84  -0.969  15.094   8.256
  644   3HZ   LYS  84          3HZ       LYS  84  -1.674  15.737   9.597
  645    H    LYS  85           HN       LYS  85   0.866   9.552   7.584
  646    HA   LYS  85           HA       LYS  85  -0.727   7.677   6.065
  647   1HB   LYS  85          2HB       LYS  85   1.592   7.308   7.080
  648   2HB   LYS  85          1HB       LYS  85   0.796   7.265   8.662
  649   1HG   LYS  85          1HG       LYS  85  -0.598   5.310   7.805
  650   2HG   LYS  85          2HG       LYS  85   0.273   5.446   6.271
  651   1HD   LYS  85          2HD       LYS  85   1.262   3.670   7.498
  652   2HD   LYS  85          1HD       LYS  85   2.424   5.004   7.478
  653   1HE   LYS  85          2HE       LYS  85   1.768   5.597   9.809
  654   2HE   LYS  85          1HE       LYS  85   0.528   4.329   9.791
  655   1HZ   LYS  85          1HZ       LYS  85   2.516   3.629  10.884
  656   2HZ   LYS  85          2HZ       LYS  85   3.425   3.917   9.541
  657   3HZ   LYS  85          3HZ       LYS  85   2.284   2.727   9.524
  658    H    CYS  86           H        CYS  86  -2.554   6.606   6.808
  659    HA   CYS  86           HA       CYS  86  -4.110   7.877   9.002
  660   1HB   CYS  86          2HB       CYS  86  -5.231   7.492   6.826
  661   2HB   CYS  86          1HB       CYS  86  -4.856   5.772   6.921
  662    HG   CYS  86           HG       CYS  86  -6.517   7.520   9.166
  663    H    GLU  87           HN       GLU  87  -3.430   4.584   7.834
  664    HA   GLU  87           HA       GLU  87  -2.653   3.564  10.452
  665   1HB   GLU  87          1HB       GLU  87  -5.139   2.611   8.968
  666   2HB   GLU  87          2HB       GLU  87  -4.406   1.722  10.313
  667   1HG   GLU  87          1HG       GLU  87  -5.727   4.448  10.489
  668   2HG   GLU  87          2HG       GLU  87  -6.378   2.916  11.044
  669    H    THR  88           H        THR  88  -2.544   0.881   9.935
  670    HA   THR  88           HA       THR  88  -1.657   0.390   7.242
  671    HB   THR  88           HB       THR  88   0.323   1.516   8.209
  672    HG1  THR  88           HG1      THR  88   0.564  -0.402   6.858
  673   1HG2  THR  88          1HG2      THR  88   1.569   0.526  10.097
  674   2HG2  THR  88          2HG2      THR  88  -0.043   1.042  10.618
  675   3HG2  THR  88          3HG2      THR  88   0.296  -0.680  10.336
  676    H    ILE  89           H        ILE  89  -0.877  -1.956   7.081
  677    HA   ILE  89           HA       ILE  89  -1.969  -3.752   9.177
  678    HB   ILE  89           HB       ILE  89  -2.440  -4.267   6.210
  679   1HG1  ILE  89          2HG1      ILE  89  -4.454  -3.067   8.153
  680   2HG1  ILE  89          1HG1      ILE  89  -3.707  -2.222   6.783
  681   1HG2  ILE  89          1HG2      ILE  89  -3.712  -5.426   8.730
  682   2HG2  ILE  89          2HG2      ILE  89  -3.944  -5.997   7.065
  683   3HG2  ILE  89          3HG2      ILE  89  -2.373  -6.178   7.838
  684   1HD1  ILE  89          1HD1      ILE  89  -4.662  -3.897   5.217
  685   2HD1  ILE  89          2HD1      ILE  89  -5.860  -2.903   6.065
  686   3HD1  ILE  89          3HD1      ILE  89  -5.594  -4.580   6.570
  687    H    ILE  90           H        ILE  90  -0.255  -5.073   9.700
  688    HA   ILE  90           HA       ILE  90   2.014  -5.353   7.774
  689    HB   ILE  90           HB       ILE  90   1.928  -5.539  10.816
  690   1HG1  ILE  90          1HG1      ILE  90   3.019  -3.388   8.942
  691   2HG1  ILE  90          2HG1      ILE  90   1.625  -3.229  10.014
  692   1HG2  ILE  90          1HG2      ILE  90   4.398  -5.681  10.653
  693   2HG2  ILE  90          2HG2      ILE  90   4.292  -5.669   8.881
  694   3HG2  ILE  90          3HG2      ILE  90   3.655  -7.030   9.824
  695   1HD1  ILE  90          1HD1      ILE  90   3.417  -2.113  11.074
  696   2HD1  ILE  90          2HD1      ILE  90   3.154  -3.617  11.980
  697   3HD1  ILE  90          3HD1      ILE  90   4.528  -3.468  10.852
  698    H    GLY  91           H        GLY  91   2.661  -7.366   7.182
  699   1HA   GLY  91          1HA       GLY  91   2.980  -9.672   7.429
  700   2HA   GLY  91          2HA       GLY  91   1.688  -9.773   8.634
  701    H    ALA  92           H        ALA  92   1.808 -11.599   6.567
  702    HA   ALA  92           HA       ALA  92   0.345 -10.942   4.222
  703   1HB   ALA  92          1HB       ALA  92   0.127 -13.389   3.997
  704   2HB   ALA  92          2HB       ALA  92   1.770 -12.962   4.527
  705   3HB   ALA  92          3HB       ALA  92   0.597 -13.605   5.695
  706    H    VAL  93           H        VAL  93  -1.869 -11.112   3.703
  707    HA   VAL  93           HA       VAL  93  -3.750 -11.999   5.732
  708    HB   VAL  93           HB       VAL  93  -4.859  -9.648   4.552
  709   1HG1  VAL  93          1HG1      VAL  93  -2.350  -8.941   6.123
  710   2HG1  VAL  93          2HG1      VAL  93  -2.520  -8.730   4.360
  711   3HG1  VAL  93          3HG1      VAL  93  -3.550  -7.820   5.470
  712   1HG2  VAL  93          1HG2      VAL  93  -4.210 -10.074   7.430
  713   2HG2  VAL  93          2HG2      VAL  93  -5.653 -10.657   6.563
  714   3HG2  VAL  93          3HG2      VAL  93  -5.363  -8.916   6.705
  715    HA   PRO  94           HA       PRO  94  -5.770 -12.844   1.723
  716   1HB   PRO  94          1HB       PRO  94  -8.383 -13.088   3.050
  717   2HB   PRO  94          2HB       PRO  94  -7.422 -14.359   2.254
  718   1HG   PRO  94          2HG       PRO  94  -7.798 -14.271   5.012
  719   2HG   PRO  94          1HG       PRO  94  -6.274 -14.859   4.277
  720   1HD   PRO  94          1HD       PRO  94  -6.896 -12.055   5.242
  721   2HD   PRO  94          2HD       PRO  94  -5.513 -13.057   5.708
  722    H    LYS  95           HN       LYS  95  -6.976 -11.423   0.300
  723    HA   LYS  95           HA       LYS  95  -7.098  -8.773   1.149
  724   1HB   LYS  95          1HB       LYS  95  -8.650  -8.405  -0.837
  725   2HB   LYS  95          2HB       LYS  95  -7.098  -9.145  -1.238
  726   1HG   LYS  95          1HG       LYS  95  -8.126 -11.218  -1.733
  727   2HG   LYS  95          2HG       LYS  95  -9.581 -10.890  -0.805
  728   1HD   LYS  95          2HD       LYS  95  -8.932  -9.184  -3.217
  729   2HD   LYS  95          1HD       LYS  95  -9.766 -10.738  -3.372
  730   1HE   LYS  95          2HE       LYS  95 -11.596 -10.013  -1.991
  731   2HE   LYS  95          1HE       LYS  95 -10.775  -8.506  -1.550
  732   1HZ   LYS  95          1HZ       LYS  95 -11.507  -9.202  -4.301
  733   2HZ   LYS  95          2HZ       LYS  95 -10.935  -7.761  -3.751
  734   3HZ   LYS  95          3HZ       LYS  95 -12.428  -8.267  -3.297
  735    H    ALA  96           H        ALA  96  -9.552 -11.171   1.236
  736    HA   ALA  96           HA       ALA  96 -11.921  -9.824   1.785
  737   1HB   ALA  96          1HB       ALA  96 -12.537 -11.705   3.270
  738   2HB   ALA  96          2HB       ALA  96 -10.838 -12.217   3.348
  739   3HB   ALA  96          3HB       ALA  96 -11.723 -12.290   1.806
  740    H    THR  97           H        THR  97  -9.170 -10.292   4.065
  741    HA   THR  97           HA       THR  97 -10.492  -8.878   6.243
  742    HB   THR  97           HB       THR  97  -7.569  -9.599   5.839
  743    HG1  THR  97           HG1      THR  97  -9.716 -11.103   6.933
  744   1HG2  THR  97          1HG2      THR  97  -7.566  -9.707   8.334
  745   2HG2  THR  97          2HG2      THR  97  -7.958  -8.079   7.756
  746   3HG2  THR  97          3HG2      THR  97  -9.248  -9.141   8.359
  747    H    ILE  98           H        ILE  98  -8.029  -8.148   3.737
  748    HA   ILE  98           HA       ILE  98  -7.235  -5.573   4.675
  749    HB   ILE  98           HB       ILE  98  -7.343  -6.635   1.812
  750   1HG1  ILE  98          2HG1      ILE  98  -5.134  -6.646   3.925
  751   2HG1  ILE  98          1HG1      ILE  98  -6.000  -8.058   3.307
  752   1HG2  ILE  98          1HG2      ILE  98  -5.754  -4.318   3.000
  753   2HG2  ILE  98          2HG2      ILE  98  -7.143  -4.151   1.909
  754   3HG2  ILE  98          3HG2      ILE  98  -5.670  -4.896   1.323
  755   1HD1  ILE  98          1HD1      ILE  98  -3.902  -8.050   2.223
  756   2HD1  ILE  98          2HD1      ILE  98  -5.077  -7.524   1.002
  757   3HD1  ILE  98          3HD1      ILE  98  -4.013  -6.339   1.797
  758    H    VAL  99           H        VAL  99  -9.875  -6.505   2.421
  759    HA   VAL  99           HA       VAL  99 -10.774  -3.891   1.832
  760    HB   VAL  99           HB       VAL  99 -12.217  -6.572   1.947
  761   1HG1  VAL  99          1HG1      VAL  99 -13.189  -3.870   0.937
  762   2HG1  VAL  99          2HG1      VAL  99 -13.934  -5.418   0.482
  763   3HG1  VAL  99          3HG1      VAL  99 -13.958  -4.896   2.168
  764   1HG2  VAL  99          1HG2      VAL  99 -10.395  -6.328   0.237
  765   2HG2  VAL  99          2HG2      VAL  99 -11.190  -4.868  -0.375
  766   3HG2  VAL  99          3HG2      VAL  99 -11.996  -6.443  -0.507
  767    H    GLN 100           H        GLN 100 -11.980  -6.167   4.367
  768    HA   GLN 100           HA       GLN 100 -13.826  -4.361   5.548
  769   1HB   GLN 100          2HB       GLN 100 -12.217  -6.688   6.688
  770   2HB   GLN 100          1HB       GLN 100 -13.472  -5.833   7.602
  771   1HG   GLN 100          2HG       GLN 100 -15.173  -6.407   6.004
  772   2HG   GLN 100          1HG       GLN 100 -14.004  -7.113   4.883
  773   1HE2  GLN 100          1HE2      GLN 100 -12.927  -9.096   5.454
  774   2HE2  GLN 100          2HE2      GLN 100 -13.654 -10.181   6.646
  775    H    THR 101           H        THR 101 -10.378  -4.928   6.263
  776    HA   THR 101           HA       THR 101 -10.255  -3.142   8.490
  777    HB   THR 101           HB       THR 101  -8.014  -4.100   6.672
  778    HG1  THR 101           HG1      THR 101  -9.159  -5.828   7.520
  779   1HG2  THR 101          1HG2      THR 101  -6.668  -3.859   8.787
  780   2HG2  THR 101          2HG2      THR 101  -7.270  -2.313   8.157
  781   3HG2  THR 101          3HG2      THR 101  -8.062  -3.076   9.554
  782    H    VAL 102           H        VAL 102  -9.533  -2.586   4.967
  783    HA   VAL 102           HA       VAL 102  -8.567   0.073   5.478
  784    HB   VAL 102           HB       VAL 102  -8.197  -1.426   3.432
  785   1HG1  VAL 102          1HG2      VAL 102  -7.853   0.651   2.014
  786   2HG1  VAL 102          2HG2      VAL 102  -8.785   1.561   3.211
  787   3HG1  VAL 102          3HG2      VAL 102  -7.244   0.805   3.667
  788   1HG2  VAL 102          1HG1      VAL 102  -9.484  -0.987   1.439
  789   2HG2  VAL 102          2HG1      VAL 102 -10.684  -0.063   2.362
  790   3HG2  VAL 102          3HG1      VAL 102 -10.447  -1.801   2.656
  791    H    GLU 103           HN       GLU 103 -11.692  -1.286   4.513
  792    HA   GLU 103           HA       GLU 103 -13.158   1.137   4.381
  793   1HB   GLU 103          1HB       GLU 103 -13.955  -1.691   5.169
  794   2HB   GLU 103          2HB       GLU 103 -15.112  -0.363   5.033
  795   1HG   GLU 103          2HG       GLU 103 -14.578   0.024   2.711
  796   2HG   GLU 103          1HG       GLU 103 -13.286  -1.181   2.736
  797    H    LYS 104           HN       LYS 104 -12.584  -0.994   7.181
  798    HA   LYS 104           HA       LYS 104 -13.889   0.500   9.184
  799   1HB   LYS 104          1HB       LYS 104 -13.009  -1.707   9.622
  800   2HB   LYS 104          2HB       LYS 104 -11.384  -1.200   9.196
  801   1HG   LYS 104          1HG       LYS 104 -11.553   0.421  11.260
  802   2HG   LYS 104          2HG       LYS 104 -12.880  -0.638  11.744
  803   1HD   LYS 104          2HD       LYS 104 -10.012  -1.462  11.027
  804   2HD   LYS 104          1HD       LYS 104 -10.625  -1.249  12.670
  805   1HE   LYS 104          2HE       LYS 104 -12.275  -3.085  12.301
  806   2HE   LYS 104          1HE       LYS 104 -11.647  -3.321  10.659
  807   1HZ   LYS 104          1HZ       LYS 104  -9.530  -3.860  11.595
  808   2HZ   LYS 104          2HZ       LYS 104 -10.101  -3.646  13.127
  809   3HZ   LYS 104          3HZ       LYS 104 -10.698  -4.859  12.185
  810    H    TYR 105           H        TYR 105 -10.455   0.758   8.092
  811    HA   TYR 105           HA       TYR 105  -9.792   2.941   9.819
  812   1HB   TYR 105          2HB       TYR 105  -8.648   2.076   7.155
  813   2HB   TYR 105          1HB       TYR 105  -7.868   3.217   8.251
  814    HD1  TYR 105           HD1      TYR 105  -8.851   1.121  10.709
  815    HD2  TYR 105           HD2      TYR 105  -6.460   0.937   7.120
  816    HE1  TYR 105           HE1      TYR 105  -7.331  -0.489  11.792
  817    HE2  TYR 105           HE2      TYR 105  -4.881  -0.581   8.254
  818    HH   TYR 105           HH       TYR 105  -4.239  -1.495  10.319
  819    H    LEU 106           H        LEU 106 -11.051   2.911   6.476
  820    HA   LEU 106           HA       LEU 106 -11.229   5.901   6.488
  821   1HB   LEU 106          2HB       LEU 106 -11.254   3.876   4.214
  822   2HB   LEU 106          1HB       LEU 106 -11.453   5.628   4.032
  823    HG   LEU 106           HG       LEU 106  -8.973   4.192   5.082
  824   1HD1  LEU 106          1HD2      LEU 106  -7.877   6.430   4.747
  825   2HD1  LEU 106          2HD2      LEU 106  -9.478   7.142   4.463
  826   3HD1  LEU 106          3HD2      LEU 106  -9.072   6.443   6.048
  827   1HD2  LEU 106          1HD1      LEU 106  -9.556   5.548   2.410
  828   2HD2  LEU 106          2HD1      LEU 106  -8.015   4.805   2.889
  829   3HD2  LEU 106          3HD1      LEU 106  -9.462   3.802   2.691
  830    H    ASN 107           H        ASN 107 -13.181   3.914   4.319
  831    HA   ASN 107           HA       ASN 107 -15.519   3.704   5.845
  832   1HB   ASN 107          1HB       ASN 107 -15.418   6.251   5.266
  833   2HB   ASN 107          2HB       ASN 107 -15.616   5.754   3.583
  834   1HD2  ASN 107          2HD2      ASN 107 -17.532   3.582   4.032
  835   2HD2  ASN 107          1HD2      ASN 107 -19.023   4.357   4.588
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1   0.577  -3.239 -11.316
    2   2H    MET   1          2H        MET   1  -0.949  -3.280 -10.662
    3   3H    MET   1          3H        MET   1  -0.169  -1.853 -10.770
    4    HA   MET   1           HA       MET   1  -0.179  -1.967 -13.156
    5   1HB   MET   1          2HB       MET   1  -0.329  -4.401 -13.393
    6   2HB   MET   1          1HB       MET   1  -1.902  -4.446 -12.599
    7   1HG   MET   1          2HG       MET   1  -2.052  -4.630 -15.073
    8   2HG   MET   1          1HG       MET   1  -2.945  -3.255 -14.440
    9   1HE   MET   1          1HE       MET   1   0.950  -3.726 -15.323
   10   2HE   MET   1          2HE       MET   1  -0.014  -4.516 -16.599
   11   3HE   MET   1          3HE       MET   1   0.903  -3.036 -16.960
   12    H    GLU   2           HN       GLU   2  -3.188  -3.127 -11.560
   13    HA   GLU   2           HA       GLU   2  -4.686  -0.712 -12.266
   14   1HB   GLU   2          1HB       GLU   2  -5.219  -3.012 -10.354
   15   2HB   GLU   2          2HB       GLU   2  -6.397  -1.756 -10.756
   16   1HG   GLU   2          2HG       GLU   2  -6.392  -2.480 -13.113
   17   2HG   GLU   2          1HG       GLU   2  -5.164  -3.707 -12.765
   18    H    ALA   3           H        ALA   3  -3.085  -2.200  -9.485
   19    HA   ALA   3           HA       ALA   3  -3.240   0.171  -7.767
   20   1HB   ALA   3          1HB       ALA   3  -1.674  -1.125  -6.359
   21   2HB   ALA   3          2HB       ALA   3  -3.048  -2.151  -6.830
   22   3HB   ALA   3          3HB       ALA   3  -1.492  -2.329  -7.655
   23    H    GLY   4           H        GLY   4  -1.598   1.787  -7.745
   24   1HA   GLY   4          2HA       GLY   4   0.091   1.945 -10.107
   25   2HA   GLY   4          1HA       GLY   4   0.111   3.046  -8.725
   26    H    ALA   5           H        ALA   5   2.513   2.362  -9.881
   27    HA   ALA   5           HA       ALA   5   3.805   0.487  -7.934
   28   1HB   ALA   5          1HB       ALA   5   5.587   0.261  -9.610
   29   2HB   ALA   5          2HB       ALA   5   4.033  -0.316 -10.247
   30   3HB   ALA   5          3HB       ALA   5   4.669   1.268 -10.749
   31    H    VAL   6           H        VAL   6   5.139   1.597  -6.503
   32    HA   VAL   6           HA       VAL   6   6.035   4.338  -7.292
   33    HB   VAL   6           HB       VAL   6   5.686   4.949  -4.819
   34   1HG1  VAL   6          1HG1      VAL   6   5.152   2.693  -3.989
   35   2HG1  VAL   6          2HG1      VAL   6   3.873   3.860  -3.630
   36   3HG1  VAL   6          3HG1      VAL   6   3.657   2.676  -4.933
   37   1HG2  VAL   6          1HG2      VAL   6   3.332   4.633  -6.696
   38   2HG2  VAL   6          2HG2      VAL   6   4.450   6.003  -6.584
   39   3HG2  VAL   6          3HG2      VAL   6   3.370   5.646  -5.228
   40    H    ASN   7           H        ASN   7   7.690   5.190  -5.947
   41    HA   ASN   7           HA       ASN   7   9.529   3.329  -4.649
   42   1HB   ASN   7          1HB       ASN   7  10.064   4.790  -7.290
   43   2HB   ASN   7          2HB       ASN   7  11.394   4.352  -6.227
   44   1HD2  ASN   7          1HD2      ASN   7  11.350   1.999  -5.413
   45   2HD2  ASN   7          2HD2      ASN   7  11.046   0.810  -6.691
   46    H    ASP   8           HN       ASP   8  11.527   4.837  -4.095
   47    HA   ASP   8           HA       ASP   8  10.932   6.581  -2.134
   48   1HB   ASP   8          2HB       ASP   8  13.218   5.852  -2.772
   49   2HB   ASP   8          1HB       ASP   8  13.214   6.943  -4.148
   50    H    ASP   9           HN       ASP   9  11.689   7.779  -5.362
   51    HA   ASP   9           HA       ASP   9  10.988  10.486  -4.920
   52   1HB   ASP   9          2HB       ASP   9  12.339   9.773  -6.819
   53   2HB   ASP   9          1HB       ASP   9  11.013   8.848  -7.506
   54    H    THR  10           H        THR  10   9.127   8.186  -6.920
   55    HA   THR  10           HA       THR  10   6.896   9.808  -7.318
   56    HB   THR  10           HB       THR  10   5.761   7.547  -7.818
   57    HG1  THR  10           HG1      THR  10   7.447   5.879  -7.997
   58   1HG2  THR  10          1HG2      THR  10   7.151   7.198  -9.828
   59   2HG2  THR  10          2HG2      THR  10   6.895   8.925  -9.531
   60   3HG2  THR  10          3HG2      THR  10   8.452   8.180  -9.122
   61    H    PHE  11           H        PHE  11   7.489   7.552  -4.645
   62    HA   PHE  11           HA       PHE  11   5.070   7.378  -3.347
   63   1HB   PHE  11          2HB       PHE  11   7.229   6.407  -2.624
   64   2HB   PHE  11          1HB       PHE  11   7.798   7.972  -2.119
   65    HD1  PHE  11           HD1      PHE  11   7.276   8.861   0.040
   66    HD2  PHE  11           HD2      PHE  11   5.229   5.351  -1.406
   67    HE1  PHE  11           HE1      PHE  11   6.334   8.481   2.288
   68    HE2  PHE  11           HE2      PHE  11   4.292   4.970   0.858
   69    HZ   PHE  11           HZ       PHE  11   4.800   6.554   2.700
   70    H    LYS  12           HN       LYS  12   7.395   9.994  -3.182
   71    HA   LYS  12           HA       LYS  12   6.208  11.673  -1.236
   72   1HB   LYS  12          2HB       LYS  12   7.688  12.533  -3.757
   73   2HB   LYS  12          1HB       LYS  12   7.390  13.542  -2.350
   74   1HG   LYS  12          1HG       LYS  12   8.795  12.163  -0.932
   75   2HG   LYS  12          2HG       LYS  12   8.936  10.916  -2.179
   76   1HD   LYS  12          1HD       LYS  12  10.072  12.530  -3.685
   77   2HD   LYS  12          2HD       LYS  12  10.069  13.730  -2.374
   78   1HE   LYS  12          1HE       LYS  12  11.412  12.190  -0.959
   79   2HE   LYS  12          2HE       LYS  12  11.329  10.940  -2.212
   80   1HZ   LYS  12          1HZ       LYS  12  13.380  12.081  -2.298
   81   2HZ   LYS  12          2HZ       LYS  12  12.641  13.543  -2.503
   82   3HZ   LYS  12          3HZ       LYS  12  12.525  12.384  -3.672
   83    H    ASN  13           H        ASN  13   5.664  11.660  -4.791
   84    HA   ASN  13           HA       ASN  13   3.655  13.746  -4.666
   85   1HB   ASN  13          1HB       ASN  13   4.343  11.803  -6.901
   86   2HB   ASN  13          2HB       ASN  13   3.395  13.283  -7.032
   87   1HD2  ASN  13          2HD2      ASN  13   4.921  15.217  -5.618
   88   2HD2  ASN  13          1HD2      ASN  13   6.471  15.323  -6.427
   89    H    VAL  14           H        VAL  14   3.587  10.285  -5.433
   90    HA   VAL  14           HA       VAL  14   0.746  10.102  -5.779
   91    HB   VAL  14           HB       VAL  14   3.001   8.063  -5.408
   92   1HG1  VAL  14          1HG1      VAL  14   2.853   7.827  -7.871
   93   2HG1  VAL  14          2HG1      VAL  14   3.242   9.492  -7.436
   94   3HG1  VAL  14          3HG1      VAL  14   1.588   9.071  -7.919
   95   1HG2  VAL  14          1HG2      VAL  14   0.997   6.846  -4.918
   96   2HG2  VAL  14          2HG2      VAL  14   0.135   7.612  -6.278
   97   3HG2  VAL  14          3HG2      VAL  14   1.453   6.463  -6.584
   98    H    VAL  15           H        VAL  15   2.715   9.848  -2.883
   99    HA   VAL  15           HA       VAL  15   0.305   8.869  -1.411
  100    HB   VAL  15           HB       VAL  15   3.198   8.451  -0.580
  101   1HG1  VAL  15          1HG1      VAL  15   0.591   7.145   0.276
  102   2HG1  VAL  15          2HG1      VAL  15   2.219   6.783   0.880
  103   3HG1  VAL  15          3HG1      VAL  15   1.495   8.364   1.197
  104   1HG2  VAL  15          1HG2      VAL  15   1.388   6.612  -2.187
  105   2HG2  VAL  15          2HG2      VAL  15   2.904   6.132  -1.400
  106   3HG2  VAL  15          3HG2      VAL  15   2.932   7.299  -2.712
  107    H    LEU  16           H        LEU  16   3.373  10.531  -0.469
  108    HA   LEU  16           HA       LEU  16   2.198  11.740   1.781
  109   1HB   LEU  16          1HB       LEU  16   4.545  12.795   0.150
  110   2HB   LEU  16          2HB       LEU  16   4.100  13.296   1.771
  111    HG   LEU  16           HG       LEU  16   5.023  10.508   0.935
  112   1HD1  LEU  16          1HD1      LEU  16   6.785  12.264   1.021
  113   2HD1  LEU  16          2HD1      LEU  16   6.321  12.632   2.694
  114   3HD1  LEU  16          3HD1      LEU  16   7.001  11.042   2.286
  115   1HD2  LEU  16          1HD2      LEU  16   5.094  10.119   3.454
  116   2HD2  LEU  16          2HD2      LEU  16   3.470  10.174   2.764
  117   3HD2  LEU  16          3HD2      LEU  16   4.114  11.582   3.644
  118    H    GLU  17           HN       GLU  17   2.618  13.238  -1.441
  119    HA   GLU  17           HA       GLU  17   1.054  15.604  -0.638
  120   1HB   GLU  17          2HB       GLU  17   2.319  14.725  -3.238
  121   2HB   GLU  17          1HB       GLU  17   1.702  16.338  -2.920
  122   1HG   GLU  17          1HG       GLU  17   3.460  16.889  -1.441
  123   2HG   GLU  17          2HG       GLU  17   3.919  15.209  -1.169
  124    H    SER  18           H        SER  18  -0.174  12.669  -1.143
  125    HA   SER  18           HA       SER  18  -1.771  13.143  -3.547
  126   1HB   SER  18          1HB       SER  18  -0.678  11.010  -2.608
  127   2HB   SER  18          2HB       SER  18  -2.135  10.818  -1.645
  128    HG   SER  18           HG       SER  18  -1.878   9.885  -3.890
  129    H    SER  19           H        SER  19  -4.054  13.268  -3.646
  130    HA   SER  19           HA       SER  19  -5.245  14.916  -1.574
  131   1HB   SER  19          1HB       SER  19  -7.115  14.853  -3.354
  132   2HB   SER  19          2HB       SER  19  -5.556  15.551  -3.843
  133    HG   SER  19           HG       SER  19  -6.291  14.024  -5.392
  134    H    VAL  20           H        VAL  20  -6.307  11.985  -3.298
  135    HA   VAL  20           HA       VAL  20  -8.349  11.401  -1.300
  136    HB   VAL  20           HB       VAL  20  -8.370   9.110  -2.587
  137   1HG1  VAL  20          1HG1      VAL  20  -6.126   9.454  -3.673
  138   2HG1  VAL  20          2HG1      VAL  20  -7.455   9.009  -4.759
  139   3HG1  VAL  20          3HG1      VAL  20  -6.888  10.685  -4.711
  140   1HG2  VAL  20          1HG2      VAL  20 -10.148  10.685  -2.842
  141   2HG2  VAL  20          2HG2      VAL  20  -9.707   9.988  -4.406
  142   3HG2  VAL  20          3HG2      VAL  20  -9.191  11.642  -4.009
  143    HA   PRO  21           HA       PRO  21  -6.067   8.692   1.413
  144   1HB   PRO  21          1HB       PRO  21  -8.223   6.662   0.747
  145   2HB   PRO  21          2HB       PRO  21  -7.554   7.022   2.357
  146   1HG   PRO  21          1HG       PRO  21  -9.887   8.008   1.620
  147   2HG   PRO  21          2HG       PRO  21  -8.739   9.085   2.474
  148   1HD   PRO  21          1HD       PRO  21  -9.434   9.063  -0.467
  149   2HD   PRO  21          2HD       PRO  21  -9.013  10.423   0.600
  150    H    VAL  22           H        VAL  22  -4.924   6.610   1.380
  151    HA   VAL  22           HA       VAL  22  -4.419   5.555  -1.342
  152    HB   VAL  22           HB       VAL  22  -2.154   6.428   0.468
  153   1HG1  VAL  22          1HG2      VAL  22  -1.708   4.861  -1.346
  154   2HG1  VAL  22          2HG2      VAL  22  -2.242   6.099  -2.504
  155   3HG1  VAL  22          3HG2      VAL  22  -0.844   6.408  -1.478
  156   1HG2  VAL  22          1HG1      VAL  22  -1.895   8.482  -0.915
  157   2HG2  VAL  22          2HG1      VAL  22  -3.465   8.167  -1.671
  158   3HG2  VAL  22          3HG1      VAL  22  -3.353   8.548   0.064
  159    H    LEU  23           H        LEU  23  -3.499   3.500  -1.350
  160    HA   LEU  23           HA       LEU  23  -2.998   2.170   1.301
  161   1HB   LEU  23          1HB       LEU  23  -5.200   1.530   0.564
  162   2HB   LEU  23          2HB       LEU  23  -4.603   0.917  -0.974
  163    HG   LEU  23           HG       LEU  23  -3.319  -0.132   1.544
  164   1HD1  LEU  23          1HD1      LEU  23  -2.595  -1.124  -0.603
  165   2HD1  LEU  23          2HD1      LEU  23  -3.532  -2.325   0.282
  166   3HD1  LEU  23          3HD1      LEU  23  -4.291  -1.446  -1.043
  167   1HD2  LEU  23          1HD2      LEU  23  -6.060  -1.128   0.707
  168   2HD2  LEU  23          2HD2      LEU  23  -5.757  -0.062   2.102
  169   3HD2  LEU  23          3HD2      LEU  23  -5.071  -1.691   2.060
  170    H    VAL  24           H        VAL  24  -0.798   2.093   1.184
  171    HA   VAL  24           HA       VAL  24   0.499   1.339  -1.403
  172    HB   VAL  24           HB       VAL  24   1.741   2.432   1.138
  173   1HG1  VAL  24          1HG1      VAL  24   2.867   2.009  -1.661
  174   2HG1  VAL  24          2HG1      VAL  24   3.329   1.116  -0.197
  175   3HG1  VAL  24          3HG1      VAL  24   3.700   2.837  -0.329
  176   1HG2  VAL  24          1HG2      VAL  24   0.246   4.126   0.007
  177   2HG2  VAL  24          2HG2      VAL  24   1.195   3.893  -1.478
  178   3HG2  VAL  24          3HG2      VAL  24   1.960   4.545  -0.017
  179    H    ASP  25           HN       ASP  25   1.023  -0.800  -1.607
  180    HA   ASP  25           HA       ASP  25   1.429  -2.461   0.843
  181   1HB   ASP  25          2HB       ASP  25  -0.099  -3.457  -0.725
  182   2HB   ASP  25          1HB       ASP  25   1.022  -3.179  -2.062
  183    H    PHE  26           H        PHE  26   3.507  -2.485   1.553
  184    HA   PHE  26           HA       PHE  26   5.727  -1.760  -0.263
  185   1HB   PHE  26          2HB       PHE  26   5.576  -2.546   2.663
  186   2HB   PHE  26          1HB       PHE  26   7.080  -2.292   1.790
  187    HD1  PHE  26           HD1      PHE  26   3.779  -0.457   2.345
  188    HD2  PHE  26           HD2      PHE  26   8.060  -0.171   1.851
  189    HE1  PHE  26           HE1      PHE  26   3.686   1.946   2.833
  190    HE2  PHE  26           HE2      PHE  26   7.966   2.199   2.557
  191    HZ   PHE  26           HZ       PHE  26   5.762   3.205   3.244
  192    H    TRP  27           H        TRP  27   6.443  -3.311  -1.635
  193    HA   TRP  27           HA       TRP  27   6.262  -6.179  -0.807
  194   1HB   TRP  27          2HB       TRP  27   5.411  -6.793  -2.925
  195   2HB   TRP  27          1HB       TRP  27   4.407  -5.470  -2.379
  196    HD1  TRP  27           HD1      TRP  27   5.225  -2.994  -3.464
  197    HE1  TRP  27           HE1      TRP  27   6.351  -2.394  -5.722
  198    HE3  TRP  27           HE3      TRP  27   6.433  -7.711  -5.045
  199    HZ2  TRP  27           HZ2      TRP  27   7.840  -3.794  -7.759
  200    HZ3  TRP  27           HZ3      TRP  27   7.501  -8.033  -7.238
  201    HH2  TRP  27           HH2      TRP  27   8.246  -6.093  -8.587
  202    H    ALA  28           H        ALA  28   7.401  -7.379  -2.870
  203    HA   ALA  28           HA       ALA  28   9.567  -6.062  -4.122
  204   1HB   ALA  28          1HB       ALA  28  10.672  -6.217  -1.879
  205   2HB   ALA  28          2HB       ALA  28  11.461  -7.271  -3.062
  206   3HB   ALA  28          3HB       ALA  28  10.356  -7.970  -1.869
  207    HA   PRO  29           HA       PRO  29   8.823  -9.664  -6.630
  208   1HB   PRO  29          1HB       PRO  29  11.310 -10.188  -7.729
  209   2HB   PRO  29          2HB       PRO  29  10.155  -8.921  -8.267
  210   1HG   PRO  29          1HG       PRO  29  12.512  -8.582  -6.376
  211   2HG   PRO  29          2HG       PRO  29  12.100  -7.580  -7.802
  212   1HD   PRO  29          2HD       PRO  29  11.318  -6.705  -5.395
  213   2HD   PRO  29          1HD       PRO  29  10.142  -6.722  -6.708
  214    H    TRP  30           H        TRP  30  11.535  -9.902  -4.297
  215    HA   TRP  30           HA       TRP  30  11.420 -12.840  -4.339
  216   1HB   TRP  30          2HB       TRP  30  12.949 -12.572  -2.361
  217   2HB   TRP  30          1HB       TRP  30  13.516 -11.933  -3.894
  218    HD1  TRP  30           HD1      TRP  30  14.438  -9.588  -3.901
  219    HE1  TRP  30           HE1      TRP  30  14.581  -7.619  -2.253
  220    HE3  TRP  30           HE3      TRP  30  11.420 -11.421  -0.180
  221    HZ2  TRP  30           HZ2      TRP  30  13.389  -6.870   0.256
  222    HZ3  TRP  30           HZ3      TRP  30  10.912 -10.037   1.798
  223    HH2  TRP  30           HH2      TRP  30  11.778  -7.726   1.976
  224    H    CYS  31           H        CYS  31   9.289 -10.503  -3.105
  225    HA   CYS  31           HA       CYS  31   8.876 -11.755  -0.481
  226   1HB   CYS  31          1HB       CYS  31   8.656  -9.315  -0.803
  227   2HB   CYS  31          2HB       CYS  31   7.310  -9.600  -1.892
  228    H    GLY  32           H        GLY  32   8.384 -13.911  -1.298
  229   1HA   GLY  32          1HA       GLY  32   6.282 -14.870  -2.753
  230   2HA   GLY  32          2HA       GLY  32   6.726 -15.561  -1.185
  231    HA   PRO  33           HA       PRO  33   2.899 -14.258   0.550
  232   1HB   PRO  33          1HB       PRO  33   3.319 -12.404   2.596
  233   2HB   PRO  33          2HB       PRO  33   3.525 -14.171   2.720
  234   1HG   PRO  33          2HG       PRO  33   5.642 -12.080   2.216
  235   2HG   PRO  33          1HG       PRO  33   5.692 -13.473   3.327
  236   1HD   PRO  33          1HD       PRO  33   6.880 -13.539   0.896
  237   2HD   PRO  33          2HD       PRO  33   6.031 -14.987   1.494
  238    H    CYS  34           H        CYS  34   4.846 -11.620  -0.784
  239    HA   CYS  34           HA       CYS  34   2.624  -9.721  -0.817
  240   1HB   CYS  34          1HB       CYS  34   5.133  -9.562  -2.408
  241   2HB   CYS  34          2HB       CYS  34   3.935  -8.359  -2.055
  242    H    ARG  35           HN       ARG  35   4.526 -11.821  -3.099
  243    HA   ARG  35           HA       ARG  35   3.349 -11.247  -5.528
  244   1HB   ARG  35          2HB       ARG  35   4.112 -13.987  -4.417
  245   2HB   ARG  35          1HB       ARG  35   3.750 -13.629  -6.098
  246   1HG   ARG  35          1HG       ARG  35   5.695 -12.121  -6.243
  247   2HG   ARG  35          2HG       ARG  35   6.098 -12.488  -4.554
  248   1HD   ARG  35          1HD       ARG  35   6.152 -14.940  -5.154
  249   2HD   ARG  35          2HD       ARG  35   5.922 -14.483  -6.858
  250    HE   ARG  35           HE       ARG  35   8.122 -13.015  -5.894
  251   1HH1  ARG  35          1HH1      ARG  35   7.300 -16.411  -6.440
  252   2HH1  ARG  35          2HH1      ARG  35   8.953 -16.903  -6.700
  253   1HH2  ARG  35          2HH2      ARG  35  10.181 -13.593  -6.237
  254   2HH2  ARG  35          1HH2      ARG  35  10.677 -15.244  -6.585
  255    H    ILE  36           H        ILE  36   2.208 -13.652  -3.131
  256    HA   ILE  36           HA       ILE  36  -0.040 -14.426  -4.729
  257    HB   ILE  36           HB       ILE  36  -0.785 -15.661  -2.717
  258   1HG1  ILE  36          2HG1      ILE  36   1.114 -15.793  -0.891
  259   2HG1  ILE  36          1HG1      ILE  36   1.466 -14.137  -1.357
  260   1HG2  ILE  36          1HG2      ILE  36   1.100 -17.195  -2.750
  261   2HG2  ILE  36          2HG2      ILE  36   0.867 -16.529  -4.370
  262   3HG2  ILE  36          3HG2      ILE  36   2.188 -15.928  -3.346
  263   1HD1  ILE  36          1HD1      ILE  36  -0.078 -14.164   0.528
  264   2HD1  ILE  36          2HD1      ILE  36  -1.149 -15.317  -0.292
  265   3HD1  ILE  36          3HD1      ILE  36  -1.027 -13.655  -0.883
  266    H    ILE  37           H        ILE  37   0.272 -11.596  -2.583
  267    HA   ILE  37           HA       ILE  37  -2.698 -11.274  -2.732
  268    HB   ILE  37           HB       ILE  37  -2.424  -9.292  -1.389
  269   1HG1  ILE  37          1HG1      ILE  37   0.473 -10.077  -1.002
  270   2HG1  ILE  37          2HG1      ILE  37  -0.042  -8.734  -2.049
  271   1HG2  ILE  37          1HG2      ILE  37  -1.015 -11.601  -0.001
  272   2HG2  ILE  37          2HG2      ILE  37  -2.141 -10.425   0.691
  273   3HG2  ILE  37          3HG2      ILE  37  -2.742 -11.649  -0.428
  274   1HD1  ILE  37          1HD1      ILE  37  -0.423  -8.937   0.955
  275   2HD1  ILE  37          2HD1      ILE  37   0.640  -7.839   0.058
  276   3HD1  ILE  37          3HD1      ILE  37  -1.122  -7.664  -0.080
  277    H    ALA  38           H        ALA  38   0.330 -10.045  -4.168
  278    HA   ALA  38           HA       ALA  38  -0.242  -7.684  -5.175
  279   1HB   ALA  38          1HB       ALA  38   1.183  -8.189  -7.098
  280   2HB   ALA  38          2HB       ALA  38   1.810  -8.947  -5.625
  281   3HB   ALA  38          3HB       ALA  38   0.972  -9.925  -6.845
  282    HA   PRO  39           HA       PRO  39  -2.815  -8.747  -9.001
  283   1HB   PRO  39          2HB       PRO  39  -4.173 -11.065  -9.333
  284   2HB   PRO  39          1HB       PRO  39  -2.447 -10.903  -9.770
  285   1HG   PRO  39          2HG       PRO  39  -3.618 -12.116  -7.267
  286   2HG   PRO  39          1HG       PRO  39  -2.297 -12.752  -8.283
  287   1HD   PRO  39          1HD       PRO  39  -1.969 -11.320  -5.969
  288   2HD   PRO  39          2HD       PRO  39  -0.737 -11.326  -7.262
  289    H    VAL  40           H        VAL  40  -3.705  -9.963  -5.838
  290    HA   VAL  40           HA       VAL  40  -6.521  -9.348  -6.031
  291    HB   VAL  40           HB       VAL  40  -5.027  -9.721  -3.429
  292   1HG1  VAL  40          1HG1      VAL  40  -7.495  -9.174  -3.613
  293   2HG1  VAL  40          2HG1      VAL  40  -7.116 -10.679  -2.733
  294   3HG1  VAL  40          3HG1      VAL  40  -7.724 -10.745  -4.396
  295   1HG2  VAL  40          1HG2      VAL  40  -5.806 -11.939  -5.381
  296   2HG2  VAL  40          2HG2      VAL  40  -5.423 -12.191  -3.666
  297   3HG2  VAL  40          3HG2      VAL  40  -4.174 -11.612  -4.762
  298    H    VAL  41           H        VAL  41  -3.540  -7.828  -4.781
  299    HA   VAL  41           HA       VAL  41  -4.667  -5.442  -3.688
  300    HB   VAL  41           HB       VAL  41  -1.981  -5.827  -5.092
  301   1HG1  VAL  41          1HG1      VAL  41  -2.395  -7.277  -2.976
  302   2HG1  VAL  41          2HG1      VAL  41  -2.404  -5.747  -2.092
  303   3HG1  VAL  41          3HG1      VAL  41  -0.969  -6.234  -2.997
  304   1HG2  VAL  41          1HG2      VAL  41  -2.909  -3.646  -3.193
  305   2HG2  VAL  41          2HG2      VAL  41  -2.516  -3.449  -4.918
  306   3HG2  VAL  41          3HG2      VAL  41  -1.248  -3.861  -3.763
  307    H    ASP  42           HN       ASP  42  -3.561  -6.307  -6.999
  308    HA   ASP  42           HA       ASP  42  -4.309  -3.841  -8.209
  309   1HB   ASP  42          1HB       ASP  42  -3.949  -6.656  -9.264
  310   2HB   ASP  42          2HB       ASP  42  -4.498  -5.366 -10.323
  311    H    GLU  43           HN       GLU  43  -6.349  -6.939  -8.169
  312    HA   GLU  43           HA       GLU  43  -8.442  -5.586  -9.521
  313   1HB   GLU  43          1HB       GLU  43  -9.797  -7.351  -9.046
  314   2HB   GLU  43          2HB       GLU  43  -8.191  -8.081  -9.151
  315   1HG   GLU  43          1HG       GLU  43  -8.145  -7.956  -6.589
  316   2HG   GLU  43          2HG       GLU  43  -9.861  -7.530  -6.644
  317    H    ILE  44           H        ILE  44  -7.739  -5.828  -6.019
  318    HA   ILE  44           HA       ILE  44 -10.129  -4.424  -5.200
  319    HB   ILE  44           HB       ILE  44  -7.409  -4.862  -3.907
  320   1HG1  ILE  44          2HG1      ILE  44  -8.882  -6.822  -4.003
  321   2HG1  ILE  44          1HG1      ILE  44  -8.714  -6.243  -2.345
  322   1HG2  ILE  44          1HG2      ILE  44  -8.098  -2.722  -3.035
  323   2HG2  ILE  44          2HG2      ILE  44  -8.368  -3.950  -1.799
  324   3HG2  ILE  44          3HG2      ILE  44  -9.738  -3.312  -2.719
  325   1HD1  ILE  44          1HD1      ILE  44 -10.953  -6.935  -2.657
  326   2HD1  ILE  44          2HD1      ILE  44 -10.980  -5.173  -2.531
  327   3HD1  ILE  44          3HD1      ILE  44 -11.166  -5.970  -4.112
  328    H    ALA  45           H        ALA  45  -6.856  -3.290  -6.191
  329    HA   ALA  45           HA       ALA  45  -7.309  -0.549  -5.775
  330   1HB   ALA  45          1HB       ALA  45  -5.860  -1.735  -8.192
  331   2HB   ALA  45          2HB       ALA  45  -5.164  -1.609  -6.572
  332   3HB   ALA  45          3HB       ALA  45  -5.656  -0.152  -7.487
  333    H    GLY  46           H        GLY  46  -8.104  -2.602  -8.639
  334   1HA   GLY  46          2HA       GLY  46  -9.197  -0.648 -10.325
  335   2HA   GLY  46          1HA       GLY  46  -9.722  -2.341 -10.247
  336    H    GLU  47           HN       GLU  47 -10.871  -2.609  -7.823
  337    HA   GLU  47           HA       GLU  47 -13.424  -1.379  -8.167
  338   1HB   GLU  47          1HB       GLU  47 -12.142  -2.873  -5.852
  339   2HB   GLU  47          2HB       GLU  47 -13.848  -2.418  -5.920
  340   1HG   GLU  47          1HG       GLU  47 -14.158  -3.836  -7.905
  341   2HG   GLU  47          2HG       GLU  47 -12.431  -4.222  -7.943
  342    H    TYR  48           H        TYR  48 -11.024  -0.865  -5.565
  343    HA   TYR  48           HA       TYR  48 -12.686   1.300  -4.444
  344   1HB   TYR  48          2HB       TYR  48 -10.095   0.019  -3.480
  345   2HB   TYR  48          1HB       TYR  48 -10.971   1.286  -2.646
  346    HD1  TYR  48           HD1      TYR  48 -12.621   0.799  -1.067
  347    HD2  TYR  48           HD2      TYR  48 -11.442  -2.241  -3.875
  348    HE1  TYR  48           HE1      TYR  48 -14.243  -0.764  -0.068
  349    HE2  TYR  48           HE2      TYR  48 -13.116  -3.785  -2.924
  350    HH   TYR  48           HH       TYR  48 -15.204  -2.868  -0.172
  351    H    LYS  49           HN       LYS  49 -10.332   1.362  -6.849
  352    HA   LYS  49           HA       LYS  49  -8.505   3.131  -6.483
  353   1HB   LYS  49          1HB       LYS  49  -9.545   2.162  -8.721
  354   2HB   LYS  49          2HB       LYS  49 -10.263   3.751  -8.873
  355   1HG   LYS  49          1HG       LYS  49  -8.037   4.805  -8.681
  356   2HG   LYS  49          2HG       LYS  49  -7.281   3.235  -8.413
  357   1HD   LYS  49          1HD       LYS  49  -8.676   4.171 -10.960
  358   2HD   LYS  49          2HD       LYS  49  -6.937   3.973 -10.713
  359   1HE   LYS  49          2HE       LYS  49  -9.048   1.786 -10.880
  360   2HE   LYS  49          1HE       LYS  49  -7.693   2.080 -11.972
  361   1HZ   LYS  49          1HZ       LYS  49  -7.488   1.209  -9.176
  362   2HZ   LYS  49          2HZ       LYS  49  -6.198   1.491 -10.174
  363   3HZ   LYS  49          3HZ       LYS  49  -7.252   0.274 -10.508
  364    H    ASP  50           HN       ASP  50 -11.818   4.181  -7.055
  365    HA   ASP  50           HA       ASP  50 -11.684   6.938  -7.174
  366   1HB   ASP  50          2HB       ASP  50 -13.719   5.610  -7.496
  367   2HB   ASP  50          1HB       ASP  50 -13.751   5.140  -5.806
  368    H    LYS  51           HN       LYS  51 -12.281   5.069  -4.243
  369    HA   LYS  51           HA       LYS  51 -12.035   7.392  -2.473
  370   1HB   LYS  51          2HB       LYS  51 -12.364   4.420  -1.877
  371   2HB   LYS  51          1HB       LYS  51 -12.639   5.762  -0.761
  372   1HG   LYS  51          2HG       LYS  51 -14.474   6.573  -2.299
  373   2HG   LYS  51          1HG       LYS  51 -14.296   5.092  -3.239
  374   1HD   LYS  51          2HD       LYS  51 -15.034   5.317  -0.287
  375   2HD   LYS  51          1HD       LYS  51 -16.115   4.872  -1.614
  376   1HE   LYS  51          2HE       LYS  51 -13.791   3.236  -0.493
  377   2HE   LYS  51          1HE       LYS  51 -15.507   2.890  -0.353
  378   1HZ   LYS  51          1HZ       LYS  51 -13.969   2.899  -2.854
  379   2HZ   LYS  51          2HZ       LYS  51 -14.539   1.576  -2.053
  380   3HZ   LYS  51          3HZ       LYS  51 -15.594   2.636  -2.743
  381    H    LEU  52           H        LEU  52 -10.106   4.678  -3.491
  382    HA   LEU  52           HA       LEU  52  -8.008   5.223  -1.415
  383   1HB   LEU  52          1HB       LEU  52  -9.661   3.326  -0.953
  384   2HB   LEU  52          2HB       LEU  52  -9.047   2.550  -2.410
  385    HG   LEU  52           HG       LEU  52  -6.694   2.732  -1.223
  386   1HD1  LEU  52          1HD1      LEU  52  -8.676   2.998   1.088
  387   2HD1  LEU  52          2HD1      LEU  52  -7.473   4.220   0.619
  388   3HD1  LEU  52          3HD1      LEU  52  -6.952   2.664   1.282
  389   1HD2  LEU  52          1HD2      LEU  52  -7.294   0.587   0.001
  390   2HD2  LEU  52          2HD2      LEU  52  -8.989   0.890  -0.417
  391   3HD2  LEU  52          3HD2      LEU  52  -7.791   0.625  -1.699
  392    H    LYS  53           HN       LYS  53  -6.172   5.894  -2.582
  393    HA   LYS  53           HA       LYS  53  -5.793   4.932  -5.314
  394   1HB   LYS  53          1HB       LYS  53  -5.356   7.238  -4.322
  395   2HB   LYS  53          2HB       LYS  53  -3.928   6.610  -3.585
  396   1HG   LYS  53          2HG       LYS  53  -4.611   6.545  -6.578
  397   2HG   LYS  53          1HG       LYS  53  -3.580   7.754  -5.808
  398   1HD   LYS  53          1HD       LYS  53  -1.915   6.094  -5.215
  399   2HD   LYS  53          2HD       LYS  53  -2.900   4.771  -5.868
  400   1HE   LYS  53          2HE       LYS  53  -1.898   7.082  -7.570
  401   2HE   LYS  53          1HE       LYS  53  -1.055   5.534  -7.383
  402   1HZ   LYS  53          1HZ       LYS  53  -2.980   4.426  -8.235
  403   2HZ   LYS  53          2HZ       LYS  53  -2.411   5.532  -9.316
  404   3HZ   LYS  53          3HZ       LYS  53  -3.768   5.859  -8.443
  405    H    CYS  54           H        CYS  54  -5.515   2.685  -5.094
  406    HA   CYS  54           HA       CYS  54  -3.735   1.626  -3.070
  407   1HB   CYS  54          1HB       CYS  54  -5.662   0.349  -3.887
  408   2HB   CYS  54          2HB       CYS  54  -4.888   0.298  -5.498
  409    HG   CYS  54           HG       CYS  54  -3.308  -0.528  -2.746
  410    H    VAL  55           H        VAL  55  -1.591   0.840  -3.332
  411    HA   VAL  55           HA       VAL  55  -0.240   1.184  -5.883
  412    HB   VAL  55           HB       VAL  55   1.346   2.538  -3.832
  413   1HG1  VAL  55          1HG1      VAL  55   0.129   4.598  -3.513
  414   2HG1  VAL  55          2HG1      VAL  55  -1.278   3.952  -4.359
  415   3HG1  VAL  55          3HG1      VAL  55  -0.777   3.256  -2.799
  416   1HG2  VAL  55          1HG2      VAL  55   1.733   2.746  -6.222
  417   2HG2  VAL  55          2HG2      VAL  55   0.125   3.485  -6.444
  418   3HG2  VAL  55          3HG2      VAL  55   1.379   4.331  -5.517
  419    H    LYS  56           HN       LYS  56   1.984   0.445  -5.772
  420    HA   LYS  56           HA       LYS  56   2.589  -1.350  -3.486
  421   1HB   LYS  56          1HB       LYS  56   2.172  -1.899  -6.364
  422   2HB   LYS  56          2HB       LYS  56   3.655  -2.599  -5.713
  423   1HG   LYS  56          1HG       LYS  56   2.436  -3.665  -3.883
  424   2HG   LYS  56          2HG       LYS  56   0.914  -2.932  -4.423
  425   1HD   LYS  56          2HD       LYS  56   2.571  -4.895  -6.079
  426   2HD   LYS  56          1HD       LYS  56   1.241  -5.359  -5.004
  427   1HE   LYS  56          2HE       LYS  56  -0.305  -3.863  -6.296
  428   2HE   LYS  56          1HE       LYS  56   1.007  -3.543  -7.447
  429   1HZ   LYS  56          1HZ       LYS  56  -0.382  -5.291  -8.238
  430   2HZ   LYS  56          2HZ       LYS  56   1.082  -5.932  -7.845
  431   3HZ   LYS  56          3HZ       LYS  56  -0.221  -6.148  -6.855
  432    H    LEU  57           H        LEU  57   4.449  -0.774  -2.536
  433    HA   LEU  57           HA       LEU  57   6.407   0.844  -4.116
  434   1HB   LEU  57          1HB       LEU  57   5.534   1.804  -1.971
  435   2HB   LEU  57          2HB       LEU  57   6.354   0.499  -1.107
  436    HG   LEU  57           HG       LEU  57   8.151   1.853  -3.024
  437   1HD1  LEU  57          1HD2      LEU  57   8.221   1.456  -0.010
  438   2HD1  LEU  57          2HD2      LEU  57   9.565   1.998  -0.997
  439   3HD1  LEU  57          3HD2      LEU  57   8.929   0.351  -1.207
  440   1HD2  LEU  57          1HD1      LEU  57   6.953   3.511  -0.775
  441   2HD2  LEU  57          2HD1      LEU  57   8.361   3.954  -1.764
  442   3HD2  LEU  57          3HD1      LEU  57   6.768   3.814  -2.522
  443    H    ASN  58           H        ASN  58   8.235  -0.074  -4.819
  444    HA   ASN  58           HA       ASN  58   8.854  -2.836  -4.017
  445   1HB   ASN  58          2HB       ASN  58   9.172  -2.074  -6.335
  446   2HB   ASN  58          1HB       ASN  58  10.429  -0.959  -5.789
  447   1HD2  ASN  58          2HD2      ASN  58   9.975  -4.008  -7.097
  448   2HD2  ASN  58          1HD2      ASN  58  11.485  -4.730  -6.568
  449    H    THR  59           H        THR  59   9.697  -3.181  -2.132
  450    HA   THR  59           HA       THR  59  10.902  -1.169  -0.478
  451    HB   THR  59           HB       THR  59  10.844  -4.196  -0.109
  452    HG1  THR  59           HG1      THR  59   8.771  -3.529  -0.515
  453   1HG2  THR  59          1HG2      THR  59  10.701  -3.605   2.297
  454   2HG2  THR  59          2HG2      THR  59  10.873  -1.887   1.882
  455   3HG2  THR  59          3HG2      THR  59  12.211  -3.018   1.581
  456    H    ASP  60           HN       ASP  60  12.226  -3.560  -2.708
  457    HA   ASP  60           HA       ASP  60  14.875  -3.675  -1.505
  458   1HB   ASP  60          1HB       ASP  60  13.640  -5.385  -2.984
  459   2HB   ASP  60          2HB       ASP  60  14.076  -4.378  -4.359
  460    H    GLU  61           HN       GLU  61  13.317  -2.077  -4.198
  461    HA   GLU  61           HA       GLU  61  15.603  -0.498  -5.064
  462   1HB   GLU  61          2HB       GLU  61  13.821  -1.423  -6.557
  463   2HB   GLU  61          1HB       GLU  61  12.641  -0.389  -5.738
  464   1HG   GLU  61          1HG       GLU  61  13.266   0.579  -7.862
  465   2HG   GLU  61          2HG       GLU  61  13.830   1.636  -6.576
  466    H    SER  62           H        SER  62  12.860   0.005  -2.867
  467    HA   SER  62           HA       SER  62  13.821   2.773  -2.272
  468   1HB   SER  62          1HB       SER  62  10.950   1.913  -2.734
  469   2HB   SER  62          2HB       SER  62  11.546   3.470  -2.112
  470    HG   SER  62           HG       SER  62  13.009   2.956  -4.235
  471    HA   PRO  63           HA       PRO  63  13.453   0.011   1.519
  472   1HB   PRO  63          2HB       PRO  63  16.051   0.275   2.343
  473   2HB   PRO  63          1HB       PRO  63  15.521  -0.881   1.094
  474   1HG   PRO  63          2HG       PRO  63  16.825   1.765   0.565
  475   2HG   PRO  63          1HG       PRO  63  17.231   0.164  -0.105
  476   1HD   PRO  63          1HD       PRO  63  15.574   1.874  -1.443
  477   2HD   PRO  63          2HD       PRO  63  15.317   0.120  -1.477
  478    H    ASN  64           H        ASN  64  15.149   2.854   0.692
  479    HA   ASN  64           HA       ASN  64  15.504   4.522   2.761
  480   1HB   ASN  64          1HB       ASN  64  13.945   5.345   0.266
  481   2HB   ASN  64          2HB       ASN  64  14.705   6.461   1.412
  482   1HD2  ASN  64          1HD2      ASN  64  15.494   6.983  -0.928
  483   2HD2  ASN  64          2HD2      ASN  64  17.073   6.290  -1.328
  484    H    VAL  65           H        VAL  65  12.298   4.676   1.220
  485    HA   VAL  65           HA       VAL  65  10.966   6.081   3.255
  486    HB   VAL  65           HB       VAL  65   9.957   4.130   1.129
  487   1HG1  VAL  65          1HG2      VAL  65   7.791   5.239   1.356
  488   2HG1  VAL  65          2HG2      VAL  65   8.410   6.214   2.715
  489   3HG1  VAL  65          3HG2      VAL  65   8.232   4.456   2.875
  490   1HG2  VAL  65          1HG1      VAL  65  10.213   7.173   1.169
  491   2HG2  VAL  65          2HG1      VAL  65  11.193   6.063   0.196
  492   3HG2  VAL  65          3HG1      VAL  65   9.460   6.219  -0.127
  493    H    ALA  66           H        ALA  66  11.078   2.616   2.571
  494    HA   ALA  66           HA       ALA  66   9.420   1.705   4.679
  495   1HB   ALA  66          1HB       ALA  66  11.837   0.243   3.511
  496   2HB   ALA  66          2HB       ALA  66  10.423  -0.475   4.276
  497   3HB   ALA  66          3HB       ALA  66  10.253   0.354   2.722
  498    H    SER  67           H        SER  67  12.862   2.581   4.696
  499    HA   SER  67           HA       SER  67  13.388   1.591   7.371
  500   1HB   SER  67          1HB       SER  67  14.992   3.574   5.697
  501   2HB   SER  67          2HB       SER  67  15.553   2.634   7.088
  502    HG   SER  67           HG       SER  67  14.596   1.560   4.626
  503    H    GLU  68           HN       GLU  68  12.760   4.761   5.880
  504    HA   GLU  68           HA       GLU  68  12.975   6.407   8.183
  505   1HB   GLU  68          1HB       GLU  68  11.169   6.609   5.734
  506   2HB   GLU  68          2HB       GLU  68  11.320   7.882   6.943
  507   1HG   GLU  68          2HG       GLU  68  13.589   8.315   6.413
  508   2HG   GLU  68          1HG       GLU  68  13.788   6.801   5.533
  509    H    TYR  69           H        TYR  69  10.186   4.564   6.887
  510    HA   TYR  69           HA       TYR  69   8.472   5.302   9.141
  511   1HB   TYR  69          2HB       TYR  69   8.256   3.515   6.714
  512   2HB   TYR  69          1HB       TYR  69   7.164   3.278   8.056
  513    HD1  TYR  69           HD1      TYR  69   7.887   5.377   5.175
  514    HD2  TYR  69           HD2      TYR  69   5.772   5.258   8.927
  515    HE1  TYR  69           HE1      TYR  69   6.497   7.295   4.456
  516    HE2  TYR  69           HE2      TYR  69   4.351   7.159   8.178
  517    HH   TYR  69           HH       TYR  69   4.784   8.737   5.019
  518    H    GLY  70           H        GLY  70  10.578   2.508   8.377
  519   1HA   GLY  70          1HA       GLY  70  11.623   1.216  10.024
  520   2HA   GLY  70          2HA       GLY  70  10.433   1.708  11.231
  521    H    ILE  71           H        ILE  71  10.235   0.234   7.970
  522    HA   ILE  71           HA       ILE  71   8.209  -1.698   8.846
  523    HB   ILE  71           HB       ILE  71   9.511  -1.138   6.173
  524   1HG1  ILE  71          2HG1      ILE  71   6.826  -0.417   7.457
  525   2HG1  ILE  71          1HG1      ILE  71   8.120   0.697   7.001
  526   1HG2  ILE  71          1HG2      ILE  71   8.793  -3.495   6.295
  527   2HG2  ILE  71          2HG2      ILE  71   7.712  -2.599   5.246
  528   3HG2  ILE  71          3HG2      ILE  71   7.205  -2.988   6.908
  529   1HD1  ILE  71          1HD1      ILE  71   7.815  -0.057   4.620
  530   2HD1  ILE  71          2HD1      ILE  71   6.493   0.907   5.319
  531   3HD1  ILE  71          3HD1      ILE  71   6.301  -0.842   5.131
  532    H    ARG  72           HN       ARG  72   8.820  -3.420   9.884
  533    HA   ARG  72           HA       ARG  72  11.507  -4.435   9.894
  534   1HB   ARG  72          2HB       ARG  72  10.761  -5.816  11.644
  535   2HB   ARG  72          1HB       ARG  72   9.980  -4.258  11.866
  536   1HG   ARG  72          1HG       ARG  72   8.731  -6.866  10.879
  537   2HG   ARG  72          2HG       ARG  72   8.486  -6.070  12.425
  538   1HD   ARG  72          2HD       ARG  72   7.415  -5.210   9.726
  539   2HD   ARG  72          1HD       ARG  72   6.524  -5.727  11.153
  540    HE   ARG  72           HE       ARG  72   7.891  -3.520  12.054
  541   1HH1  ARG  72          2HH2      ARG  72   5.537  -4.144   9.469
  542   2HH1  ARG  72          1HH2      ARG  72   5.077  -2.479   9.310
  543   1HH2  ARG  72          2HH1      ARG  72   7.542  -1.277  11.523
  544   2HH2  ARG  72          1HH1      ARG  72   6.090  -0.854  10.668
  545    H    SER  73           H        SER  73   8.623  -5.357   8.075
  546    HA   SER  73           HA       SER  73  10.045  -7.390   6.629
  547   1HB   SER  73          1HB       SER  73   7.685  -8.260   8.379
  548   2HB   SER  73          2HB       SER  73   8.561  -9.271   7.220
  549    HG   SER  73           HG       SER  73  10.406  -8.339   8.808
  550    H    ILE  74           H        ILE  74   8.413  -8.348   4.958
  551    HA   ILE  74           HA       ILE  74   6.179  -6.495   4.456
  552    HB   ILE  74           HB       ILE  74   6.795  -6.641   2.003
  553   1HG1  ILE  74          1HG1      ILE  74   9.584  -7.333   2.933
  554   2HG1  ILE  74          2HG1      ILE  74   8.450  -8.515   2.253
  555   1HG2  ILE  74          1HG2      ILE  74   7.103  -4.635   3.502
  556   2HG2  ILE  74          2HG2      ILE  74   8.256  -4.699   2.175
  557   3HG2  ILE  74          3HG2      ILE  74   8.769  -5.167   3.806
  558   1HD1  ILE  74          1HD1      ILE  74   9.494  -6.016   0.857
  559   2HD1  ILE  74          2HD1      ILE  74   8.152  -7.013   0.249
  560   3HD1  ILE  74          3HD1      ILE  74   9.753  -7.702   0.407
  561    HA   PRO  75           HA       PRO  75   4.599  -6.647   2.416
  562   1HB   PRO  75          2HB       PRO  75   1.915  -7.113   2.629
  563   2HB   PRO  75          1HB       PRO  75   2.949  -7.758   1.335
  564   1HG   PRO  75          1HG       PRO  75   2.096  -9.118   3.904
  565   2HG   PRO  75          2HG       PRO  75   2.014  -9.795   2.250
  566   1HD   PRO  75          1HD       PRO  75   4.085 -10.379   3.942
  567   2HD   PRO  75          2HD       PRO  75   4.361 -10.127   2.195
  568    H    THR  76           H        THR  76   3.800  -4.856   3.199
  569    HA   THR  76           HA       THR  76   2.627  -4.606   5.862
  570    HB   THR  76           HB       THR  76   5.228  -3.242   5.058
  571    HG1  THR  76           HG1      THR  76   5.711  -4.958   6.331
  572   1HG2  THR  76          1HG2      THR  76   4.918  -1.875   7.120
  573   2HG2  THR  76          2HG2      THR  76   3.700  -1.492   5.897
  574   3HG2  THR  76          3HG2      THR  76   3.277  -2.533   7.280
  575    H    ILE  77           H        ILE  77   0.816  -3.572   5.370
  576    HA   ILE  77           HA       ILE  77   0.604  -2.058   2.808
  577    HB   ILE  77           HB       ILE  77  -1.488  -3.511   4.455
  578   1HG1  ILE  77          1HG1      ILE  77  -0.274  -4.175   1.733
  579   2HG1  ILE  77          2HG1      ILE  77   0.104  -5.016   3.242
  580   1HG2  ILE  77          1HG2      ILE  77  -2.994  -2.970   2.565
  581   2HG2  ILE  77          2HG2      ILE  77  -2.387  -1.498   3.303
  582   3HG2  ILE  77          3HG2      ILE  77  -1.674  -2.067   1.779
  583   1HD1  ILE  77          1HD1      ILE  77  -1.460  -6.366   2.099
  584   2HD1  ILE  77          2HD1      ILE  77  -2.321  -5.629   3.464
  585   3HD1  ILE  77          3HD1      ILE  77  -2.564  -5.016   1.806
  586    H    MET  78           H        MET  78   0.955   0.064   3.298
  587    HA   MET  78           HA       MET  78   0.030   1.159   5.909
  588   1HB   MET  78          1HB       MET  78   1.683   2.368   3.679
  589   2HB   MET  78          2HB       MET  78   1.174   3.208   5.159
  590   1HG   MET  78          1HG       MET  78   2.278   1.323   6.441
  591   2HG   MET  78          2HG       MET  78   3.014   0.819   4.945
  592   1HE   MET  78          1HE       MET  78   4.970   1.320   7.383
  593   2HE   MET  78          2HE       MET  78   5.034   2.999   7.971
  594   3HE   MET  78          3HE       MET  78   3.538   2.094   8.104
  595    H    VAL  79           H        VAL  79  -1.679   2.431   6.085
  596    HA   VAL  79           HA       VAL  79  -3.286   3.065   3.639
  597    HB   VAL  79           HB       VAL  79  -4.130   2.802   6.557
  598   1HG1  VAL  79          1HG1      VAL  79  -3.942   0.660   5.318
  599   2HG1  VAL  79          2HG1      VAL  79  -5.635   1.058   5.660
  600   3HG1  VAL  79          3HG1      VAL  79  -4.977   1.315   4.030
  601   1HG2  VAL  79          1HG2      VAL  79  -5.621   3.895   4.126
  602   2HG2  VAL  79          2HG2      VAL  79  -5.293   4.743   5.640
  603   3HG2  VAL  79          3HG2      VAL  79  -6.423   3.401   5.635
  604    H    PHE  80           H        PHE  80  -3.807   5.212   3.291
  605    HA   PHE  80           HA       PHE  80  -2.840   7.244   5.237
  606   1HB   PHE  80          2HB       PHE  80  -2.547   7.428   2.232
  607   2HB   PHE  80          1HB       PHE  80  -2.027   8.574   3.414
  608    HD1  PHE  80           HD1      PHE  80  -1.440   5.025   2.353
  609    HD2  PHE  80           HD2      PHE  80   0.293   8.601   3.992
  610    HE1  PHE  80           HE1      PHE  80   0.748   3.917   2.462
  611    HE2  PHE  80           HE2      PHE  80   2.458   7.435   4.266
  612    HZ   PHE  80           HZ       PHE  80   2.697   5.067   3.523
  613    H    LYS  81           HN       LYS  81  -3.777   9.302   4.914
  614    HA   LYS  81           HA       LYS  81  -6.211   9.638   3.357
  615   1HB   LYS  81          2HB       LYS  81  -7.707   9.951   5.056
  616   2HB   LYS  81          1HB       LYS  81  -6.809   8.596   5.731
  617   1HG   LYS  81          2HG       LYS  81  -6.448  11.565   6.442
  618   2HG   LYS  81          1HG       LYS  81  -7.336  10.383   7.378
  619   1HD   LYS  81          2HD       LYS  81  -5.509   9.376   8.217
  620   2HD   LYS  81          1HD       LYS  81  -4.478   9.661   6.811
  621   1HE   LYS  81          2HE       LYS  81  -3.969  11.855   7.421
  622   2HE   LYS  81          1HE       LYS  81  -5.283  11.927   8.620
  623   1HZ   LYS  81          1HZ       LYS  81  -2.896  10.223   8.802
  624   2HZ   LYS  81          2HZ       LYS  81  -3.146  11.625   9.631
  625   3HZ   LYS  81          3HZ       LYS  81  -4.105  10.315   9.914
  626    H    GLY  82           H        GLY  82  -6.434  12.015   3.019
  627   1HA   GLY  82          2HA       GLY  82  -5.547  14.187   2.975
  628   2HA   GLY  82          1HA       GLY  82  -5.205  13.832   4.703
  629    H    GLY  83           H        GLY  83  -3.767  12.193   1.873
  630   1HA   GLY  83          1HA       GLY  83  -1.622  12.045   1.144
  631   2HA   GLY  83          2HA       GLY  83  -1.216  13.499   2.051
  632    H    LYS  84           HN       LYS  84  -1.618  12.752   4.646
  633    HA   LYS  84           HA       LYS  84   0.741  11.073   5.090
  634   1HB   LYS  84          2HB       LYS  84  -1.089  12.460   7.081
  635   2HB   LYS  84          1HB       LYS  84   0.467  11.699   7.446
  636   1HG   LYS  84          1HG       LYS  84   1.494  13.236   5.652
  637   2HG   LYS  84          2HG       LYS  84  -0.001  14.166   5.725
  638   1HD   LYS  84          1HD       LYS  84   1.923  13.540   8.029
  639   2HD   LYS  84          2HD       LYS  84   1.773  15.090   7.201
  640   1HE   LYS  84          1HE       LYS  84  -0.345  13.749   8.958
  641   2HE   LYS  84          2HE       LYS  84   0.610  15.183   9.350
  642   1HZ   LYS  84          1HZ       LYS  84  -1.364  14.982   7.187
  643   2HZ   LYS  84          2HZ       LYS  84  -1.561  15.773   8.618
  644   3HZ   LYS  84          3HZ       LYS  84  -0.453  16.314   7.525
  645    H    LYS  85           HN       LYS  85   0.835   9.507   6.849
  646    HA   LYS  85           HA       LYS  85  -0.800   7.274   6.144
  647   1HB   LYS  85          2HB       LYS  85   1.643   7.295   6.867
  648   2HB   LYS  85          1HB       LYS  85   1.060   7.500   8.524
  649   1HG   LYS  85          1HG       LYS  85  -0.263   5.307   8.205
  650   2HG   LYS  85          2HG       LYS  85   0.388   5.250   6.565
  651   1HD   LYS  85          2HD       LYS  85   1.805   3.832   7.613
  652   2HD   LYS  85          1HD       LYS  85   2.738   5.312   7.751
  653   1HE   LYS  85          1HE       LYS  85   0.955   4.029   9.898
  654   2HE   LYS  85          2HE       LYS  85   2.722   3.998   9.855
  655   1HZ   LYS  85          1HZ       LYS  85   1.965   5.644  11.350
  656   2HZ   LYS  85          2HZ       LYS  85   1.041   6.374  10.201
  657   3HZ   LYS  85          3HZ       LYS  85   2.686   6.395  10.072
  658    H    CYS  86           H        CYS  86  -2.256   6.111   7.379
  659    HA   CYS  86           HA       CYS  86  -3.582   7.537   9.651
  660   1HB   CYS  86          1HB       CYS  86  -4.831   7.291   7.405
  661   2HB   CYS  86          2HB       CYS  86  -4.940   5.574   7.768
  662    HG   CYS  86           HG       CYS  86  -5.938   5.975  10.235
  663    H    GLU  87           HN       GLU  87  -3.319   4.222   8.233
  664    HA   GLU  87           HA       GLU  87  -2.430   3.120  10.832
  665   1HB   GLU  87          1HB       GLU  87  -4.600   1.782   9.158
  666   2HB   GLU  87          2HB       GLU  87  -3.972   1.287  10.723
  667   1HG   GLU  87          2HG       GLU  87  -5.815   2.273  11.544
  668   2HG   GLU  87          1HG       GLU  87  -4.809   3.721  11.456
  669    H    THR  88           H        THR  88  -2.026   0.554  10.282
  670    HA   THR  88           HA       THR  88  -0.986   0.122   7.608
  671    HB   THR  88           HB       THR  88   0.827   0.239  10.067
  672    HG1  THR  88           HG1      THR  88   0.203   2.034   8.174
  673   1HG2  THR  88          1HG2      THR  88   2.655  -0.299   8.422
  674   2HG2  THR  88          2HG2      THR  88   1.402  -0.695   7.221
  675   3HG2  THR  88          3HG2      THR  88   1.543  -1.641   8.716
  676    H    ILE  89           H        ILE  89  -1.149  -2.020   7.124
  677    HA   ILE  89           HA       ILE  89  -1.715  -3.968   9.329
  678    HB   ILE  89           HB       ILE  89  -2.388  -4.176   6.363
  679   1HG1  ILE  89          1HG1      ILE  89  -3.770  -2.410   7.238
  680   2HG1  ILE  89          2HG1      ILE  89  -4.724  -3.876   7.033
  681   1HG2  ILE  89          1HG2      ILE  89  -3.880  -6.024   7.173
  682   2HG2  ILE  89          2HG2      ILE  89  -2.160  -6.369   7.336
  683   3HG2  ILE  89          3HG2      ILE  89  -3.106  -5.907   8.766
  684   1HD1  ILE  89          1HD1      ILE  89  -5.315  -2.709   9.096
  685   2HD1  ILE  89          2HD1      ILE  89  -3.667  -2.838   9.702
  686   3HD1  ILE  89          3HD1      ILE  89  -4.646  -4.305   9.470
  687    H    ILE  90           H        ILE  90  -0.625  -6.057   9.062
  688    HA   ILE  90           HA       ILE  90   1.905  -5.954   7.491
  689    HB   ILE  90           HB       ILE  90   1.700  -6.660  10.449
  690   1HG1  ILE  90          1HG1      ILE  90   3.062  -4.241   9.177
  691   2HG1  ILE  90          2HG1      ILE  90   1.511  -4.177  10.022
  692   1HG2  ILE  90          1HG2      ILE  90   4.106  -6.451   8.566
  693   2HG2  ILE  90          2HG2      ILE  90   3.430  -7.960   9.215
  694   3HG2  ILE  90          3HG2      ILE  90   4.188  -6.818  10.301
  695   1HD1  ILE  90          1HD1      ILE  90   4.144  -4.894  11.331
  696   2HD1  ILE  90          2HD1      ILE  90   3.166  -3.440  11.545
  697   3HD1  ILE  90          3HD1      ILE  90   2.545  -5.006  12.096
  698    H    GLY  91           H        GLY  91   2.500  -7.935   6.688
  699   1HA   GLY  91          2HA       GLY  91   2.578 -10.219   6.458
  700   2HA   GLY  91          1HA       GLY  91   1.444 -10.432   7.799
  701    H    ALA  92           H        ALA  92   1.356 -11.915   5.383
  702    HA   ALA  92           HA       ALA  92  -0.642 -10.833   3.580
  703   1HB   ALA  92          1HB       ALA  92   1.033 -12.401   2.792
  704   2HB   ALA  92          2HB       ALA  92  -0.581 -13.104   2.615
  705   3HB   ALA  92          3HB       ALA  92   0.475 -13.645   3.938
  706    H    VAL  93           H        VAL  93  -2.087 -10.247   5.502
  707    HA   VAL  93           HA       VAL  93  -3.754 -12.450   6.537
  708    HB   VAL  93           HB       VAL  93  -5.245 -10.547   7.281
  709   1HG1  VAL  93          1HG2      VAL  93  -4.302  -8.873   5.600
  710   2HG1  VAL  93          2HG2      VAL  93  -2.880  -8.742   6.647
  711   3HG1  VAL  93          3HG2      VAL  93  -4.483  -8.313   7.272
  712   1HG2  VAL  93          1HG1      VAL  93  -2.344 -10.559   8.234
  713   2HG2  VAL  93          2HG1      VAL  93  -3.733  -9.916   9.135
  714   3HG2  VAL  93          3HG1      VAL  93  -3.633 -11.651   8.786
  715    HA   PRO  94           HA       PRO  94  -6.295 -12.884   3.002
  716   1HB   PRO  94          2HB       PRO  94  -8.757 -12.520   4.661
  717   2HB   PRO  94          1HB       PRO  94  -8.376 -13.838   3.528
  718   1HG   PRO  94          2HG       PRO  94  -8.154 -14.249   6.220
  719   2HG   PRO  94          1HG       PRO  94  -6.930 -14.900   5.090
  720   1HD   PRO  94          2HD       PRO  94  -6.740 -12.435   6.822
  721   2HD   PRO  94          1HD       PRO  94  -5.519 -13.693   6.472
  722    H    LYS  95           HN       LYS  95  -7.381 -11.730   1.454
  723    HA   LYS  95           HA       LYS  95  -7.195  -8.914   1.687
  724   1HB   LYS  95          1HB       LYS  95  -7.235 -10.491  -0.433
  725   2HB   LYS  95          2HB       LYS  95  -8.976 -10.249  -0.359
  726   1HG   LYS  95          1HG       LYS  95  -8.253  -8.465  -1.750
  727   2HG   LYS  95          2HG       LYS  95  -8.425  -7.697  -0.184
  728   1HD   LYS  95          2HD       LYS  95  -5.928  -8.063   0.208
  729   2HD   LYS  95          1HD       LYS  95  -5.809  -8.677  -1.438
  730   1HE   LYS  95          2HE       LYS  95  -6.434  -6.521  -2.345
  731   2HE   LYS  95          1HE       LYS  95  -6.898  -5.910  -0.738
  732   1HZ   LYS  95          1HZ       LYS  95  -4.761  -5.128  -1.398
  733   2HZ   LYS  95          2HZ       LYS  95  -4.191  -6.668  -1.543
  734   3HZ   LYS  95          3HZ       LYS  95  -4.633  -6.087  -0.065
  735    H    ALA  96           H        ALA  96  -9.893 -11.132   1.893
  736    HA   ALA  96           HA       ALA  96 -12.061  -9.408   2.282
  737   1HB   ALA  96          1HB       ALA  96 -13.015 -11.145   3.771
  738   2HB   ALA  96          2HB       ALA  96 -11.423 -11.924   3.898
  739   3HB   ALA  96          3HB       ALA  96 -12.266 -11.867   2.333
  740    H    THR  97           H        THR  97  -9.609 -10.387   4.781
  741    HA   THR  97           HA       THR  97 -10.680  -8.880   6.924
  742    HB   THR  97           HB       THR  97  -7.751  -9.592   6.416
  743    HG1  THR  97           HG1      THR  97  -9.887 -11.223   7.338
  744   1HG2  THR  97          1HG2      THR  97  -7.672  -9.964   8.817
  745   2HG2  THR  97          2HG2      THR  97  -8.149  -8.296   8.458
  746   3HG2  THR  97          3HG2      THR  97  -9.373  -9.479   8.984
  747    H    ILE  98           H        ILE  98  -8.108  -8.190   4.509
  748    HA   ILE  98           HA       ILE  98  -7.415  -5.602   5.424
  749    HB   ILE  98           HB       ILE  98  -7.287  -6.849   2.646
  750   1HG1  ILE  98          2HG1      ILE  98  -5.083  -6.228   4.658
  751   2HG1  ILE  98          1HG1      ILE  98  -5.950  -7.766   4.646
  752   1HG2  ILE  98          1HG2      ILE  98  -6.100  -4.215   3.640
  753   2HG2  ILE  98          2HG2      ILE  98  -5.687  -4.991   2.101
  754   3HG2  ILE  98          3HG2      ILE  98  -7.318  -4.397   2.361
  755   1HD1  ILE  98          1HD1      ILE  98  -4.375  -6.747   2.251
  756   2HD1  ILE  98          2HD1      ILE  98  -3.780  -7.884   3.466
  757   3HD1  ILE  98          3HD1      ILE  98  -5.151  -8.331   2.451
  758    H    VAL  99           H        VAL  99  -9.725  -6.405   2.760
  759    HA   VAL  99           HA       VAL  99 -10.629  -3.839   2.184
  760    HB   VAL  99           HB       VAL  99 -12.013  -6.552   2.119
  761   1HG1  VAL  99          1HG1      VAL  99 -13.843  -4.955   2.210
  762   2HG1  VAL  99          2HG1      VAL  99 -13.019  -3.881   1.058
  763   3HG1  VAL  99          3HG1      VAL  99 -13.644  -5.458   0.531
  764   1HG2  VAL  99          1HG2      VAL  99 -10.905  -4.759  -0.091
  765   2HG2  VAL  99          2HG2      VAL  99 -10.043  -6.147   0.591
  766   3HG2  VAL  99          3HG2      VAL  99 -11.563  -6.399  -0.280
  767    H    GLN 100           H        GLN 100 -12.137  -6.140   4.533
  768    HA   GLN 100           HA       GLN 100 -14.134  -4.337   5.451
  769   1HB   GLN 100          2HB       GLN 100 -12.833  -6.852   6.449
  770   2HB   GLN 100          1HB       GLN 100 -13.571  -5.840   7.678
  771   1HG   GLN 100          1HG       GLN 100 -15.091  -7.573   6.778
  772   2HG   GLN 100          2HG       GLN 100 -15.713  -5.919   6.729
  773   1HE2  GLN 100          1HE2      GLN 100 -13.570  -7.754   4.410
  774   2HE2  GLN 100          2HE2      GLN 100 -14.658  -7.474   3.057
  775    H    THR 101           H        THR 101 -10.824  -4.899   6.694
  776    HA   THR 101           HA       THR 101 -10.991  -3.001   8.816
  777    HB   THR 101           HB       THR 101  -8.548  -3.984   7.279
  778    HG1  THR 101           HG1      THR 101  -9.674  -5.697   8.123
  779   1HG2  THR 101          1HG2      THR 101  -7.435  -3.595   9.506
  780   2HG2  THR 101          2HG2      THR 101  -8.886  -2.718  10.034
  781   3HG2  THR 101          3HG2      THR 101  -7.934  -2.123   8.651
  782    H    VAL 102           H        VAL 102  -9.998  -2.592   5.387
  783    HA   VAL 102           HA       VAL 102  -9.146   0.135   5.640
  784    HB   VAL 102           HB       VAL 102 -10.085  -1.564   3.296
  785   1HG1  VAL 102          1HG1      VAL 102  -7.830  -2.052   4.402
  786   2HG1  VAL 102          2HG1      VAL 102  -7.744  -1.591   2.696
  787   3HG1  VAL 102          3HG1      VAL 102  -7.343  -0.412   3.965
  788   1HG2  VAL 102          1HG2      VAL 102  -9.157   0.220   1.833
  789   2HG2  VAL 102          2HG2      VAL 102 -10.610   0.753   2.681
  790   3HG2  VAL 102          3HG2      VAL 102  -9.008   1.285   3.244
  791    H    GLU 103           HN       GLU 103 -12.247  -1.347   4.666
  792    HA   GLU 103           HA       GLU 103 -13.683   1.053   4.240
  793   1HB   GLU 103          1HB       GLU 103 -14.536  -1.730   5.124
  794   2HB   GLU 103          2HB       GLU 103 -15.682  -0.443   4.722
  795   1HG   GLU 103          1HG       GLU 103 -14.885  -0.256   2.467
  796   2HG   GLU 103          2HG       GLU 103 -13.534  -1.353   2.759
  797    H    LYS 104           HN       LYS 104 -13.322  -0.928   7.169
  798    HA   LYS 104           HA       LYS 104 -14.850   0.575   8.998
  799   1HB   LYS 104          1HB       LYS 104 -13.961  -1.510   9.695
  800   2HB   LYS 104          2HB       LYS 104 -12.338  -1.078   9.196
  801   1HG   LYS 104          2HG       LYS 104 -12.430   0.713  11.140
  802   2HG   LYS 104          1HG       LYS 104 -13.750  -0.294  11.733
  803   1HD   LYS 104          1HD       LYS 104 -10.898  -1.159  11.011
  804   2HD   LYS 104          2HD       LYS 104 -11.486  -0.852  12.648
  805   1HE   LYS 104          2HE       LYS 104 -13.104  -2.725  12.447
  806   2HE   LYS 104          1HE       LYS 104 -12.559  -3.043  10.791
  807   1HZ   LYS 104          1HZ       LYS 104 -10.880  -3.234  13.183
  808   2HZ   LYS 104          2HZ       LYS 104 -11.527  -4.496  12.345
  809   3HZ   LYS 104          3HZ       LYS 104 -10.398  -3.533  11.634
  810    H    TYR 105           H        TYR 105 -11.351   0.983   8.142
  811    HA   TYR 105           HA       TYR 105 -11.022   3.290   9.813
  812   1HB   TYR 105          1HB       TYR 105  -9.466   2.567   7.303
  813   2HB   TYR 105          2HB       TYR 105  -8.964   3.616   8.631
  814    HD1  TYR 105           HD1      TYR 105  -7.508   1.215   7.377
  815    HD2  TYR 105           HD2      TYR 105  -9.840   1.753  10.967
  816    HE1  TYR 105           HE1      TYR 105  -5.966  -0.275   8.611
  817    HE2  TYR 105           HE2      TYR 105  -8.346   0.213  12.168
  818    HH   TYR 105           HH       TYR 105  -6.408  -1.043  12.071
  819    H    LEU 106           H        LEU 106 -11.770   2.991   6.337
  820    HA   LEU 106           HA       LEU 106 -12.148   5.955   6.125
  821   1HB   LEU 106          2HB       LEU 106 -11.483   3.835   4.048
  822   2HB   LEU 106          1HB       LEU 106 -11.764   5.549   3.696
  823    HG   LEU 106           HG       LEU 106  -9.531   4.478   5.492
  824   1HD1  LEU 106          1HD2      LEU 106  -8.540   6.734   5.113
  825   2HD1  LEU 106          2HD2      LEU 106 -10.062   6.826   6.005
  826   3HD1  LEU 106          3HD2      LEU 106 -10.022   7.236   4.274
  827   1HD2  LEU 106          1HD1      LEU 106  -9.498   5.320   2.567
  828   2HD2  LEU 106          2HD1      LEU 106  -8.066   4.918   3.547
  829   3HD2  LEU 106          3HD1      LEU 106  -9.284   3.679   3.206
  830    H    ASN 107           H        ASN 107 -13.401   3.718   3.697
  831    HA   ASN 107           HA       ASN 107 -16.012   3.379   4.643
  832   1HB   ASN 107          2HB       ASN 107 -15.932   5.930   4.034
  833   2HB   ASN 107          1HB       ASN 107 -15.726   5.394   2.366
  834   1HD2  ASN 107          1HD2      ASN 107 -17.563   3.135   2.408
  835   2HD2  ASN 107          2HD2      ASN 107 -19.183   3.816   2.619
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1   0.015  -3.710 -11.696
    2   2H    MET   1          2H        MET   1  -0.521  -2.272 -11.030
    3   3H    MET   1          3H        MET   1  -1.425  -3.614 -10.874
    4    HA   MET   1           HA       MET   1  -0.832  -2.315 -13.428
    5   1HB   MET   1          2HB       MET   1  -1.262  -4.664 -13.754
    6   2HB   MET   1          1HB       MET   1  -2.615  -4.655 -12.640
    7   1HG   MET   1          1HG       MET   1  -3.515  -4.696 -14.876
    8   2HG   MET   1          2HG       MET   1  -3.832  -3.093 -14.287
    9   1HE   MET   1          1HE       MET   1  -3.279  -2.240 -17.977
   10   2HE   MET   1          2HE       MET   1  -4.279  -1.970 -16.531
   11   3HE   MET   1          3HE       MET   1  -4.167  -3.599 -17.248
   12    H    GLU   2           HN       GLU   2  -3.945  -3.199 -11.858
   13    HA   GLU   2           HA       GLU   2  -5.014  -0.555 -12.219
   14   1HB   GLU   2          2HB       GLU   2  -5.938  -2.676 -10.233
   15   2HB   GLU   2          1HB       GLU   2  -6.870  -1.331 -10.900
   16   1HG   GLU   2          2HG       GLU   2  -7.627  -2.901 -12.384
   17   2HG   GLU   2          1HG       GLU   2  -6.101  -2.630 -13.227
   18    H    ALA   3           H        ALA   3  -3.401  -2.289  -9.604
   19    HA   ALA   3           HA       ALA   3  -3.238   0.089  -7.856
   20   1HB   ALA   3          1HB       ALA   3  -3.347  -2.150  -6.811
   21   2HB   ALA   3          2HB       ALA   3  -1.765  -1.403  -6.504
   22   3HB   ALA   3          3HB       ALA   3  -1.945  -2.662  -7.749
   23    H    GLY   4           H        GLY   4  -1.494   1.550  -8.078
   24   1HA   GLY   4          2HA       GLY   4   0.220   1.244 -10.434
   25   2HA   GLY   4          1HA       GLY   4   0.220   2.574  -9.272
   26    H    ALA   5           H        ALA   5   2.654   2.094  -9.883
   27    HA   ALA   5           HA       ALA   5   3.827   0.377  -7.750
   28   1HB   ALA   5          1HB       ALA   5   4.229  -0.685  -9.936
   29   2HB   ALA   5          2HB       ALA   5   4.892   0.841 -10.566
   30   3HB   ALA   5          3HB       ALA   5   5.730  -0.022  -9.257
   31    H    VAL   6           H        VAL   6   5.336   1.534  -6.495
   32    HA   VAL   6           HA       VAL   6   6.142   4.241  -7.450
   33    HB   VAL   6           HB       VAL   6   5.812   4.944  -4.947
   34   1HG1  VAL   6          1HG1      VAL   6   3.706   2.750  -5.067
   35   2HG1  VAL   6          2HG1      VAL   6   3.935   3.953  -3.786
   36   3HG1  VAL   6          3HG1      VAL   6   5.177   2.735  -4.092
   37   1HG2  VAL   6          1HG2      VAL   6   4.671   6.082  -6.657
   38   2HG2  VAL   6          2HG2      VAL   6   3.561   4.731  -6.941
   39   3HG2  VAL   6          3HG2      VAL   6   3.481   5.655  -5.417
   40    H    ASN   7           H        ASN   7   7.785   5.212  -6.127
   41    HA   ASN   7           HA       ASN   7   9.549   3.484  -4.606
   42   1HB   ASN   7          2HB       ASN   7  10.480   3.131  -6.801
   43   2HB   ASN   7          1HB       ASN   7  10.343   4.853  -7.218
   44   1HD2  ASN   7          2HD2      ASN   7  11.841   2.929  -4.509
   45   2HD2  ASN   7          1HD2      ASN   7  13.432   3.606  -4.708
   46    H    ASP   8           HN       ASP   8  11.338   5.013  -3.816
   47    HA   ASP   8           HA       ASP   8  10.463   6.893  -2.076
   48   1HB   ASP   8          1HB       ASP   8  12.806   6.078  -2.325
   49   2HB   ASP   8          2HB       ASP   8  13.052   7.159  -3.683
   50    H    ASP   9           HN       ASP   9  11.570   7.657  -5.327
   51    HA   ASP   9           HA       ASP   9  11.107  10.462  -5.320
   52   1HB   ASP   9          2HB       ASP   9  12.425   9.394  -7.053
   53   2HB   ASP   9          1HB       ASP   9  11.063   8.434  -7.611
   54    H    THR  10           H        THR  10   9.081   8.155  -7.154
   55    HA   THR  10           HA       THR  10   6.932   9.897  -7.610
   56    HB   THR  10           HB       THR  10   5.698   7.687  -8.040
   57    HG1  THR  10           HG1      THR  10   7.260   5.908  -8.129
   58   1HG2  THR  10          1HG2      THR  10   8.439   8.067  -9.336
   59   2HG2  THR  10          2HG2      THR  10   6.954   8.923  -9.787
   60   3HG2  THR  10          3HG2      THR  10   7.067   7.171 -10.018
   61    H    PHE  11           H        PHE  11   7.486   7.756  -4.870
   62    HA   PHE  11           HA       PHE  11   5.159   7.622  -3.483
   63   1HB   PHE  11          2HB       PHE  11   7.458   6.855  -2.788
   64   2HB   PHE  11          1HB       PHE  11   7.821   8.489  -2.289
   65    HD1  PHE  11           HD1      PHE  11   7.136   9.302  -0.141
   66    HD2  PHE  11           HD2      PHE  11   5.710   5.521  -1.623
   67    HE1  PHE  11           HE1      PHE  11   6.396   8.691   2.136
   68    HE2  PHE  11           HE2      PHE  11   4.889   4.941   0.646
   69    HZ   PHE  11           HZ       PHE  11   5.221   6.535   2.531
   70    H    LYS  12           HN       LYS  12   7.308  10.342  -3.623
   71    HA   LYS  12           HA       LYS  12   6.214  12.138  -1.740
   72   1HB   LYS  12          2HB       LYS  12   7.447  12.778  -4.451
   73   2HB   LYS  12          1HB       LYS  12   7.250  13.930  -3.142
   74   1HG   LYS  12          1HG       LYS  12   8.872  11.356  -2.885
   75   2HG   LYS  12          2HG       LYS  12   9.571  12.862  -3.444
   76   1HD   LYS  12          1HD       LYS  12   9.768  13.692  -1.357
   77   2HD   LYS  12          2HD       LYS  12   8.122  13.251  -0.915
   78   1HE   LYS  12          2HE       LYS  12   9.787  12.093   0.504
   79   2HE   LYS  12          1HE       LYS  12   8.806  10.948  -0.419
   80   1HZ   LYS  12          1HZ       LYS  12  10.588  10.656  -1.936
   81   2HZ   LYS  12          2HZ       LYS  12  11.501  11.820  -1.203
   82   3HZ   LYS  12          3HZ       LYS  12  11.155  10.415  -0.416
   83    H    ASN  13           H        ASN  13   5.362  11.702  -5.172
   84    HA   ASN  13           HA       ASN  13   3.246  13.749  -5.069
   85   1HB   ASN  13          1HB       ASN  13   4.247  11.839  -7.238
   86   2HB   ASN  13          2HB       ASN  13   3.011  13.060  -7.474
   87   1HD2  ASN  13          1HD2      ASN  13   3.750  15.391  -6.588
   88   2HD2  ASN  13          2HD2      ASN  13   5.361  15.842  -7.114
   89    H    VAL  14           H        VAL  14   3.524  10.291  -5.838
   90    HA   VAL  14           HA       VAL  14   0.729   9.876  -6.218
   91    HB   VAL  14           HB       VAL  14   3.049   7.956  -5.746
   92   1HG1  VAL  14          1HG1      VAL  14   3.015   7.722  -8.223
   93   2HG1  VAL  14          2HG1      VAL  14   1.752   8.964  -8.320
   94   3HG1  VAL  14          3HG1      VAL  14   3.380   9.383  -7.754
   95   1HG2  VAL  14          1HG2      VAL  14   0.977   6.728  -5.382
   96   2HG2  VAL  14          2HG2      VAL  14   0.250   7.449  -6.840
   97   3HG2  VAL  14          3HG2      VAL  14   1.600   6.310  -6.984
   98    H    VAL  15           H        VAL  15   2.833   9.439  -3.346
   99    HA   VAL  15           HA       VAL  15   0.538   8.236  -1.872
  100    HB   VAL  15           HB       VAL  15   3.489   8.204  -1.140
  101   1HG1  VAL  15          1HG1      VAL  15   1.089   6.682  -0.083
  102   2HG1  VAL  15          2HG1      VAL  15   2.779   6.472   0.427
  103   3HG1  VAL  15          3HG1      VAL  15   1.958   7.984   0.761
  104   1HG2  VAL  15          1HG2      VAL  15   3.437   5.865  -1.924
  105   2HG2  VAL  15          2HG2      VAL  15   3.133   6.974  -3.259
  106   3HG2  VAL  15          3HG2      VAL  15   1.788   6.097  -2.529
  107    H    LEU  16           H        LEU  16   3.267  10.527  -1.232
  108    HA   LEU  16           HA       LEU  16   1.999  11.380   1.220
  109   1HB   LEU  16          2HB       LEU  16   4.249  12.602  -0.420
  110   2HB   LEU  16          1HB       LEU  16   3.713  13.242   1.113
  111    HG   LEU  16           HG       LEU  16   4.895  10.481   0.568
  112   1HD1  LEU  16          1HD2      LEU  16   6.792  11.300   1.903
  113   2HD1  LEU  16          2HD2      LEU  16   5.959  12.846   2.174
  114   3HD1  LEU  16          3HD2      LEU  16   6.491  12.395   0.545
  115   1HD2  LEU  16          1HD1      LEU  16   3.859  11.672   3.173
  116   2HD2  LEU  16          2HD1      LEU  16   4.970  10.297   3.112
  117   3HD2  LEU  16          3HD1      LEU  16   3.364  10.140   2.406
  118    H    GLU  17           HN       GLU  17   2.617  13.475  -1.634
  119    HA   GLU  17           HA       GLU  17   0.491  15.275  -0.730
  120   1HB   GLU  17          1HB       GLU  17   2.154  15.331  -3.288
  121   2HB   GLU  17          2HB       GLU  17   1.202  16.655  -2.599
  122   1HG   GLU  17          2HG       GLU  17   3.722  15.401  -1.409
  123   2HG   GLU  17          1HG       GLU  17   3.534  17.025  -2.064
  124    H    SER  18           H        SER  18  -0.832  13.050  -0.972
  125    HA   SER  18           HA       SER  18  -2.136  12.783  -3.597
  126   1HB   SER  18          1HB       SER  18  -3.256  10.891  -2.318
  127   2HB   SER  18          2HB       SER  18  -1.496  10.765  -2.493
  128    HG   SER  18           HG       SER  18  -1.279  10.948  -0.399
  129    H    SER  19           H        SER  19  -4.492  12.823  -3.741
  130    HA   SER  19           HA       SER  19  -5.800  14.895  -2.099
  131   1HB   SER  19          2HB       SER  19  -7.565  14.459  -3.927
  132   2HB   SER  19          1HB       SER  19  -6.018  15.151  -4.461
  133    HG   SER  19           HG       SER  19  -6.596  13.374  -5.782
  134    H    VAL  20           H        VAL  20  -6.758  11.825  -3.537
  135    HA   VAL  20           HA       VAL  20  -8.486  11.026  -1.265
  136    HB   VAL  20           HB       VAL  20  -8.866   9.005  -2.606
  137   1HG1  VAL  20          1HG1      VAL  20  -7.049  10.211  -4.734
  138   2HG1  VAL  20          2HG1      VAL  20  -6.672   8.792  -3.735
  139   3HG1  VAL  20          3HG1      VAL  20  -8.028   8.742  -4.865
  140   1HG2  VAL  20          1HG2      VAL  20 -10.104  10.051  -4.427
  141   2HG2  VAL  20          2HG2      VAL  20 -10.268  11.007  -2.944
  142   3HG2  VAL  20          3HG2      VAL  20  -9.179  11.555  -4.239
  143    HA   PRO  21           HA       PRO  21  -5.294   8.945   0.877
  144   1HB   PRO  21          1HB       PRO  21  -6.940   6.524   1.365
  145   2HB   PRO  21          2HB       PRO  21  -6.266   7.651   2.563
  146   1HG   PRO  21          2HG       PRO  21  -8.923   7.538   1.949
  147   2HG   PRO  21          1HG       PRO  21  -8.126   9.068   2.420
  148   1HD   PRO  21          2HD       PRO  21  -8.842   8.147  -0.380
  149   2HD   PRO  21          1HD       PRO  21  -9.040   9.721   0.354
  150    H    VAL  22           H        VAL  22  -3.996   6.962   0.854
  151    HA   VAL  22           HA       VAL  22  -3.998   5.579  -1.801
  152    HB   VAL  22           HB       VAL  22  -1.637   6.876  -0.378
  153   1HG1  VAL  22          1HG1      VAL  22  -1.946   5.483  -3.064
  154   2HG1  VAL  22          2HG1      VAL  22  -0.911   5.015  -1.712
  155   3HG1  VAL  22          3HG1      VAL  22  -0.553   6.476  -2.639
  156   1HG2  VAL  22          1HG2      VAL  22  -1.703   8.515  -2.218
  157   2HG2  VAL  22          2HG2      VAL  22  -3.092   8.649  -1.158
  158   3HG2  VAL  22          3HG2      VAL  22  -3.262   7.873  -2.746
  159    H    LEU  23           H        LEU  23  -4.150   3.430  -1.413
  160    HA   LEU  23           HA       LEU  23  -3.078   2.172   1.028
  161   1HB   LEU  23          2HB       LEU  23  -5.235   1.527  -0.051
  162   2HB   LEU  23          1HB       LEU  23  -4.374   0.958  -1.463
  163    HG   LEU  23           HG       LEU  23  -3.906  -0.143   1.348
  164   1HD1  LEU  23          1HD2      LEU  23  -3.205  -2.197  -0.013
  165   2HD1  LEU  23          2HD2      LEU  23  -2.094  -0.834  -0.123
  166   3HD1  LEU  23          3HD2      LEU  23  -3.226  -1.168  -1.450
  167   1HD2  LEU  23          1HD1      LEU  23  -5.792  -1.149  -0.824
  168   2HD2  LEU  23          2HD1      LEU  23  -6.277  -0.408   0.718
  169   3HD2  LEU  23          3HD1      LEU  23  -5.441  -1.967   0.714
  170    H    VAL  24           H        VAL  24  -0.833   2.041   1.040
  171    HA   VAL  24           HA       VAL  24   0.604   1.348  -1.484
  172    HB   VAL  24           HB       VAL  24   1.661   2.446   1.151
  173   1HG1  VAL  24          1HG1      VAL  24   3.346   1.077  -0.056
  174   2HG1  VAL  24          2HG1      VAL  24   3.743   2.791  -0.167
  175   3HG1  VAL  24          3HG1      VAL  24   3.000   1.966  -1.553
  176   1HG2  VAL  24          1HG2      VAL  24   2.093   4.472  -0.224
  177   2HG2  VAL  24          2HG2      VAL  24   0.369   4.164   0.026
  178   3HG2  VAL  24          3HG2      VAL  24   1.134   3.772  -1.540
  179    H    ASP  25           HN       ASP  25   0.977  -0.821  -1.701
  180    HA   ASP  25           HA       ASP  25   1.344  -2.505   0.728
  181   1HB   ASP  25          1HB       ASP  25  -0.017  -3.472  -1.041
  182   2HB   ASP  25          2HB       ASP  25   1.280  -3.208  -2.221
  183    H    PHE  26           H        PHE  26   3.428  -2.368   1.612
  184    HA   PHE  26           HA       PHE  26   5.711  -1.661  -0.127
  185   1HB   PHE  26          1HB       PHE  26   5.481  -2.435   2.793
  186   2HB   PHE  26          2HB       PHE  26   7.011  -2.288   1.956
  187    HD1  PHE  26           HD1      PHE  26   3.849  -0.214   2.354
  188    HD2  PHE  26           HD2      PHE  26   8.165  -0.282   2.164
  189    HE1  PHE  26           HE1      PHE  26   3.916   2.178   2.908
  190    HE2  PHE  26           HE2      PHE  26   8.227   2.067   2.922
  191    HZ   PHE  26           HZ       PHE  26   6.100   3.314   3.314
  192    H    TRP  27           H        TRP  27   6.507  -3.227  -1.447
  193    HA   TRP  27           HA       TRP  27   6.293  -6.093  -0.626
  194   1HB   TRP  27          2HB       TRP  27   5.479  -6.693  -2.796
  195   2HB   TRP  27          1HB       TRP  27   4.458  -5.379  -2.257
  196    HD1  TRP  27           HD1      TRP  27   5.356  -2.895  -3.277
  197    HE1  TRP  27           HE1      TRP  27   6.485  -2.278  -5.531
  198    HE3  TRP  27           HE3      TRP  27   6.436  -7.602  -4.951
  199    HZ2  TRP  27           HZ2      TRP  27   7.968  -3.675  -7.576
  200    HZ3  TRP  27           HZ3      TRP  27   7.582  -7.914  -7.100
  201    HH2  TRP  27           HH2      TRP  27   8.350  -5.967  -8.429
  202    H    ALA  28           H        ALA  28   7.436  -7.321  -2.639
  203    HA   ALA  28           HA       ALA  28   9.603  -6.032  -3.914
  204   1HB   ALA  28          1HB       ALA  28  10.708  -6.170  -1.683
  205   2HB   ALA  28          2HB       ALA  28  10.371  -7.922  -1.644
  206   3HB   ALA  28          3HB       ALA  28  11.480  -7.251  -2.855
  207    HA   PRO  29           HA       PRO  29   8.746  -9.641  -6.411
  208   1HB   PRO  29          1HB       PRO  29  11.260 -10.251  -7.464
  209   2HB   PRO  29          2HB       PRO  29  10.134  -8.996  -8.068
  210   1HG   PRO  29          1HG       PRO  29  12.473  -8.625  -6.171
  211   2HG   PRO  29          2HG       PRO  29  12.056  -7.646  -7.609
  212   1HD   PRO  29          2HD       PRO  29  11.313  -6.732  -5.203
  213   2HD   PRO  29          1HD       PRO  29  10.137  -6.727  -6.509
  214    H    TRP  30           H        TRP  30  11.723 -10.004  -4.408
  215    HA   TRP  30           HA       TRP  30  11.586 -12.859  -4.319
  216   1HB   TRP  30          1HB       TRP  30  13.128 -12.623  -2.410
  217   2HB   TRP  30          2HB       TRP  30  13.623 -11.706  -3.825
  218    HD1  TRP  30           HD1      TRP  30  14.135  -9.223  -3.499
  219    HE1  TRP  30           HE1      TRP  30  14.051  -7.554  -1.526
  220    HE3  TRP  30           HE3      TRP  30  11.658 -12.103  -0.050
  221    HZ2  TRP  30           HZ2      TRP  30  12.973  -7.446   1.111
  222    HZ3  TRP  30           HZ3      TRP  30  11.028 -11.146   2.139
  223    HH2  TRP  30           HH2      TRP  30  11.597  -8.794   2.696
  224    H    CYS  31           H        CYS  31   9.626 -10.456  -2.706
  225    HA   CYS  31           HA       CYS  31   9.127 -12.072  -0.305
  226   1HB   CYS  31          2HB       CYS  31   9.121  -9.679  -0.101
  227   2HB   CYS  31          1HB       CYS  31   7.885  -9.525  -1.352
  228    H    GLY  32           H        GLY  32   8.497 -14.013  -1.441
  229   1HA   GLY  32          1HA       GLY  32   6.378 -14.560  -3.057
  230   2HA   GLY  32          2HA       GLY  32   6.741 -15.556  -1.643
  231    HA   PRO  33           HA       PRO  33   3.066 -14.316   0.458
  232   1HB   PRO  33          1HB       PRO  33   4.418 -12.386   2.329
  233   2HB   PRO  33          2HB       PRO  33   3.289 -13.720   2.714
  234   1HG   PRO  33          1HG       PRO  33   5.892 -13.995   3.161
  235   2HG   PRO  33          2HG       PRO  33   4.981 -15.347   2.415
  236   1HD   PRO  33          1HD       PRO  33   6.745 -13.331   1.012
  237   2HD   PRO  33          2HD       PRO  33   6.641 -15.097   0.757
  238    H    CYS  34           H        CYS  34   5.078 -11.605  -0.598
  239    HA   CYS  34           HA       CYS  34   2.895  -9.637  -0.547
  240   1HB   CYS  34          2HB       CYS  34   5.535  -9.419  -2.037
  241   2HB   CYS  34          1HB       CYS  34   4.350  -8.184  -1.645
  242    H    ARG  35           HN       ARG  35   4.873 -11.420  -2.880
  243    HA   ARG  35           HA       ARG  35   3.813 -10.766  -5.326
  244   1HB   ARG  35          2HB       ARG  35   5.747 -12.360  -4.574
  245   2HB   ARG  35          1HB       ARG  35   4.528 -13.632  -4.605
  246   1HG   ARG  35          2HG       ARG  35   4.041 -12.981  -7.020
  247   2HG   ARG  35          1HG       ARG  35   5.445 -11.897  -6.932
  248   1HD   ARG  35          2HD       ARG  35   5.396 -14.906  -6.515
  249   2HD   ARG  35          1HD       ARG  35   6.114 -14.059  -7.894
  250    HE   ARG  35           HE       ARG  35   7.606 -12.933  -6.069
  251   1HH1  ARG  35          2HH2      ARG  35   6.683 -16.369  -6.074
  252   2HH1  ARG  35          1HH2      ARG  35   7.989 -16.826  -5.017
  253   1HH2  ARG  35          1HH1      ARG  35   9.243 -13.520  -4.782
  254   2HH2  ARG  35          2HH1      ARG  35   9.486 -15.161  -4.221
  255    H    ILE  36           H        ILE  36   2.659 -13.363  -3.140
  256    HA   ILE  36           HA       ILE  36   0.491 -14.078  -4.920
  257    HB   ILE  36           HB       ILE  36  -0.295 -15.545  -3.127
  258   1HG1  ILE  36          2HG1      ILE  36   1.519 -15.712  -1.161
  259   2HG1  ILE  36          1HG1      ILE  36   1.641 -13.978  -1.440
  260   1HG2  ILE  36          1HG2      ILE  36   1.659 -16.990  -3.127
  261   2HG2  ILE  36          2HG2      ILE  36   1.513 -16.189  -4.697
  262   3HG2  ILE  36          3HG2      ILE  36   2.728 -15.635  -3.529
  263   1HD1  ILE  36          1HD1      ILE  36  -0.851 -15.597  -0.730
  264   2HD1  ILE  36          2HD1      ILE  36   0.001 -14.441   0.312
  265   3HD1  ILE  36          3HD1      ILE  36  -0.896 -13.868  -1.107
  266    H    ILE  37           H        ILE  37   0.595 -11.479  -2.449
  267    HA   ILE  37           HA       ILE  37  -2.387 -11.352  -2.563
  268    HB   ILE  37           HB       ILE  37  -2.219  -9.452  -1.078
  269   1HG1  ILE  37          2HG1      ILE  37   0.734 -10.017  -0.773
  270   2HG1  ILE  37          1HG1      ILE  37   0.125  -8.713  -1.811
  271   1HG2  ILE  37          1HG2      ILE  37  -1.668 -10.723   0.917
  272   2HG2  ILE  37          2HG2      ILE  37  -2.394 -11.825  -0.253
  273   3HG2  ILE  37          3HG2      ILE  37  -0.635 -11.826  -0.008
  274   1HD1  ILE  37          1HD1      ILE  37  -1.026  -7.711   0.111
  275   2HD1  ILE  37          2HD1      ILE  37   0.736  -7.794   0.307
  276   3HD1  ILE  37          3HD1      ILE  37  -0.298  -8.940   1.180
  277    H    ALA  38           H        ALA  38   0.460  -9.893  -3.993
  278    HA   ALA  38           HA       ALA  38  -0.230  -7.492  -4.940
  279   1HB   ALA  38          1HB       ALA  38   1.216  -7.923  -6.855
  280   2HB   ALA  38          2HB       ALA  38   0.971  -9.661  -6.715
  281   3HB   ALA  38          3HB       ALA  38   1.852  -8.780  -5.448
  282    HA   PRO  39           HA       PRO  39  -2.891  -8.993  -8.668
  283   1HB   PRO  39          1HB       PRO  39  -4.117 -11.563  -7.838
  284   2HB   PRO  39          2HB       PRO  39  -3.293 -11.170  -9.368
  285   1HG   PRO  39          2HG       PRO  39  -2.148 -12.848  -7.517
  286   2HG   PRO  39          1HG       PRO  39  -1.155 -11.676  -8.440
  287   1HD   PRO  39          2HD       PRO  39  -2.381 -11.293  -5.700
  288   2HD   PRO  39          1HD       PRO  39  -0.710 -11.118  -6.079
  289    H    VAL  40           H        VAL  40  -3.669  -9.877  -5.385
  290    HA   VAL  40           HA       VAL  40  -6.505  -9.294  -5.437
  291    HB   VAL  40           HB       VAL  40  -4.597 -10.807  -3.885
  292   1HG1  VAL  40          1HG1      VAL  40  -4.315  -8.957  -2.344
  293   2HG1  VAL  40          2HG1      VAL  40  -5.154 -10.330  -1.632
  294   3HG1  VAL  40          3HG1      VAL  40  -6.068  -8.871  -2.120
  295   1HG2  VAL  40          1HG2      VAL  40  -7.585 -10.544  -3.673
  296   2HG2  VAL  40          2HG2      VAL  40  -6.666 -11.660  -4.693
  297   3HG2  VAL  40          3HG2      VAL  40  -6.584 -11.810  -2.930
  298    H    VAL  41           H        VAL  41  -3.427  -7.730  -4.454
  299    HA   VAL  41           HA       VAL  41  -4.571  -5.338  -3.369
  300    HB   VAL  41           HB       VAL  41  -1.930  -5.708  -4.852
  301   1HG1  VAL  41          1HG1      VAL  41  -0.901  -5.898  -2.646
  302   2HG1  VAL  41          2HG1      VAL  41  -2.483  -5.729  -1.853
  303   3HG1  VAL  41          3HG1      VAL  41  -2.111  -7.162  -2.814
  304   1HG2  VAL  41          1HG2      VAL  41  -2.498  -3.342  -4.745
  305   2HG2  VAL  41          2HG2      VAL  41  -1.213  -3.690  -3.588
  306   3HG2  VAL  41          3HG2      VAL  41  -2.877  -3.477  -3.013
  307    H    ASP  42           HN       ASP  42  -3.580  -6.269  -6.685
  308    HA   ASP  42           HA       ASP  42  -4.438  -3.907  -8.030
  309   1HB   ASP  42          1HB       ASP  42  -4.025  -6.791  -8.800
  310   2HB   ASP  42          2HB       ASP  42  -4.885  -5.757  -9.925
  311    H    GLU  43           HN       GLU  43  -6.293  -6.987  -7.525
  312    HA   GLU  43           HA       GLU  43  -8.727  -6.151  -8.596
  313   1HB   GLU  43          2HB       GLU  43  -8.303  -8.432  -7.543
  314   2HB   GLU  43          1HB       GLU  43  -8.338  -7.573  -5.972
  315   1HG   GLU  43          1HG       GLU  43 -10.392  -8.749  -6.297
  316   2HG   GLU  43          2HG       GLU  43 -10.592  -7.003  -6.080
  317    H    ILE  44           H        ILE  44  -7.492  -5.642  -5.280
  318    HA   ILE  44           HA       ILE  44  -9.798  -4.296  -4.281
  319    HB   ILE  44           HB       ILE  44  -6.898  -4.276  -3.382
  320   1HG1  ILE  44          1HG1      ILE  44  -9.320  -5.486  -1.975
  321   2HG1  ILE  44          2HG1      ILE  44  -8.540  -6.374  -3.263
  322   1HG2  ILE  44          1HG2      ILE  44  -7.940  -2.217  -2.603
  323   2HG2  ILE  44          2HG2      ILE  44  -7.927  -3.354  -1.239
  324   3HG2  ILE  44          3HG2      ILE  44  -9.415  -3.130  -2.189
  325   1HD1  ILE  44          1HD1      ILE  44  -7.251  -5.422  -0.672
  326   2HD1  ILE  44          2HD1      ILE  44  -6.332  -6.136  -2.010
  327   3HD1  ILE  44          3HD1      ILE  44  -7.552  -7.090  -1.165
  328    H    ALA  45           H        ALA  45  -6.884  -3.066  -5.974
  329    HA   ALA  45           HA       ALA  45  -7.472  -0.302  -5.769
  330   1HB   ALA  45          1HB       ALA  45  -6.428  -1.645  -8.286
  331   2HB   ALA  45          2HB       ALA  45  -5.423  -1.408  -6.851
  332   3HB   ALA  45          3HB       ALA  45  -6.119  -0.014  -7.723
  333    H    GLY  46           H        GLY  46  -8.986  -2.880  -7.718
  334   1HA   GLY  46          1HA       GLY  46 -10.465  -1.085  -9.480
  335   2HA   GLY  46          2HA       GLY  46 -10.698  -2.829  -9.237
  336    H    GLU  47           HN       GLU  47 -11.200  -3.276  -6.692
  337    HA   GLU  47           HA       GLU  47 -13.861  -2.596  -6.303
  338   1HB   GLU  47          2HB       GLU  47 -11.836  -3.065  -4.061
  339   2HB   GLU  47          1HB       GLU  47 -13.588  -3.207  -3.971
  340   1HG   GLU  47          2HG       GLU  47 -13.301  -4.920  -5.973
  341   2HG   GLU  47          1HG       GLU  47 -11.632  -4.989  -5.451
  342    H    TYR  48           H        TYR  48 -11.125  -0.825  -4.884
  343    HA   TYR  48           HA       TYR  48 -13.025   1.335  -3.985
  344   1HB   TYR  48          1HB       TYR  48 -10.167   0.811  -3.134
  345   2HB   TYR  48          2HB       TYR  48 -11.313   1.924  -2.382
  346    HD1  TYR  48           HD1      TYR  48 -13.795   0.368  -2.127
  347    HD2  TYR  48           HD2      TYR  48  -9.695  -0.817  -1.481
  348    HE1  TYR  48           HE1      TYR  48 -14.561  -1.503  -0.726
  349    HE2  TYR  48           HE2      TYR  48 -10.484  -2.716  -0.082
  350    HH   TYR  48           HH       TYR  48 -13.947  -3.333   0.508
  351    H    LYS  49           HN       LYS  49 -11.789   1.008  -6.796
  352    HA   LYS  49           HA       LYS  49  -9.897   2.913  -7.357
  353   1HB   LYS  49          2HB       LYS  49 -10.977   1.359  -8.989
  354   2HB   LYS  49          1HB       LYS  49 -12.463   2.301  -8.907
  355   1HG   LYS  49          2HG       LYS  49 -11.206   2.761 -10.933
  356   2HG   LYS  49          1HG       LYS  49 -11.324   4.227  -9.947
  357   1HD   LYS  49          1HD       LYS  49  -9.021   4.023  -9.222
  358   2HD   LYS  49          2HD       LYS  49  -8.909   2.364  -9.832
  359   1HE   LYS  49          2HE       LYS  49  -7.738   3.937 -11.320
  360   2HE   LYS  49          1HE       LYS  49  -9.090   3.158 -12.155
  361   1HZ   LYS  49          1HZ       LYS  49  -9.137   5.849 -10.975
  362   2HZ   LYS  49          2HZ       LYS  49 -10.381   5.130 -11.782
  363   3HZ   LYS  49          3HZ       LYS  49  -8.990   5.505 -12.580
  364    H    ASP  50           HN       ASP  50 -13.317   3.424  -6.767
  365    HA   ASP  50           HA       ASP  50 -13.680   6.113  -7.460
  366   1HB   ASP  50          2HB       ASP  50 -15.517   4.636  -6.930
  367   2HB   ASP  50          1HB       ASP  50 -14.925   4.343  -5.301
  368    H    LYS  51           HN       LYS  51 -13.338   4.971  -4.130
  369    HA   LYS  51           HA       LYS  51 -12.698   7.659  -3.205
  370   1HB   LYS  51          1HB       LYS  51 -12.918   6.675  -1.009
  371   2HB   LYS  51          2HB       LYS  51 -14.304   6.290  -2.016
  372   1HG   LYS  51          2HG       LYS  51 -12.866   3.998  -2.417
  373   2HG   LYS  51          1HG       LYS  51 -12.151   4.527  -0.896
  374   1HD   LYS  51          2HD       LYS  51 -13.898   3.062  -0.288
  375   2HD   LYS  51          1HD       LYS  51 -14.517   4.680   0.060
  376   1HE   LYS  51          1HE       LYS  51 -15.824   4.651  -2.050
  377   2HE   LYS  51          2HE       LYS  51 -15.133   3.072  -2.469
  378   1HZ   LYS  51          1HZ       LYS  51 -16.194   2.157  -0.545
  379   2HZ   LYS  51          2HZ       LYS  51 -17.311   2.921  -1.479
  380   3HZ   LYS  51          3HZ       LYS  51 -16.771   3.611  -0.083
  381    H    LEU  52           H        LEU  52 -10.650   4.921  -4.015
  382    HA   LEU  52           HA       LEU  52  -8.535   6.051  -2.203
  383   1HB   LEU  52          1HB       LEU  52 -10.084   3.920  -1.576
  384   2HB   LEU  52          2HB       LEU  52  -8.898   3.094  -2.591
  385    HG   LEU  52           HG       LEU  52  -7.175   4.382  -0.979
  386   1HD1  LEU  52          1HD1      LEU  52  -9.012   5.723   0.090
  387   2HD1  LEU  52          2HD1      LEU  52  -9.785   4.217   0.627
  388   3HD1  LEU  52          3HD1      LEU  52  -8.212   4.673   1.286
  389   1HD2  LEU  52          1HD2      LEU  52  -7.412   1.931  -1.101
  390   2HD2  LEU  52          2HD2      LEU  52  -8.881   2.000  -0.103
  391   3HD2  LEU  52          3HD2      LEU  52  -7.311   2.460   0.592
  392    H    LYS  53           HN       LYS  53  -6.507   6.132  -3.007
  393    HA   LYS  53           HA       LYS  53  -5.980   5.075  -5.714
  394   1HB   LYS  53          2HB       LYS  53  -4.951   7.213  -4.127
  395   2HB   LYS  53          1HB       LYS  53  -3.674   6.021  -4.186
  396   1HG   LYS  53          1HG       LYS  53  -5.038   7.175  -6.646
  397   2HG   LYS  53          2HG       LYS  53  -3.484   7.685  -5.967
  398   1HD   LYS  53          2HD       LYS  53  -2.668   5.283  -6.236
  399   2HD   LYS  53          1HD       LYS  53  -4.141   4.964  -7.183
  400   1HE   LYS  53          1HE       LYS  53  -3.500   6.704  -8.801
  401   2HE   LYS  53          2HE       LYS  53  -2.051   7.077  -7.848
  402   1HZ   LYS  53          1HZ       LYS  53  -2.636   4.495  -9.119
  403   2HZ   LYS  53          2HZ       LYS  53  -1.560   5.621  -9.658
  404   3HZ   LYS  53          3HZ       LYS  53  -1.295   4.846  -8.227
  405    H    CYS  54           H        CYS  54  -4.336   3.316  -5.953
  406    HA   CYS  54           HA       CYS  54  -3.644   1.842  -3.477
  407   1HB   CYS  54          1HB       CYS  54  -5.727   0.817  -4.350
  408   2HB   CYS  54          2HB       CYS  54  -4.923   0.632  -5.930
  409    HG   CYS  54           HG       CYS  54  -4.928  -1.703  -4.775
  410    H    VAL  55           H        VAL  55  -1.599   0.979  -3.586
  411    HA   VAL  55           HA       VAL  55  -0.171   0.967  -6.142
  412    HB   VAL  55           HB       VAL  55   1.393   2.491  -4.163
  413   1HG1  VAL  55          1HG1      VAL  55  -0.752   3.421  -3.418
  414   2HG1  VAL  55          2HG1      VAL  55   0.313   4.605  -4.185
  415   3HG1  VAL  55          3HG1      VAL  55  -1.074   3.979  -5.084
  416   1HG2  VAL  55          1HG2      VAL  55   1.989   2.349  -6.511
  417   2HG2  VAL  55          2HG2      VAL  55   1.652   4.029  -6.072
  418   3HG2  VAL  55          3HG2      VAL  55   0.444   3.105  -6.981
  419    H    LYS  56           HN       LYS  56   2.039   0.261  -5.964
  420    HA   LYS  56           HA       LYS  56   2.601  -1.456  -3.591
  421   1HB   LYS  56          1HB       LYS  56   3.314  -1.965  -6.489
  422   2HB   LYS  56          2HB       LYS  56   3.446  -3.077  -5.102
  423   1HG   LYS  56          2HG       LYS  56   0.898  -2.889  -4.880
  424   2HG   LYS  56          1HG       LYS  56   0.933  -2.057  -6.450
  425   1HD   LYS  56          2HD       LYS  56   2.316  -4.134  -7.259
  426   2HD   LYS  56          1HD       LYS  56   1.674  -4.921  -5.800
  427   1HE   LYS  56          1HE       LYS  56  -0.656  -4.225  -6.579
  428   2HE   LYS  56          2HE       LYS  56   0.100  -3.613  -8.072
  429   1HZ   LYS  56          1HZ       LYS  56  -0.704  -5.761  -8.468
  430   2HZ   LYS  56          2HZ       LYS  56   0.938  -5.894  -8.391
  431   3HZ   LYS  56          3HZ       LYS  56  -0.008  -6.374  -7.120
  432    H    LEU  57           H        LEU  57   4.391  -0.757  -2.518
  433    HA   LEU  57           HA       LEU  57   6.399   0.933  -3.946
  434   1HB   LEU  57          1HB       LEU  57   5.428   1.974  -2.015
  435   2HB   LEU  57          2HB       LEU  57   5.785   0.560  -0.997
  436    HG   LEU  57           HG       LEU  57   8.176   1.036  -1.155
  437   1HD1  LEU  57          1HD2      LEU  57   8.446   1.952  -3.361
  438   2HD1  LEU  57          2HD2      LEU  57   7.258   3.247  -3.062
  439   3HD1  LEU  57          3HD2      LEU  57   8.818   3.281  -2.241
  440   1HD2  LEU  57          1HD1      LEU  57   6.547   2.286   0.409
  441   2HD2  LEU  57          2HD1      LEU  57   6.762   3.668  -0.655
  442   3HD2  LEU  57          3HD1      LEU  57   8.168   2.998   0.196
  443    H    ASN  58           H        ASN  58   8.150  -0.062  -4.686
  444    HA   ASN  58           HA       ASN  58   8.846  -2.757  -3.783
  445   1HB   ASN  58          1HB       ASN  58   9.224  -2.039  -6.104
  446   2HB   ASN  58          2HB       ASN  58  10.429  -0.873  -5.550
  447   1HD2  ASN  58          2HD2      ASN  58  10.190  -3.892  -6.885
  448   2HD2  ASN  58          1HD2      ASN  58  11.656  -4.599  -6.225
  449    H    THR  59           H        THR  59   9.690  -3.110  -1.930
  450    HA   THR  59           HA       THR  59  10.653  -1.120  -0.128
  451    HB   THR  59           HB       THR  59  10.812  -4.173  -0.104
  452    HG1  THR  59           HG1      THR  59   8.723  -3.500  -0.259
  453   1HG2  THR  59          1HG2      THR  59  11.076  -2.137   2.133
  454   2HG2  THR  59          2HG2      THR  59  10.892  -3.899   2.354
  455   3HG2  THR  59          3HG2      THR  59  12.333  -3.257   1.553
  456    H    ASP  60           HN       ASP  60  12.254  -3.513  -2.196
  457    HA   ASP  60           HA       ASP  60  14.905  -3.241  -1.040
  458   1HB   ASP  60          2HB       ASP  60  14.259  -5.270  -2.101
  459   2HB   ASP  60          1HB       ASP  60  13.682  -4.436  -3.529
  460    H    GLU  61           HN       GLU  61  13.080  -1.758  -3.660
  461    HA   GLU  61           HA       GLU  61  15.274  -0.098  -4.624
  462   1HB   GLU  61          2HB       GLU  61  13.195  -1.050  -5.891
  463   2HB   GLU  61          1HB       GLU  61  12.315   0.305  -5.138
  464   1HG   GLU  61          2HG       GLU  61  13.940   1.881  -6.227
  465   2HG   GLU  61          1HG       GLU  61  14.786   0.482  -6.881
  466    H    SER  62           H        SER  62  12.730   0.141  -2.241
  467    HA   SER  62           HA       SER  62  13.378   2.993  -1.663
  468   1HB   SER  62          1HB       SER  62  10.685   1.714  -1.121
  469   2HB   SER  62          2HB       SER  62  11.178   3.414  -1.273
  470    HG   SER  62           HG       SER  62  10.939   1.375  -3.233
  471    HA   PRO  63           HA       PRO  63  13.987   0.242   2.156
  472   1HB   PRO  63          1HB       PRO  63  16.671   0.654   2.557
  473   2HB   PRO  63          2HB       PRO  63  16.026  -0.633   1.498
  474   1HG   PRO  63          1HG       PRO  63  17.032   2.099   0.663
  475   2HG   PRO  63          2HG       PRO  63  17.433   0.510  -0.053
  476   1HD   PRO  63          1HD       PRO  63  15.510   2.096  -1.157
  477   2HD   PRO  63          2HD       PRO  63  15.275   0.338  -1.067
  478    H    ASN  64           H        ASN  64  15.043   3.337   1.008
  479    HA   ASN  64           HA       ASN  64  15.562   4.924   3.238
  480   1HB   ASN  64          1HB       ASN  64  14.154   6.694   1.796
  481   2HB   ASN  64          2HB       ASN  64  15.775   6.167   1.372
  482   1HD2  ASN  64          2HD2      ASN  64  16.039   5.695  -0.761
  483   2HD2  ASN  64          1HD2      ASN  64  14.811   4.950  -1.761
  484    H    VAL  65           H        VAL  65  12.400   5.022   1.711
  485    HA   VAL  65           HA       VAL  65  10.958   6.169   3.794
  486    HB   VAL  65           HB       VAL  65  10.072   4.223   1.614
  487   1HG1  VAL  65          1HG2      VAL  65   8.352   4.356   3.414
  488   2HG1  VAL  65          2HG2      VAL  65   7.825   5.114   1.910
  489   3HG1  VAL  65          3HG2      VAL  65   8.367   6.126   3.272
  490   1HG2  VAL  65          1HG1      VAL  65  11.120   6.298   0.751
  491   2HG2  VAL  65          2HG1      VAL  65  10.070   7.274   1.785
  492   3HG2  VAL  65          3HG1      VAL  65   9.381   6.317   0.453
  493    H    ALA  66           H        ALA  66  11.282   2.728   3.039
  494    HA   ALA  66           HA       ALA  66   9.693   1.717   5.164
  495   1HB   ALA  66          1HB       ALA  66  10.430   0.354   3.271
  496   2HB   ALA  66          2HB       ALA  66  10.869  -0.400   4.818
  497   3HB   ALA  66          3HB       ALA  66  12.114   0.428   3.857
  498    H    SER  67           H        SER  67  13.176   2.612   5.176
  499    HA   SER  67           HA       SER  67  13.657   1.605   7.848
  500   1HB   SER  67          2HB       SER  67  15.195   3.662   6.197
  501   2HB   SER  67          1HB       SER  67  15.745   2.902   7.702
  502    HG   SER  67           HG       SER  67  15.117   1.588   5.267
  503    H    GLU  68           HN       GLU  68  12.905   4.787   6.439
  504    HA   GLU  68           HA       GLU  68  12.975   6.342   8.827
  505   1HB   GLU  68          1HB       GLU  68  11.237   6.584   6.331
  506   2HB   GLU  68          2HB       GLU  68  11.320   7.806   7.595
  507   1HG   GLU  68          2HG       GLU  68  13.615   8.293   7.147
  508   2HG   GLU  68          1HG       GLU  68  13.833   6.845   6.163
  509    H    TYR  69           H        TYR  69  10.359   4.431   7.345
  510    HA   TYR  69           HA       TYR  69   8.494   4.941   9.523
  511   1HB   TYR  69          1HB       TYR  69   8.527   3.487   6.904
  512   2HB   TYR  69          2HB       TYR  69   7.494   2.783   8.095
  513    HD1  TYR  69           HD1      TYR  69   7.900   5.498   5.727
  514    HD2  TYR  69           HD2      TYR  69   5.873   4.431   9.372
  515    HE1  TYR  69           HE1      TYR  69   6.486   7.537   5.546
  516    HE2  TYR  69           HE2      TYR  69   4.487   6.484   9.204
  517    HH   TYR  69           HH       TYR  69   4.147   8.446   8.074
  518    H    GLY  70           H        GLY  70  10.925   2.484   8.905
  519   1HA   GLY  70          2HA       GLY  70  11.876   1.050  10.438
  520   2HA   GLY  70          1HA       GLY  70  10.696   1.544  11.662
  521    H    ILE  71           H        ILE  71  10.318   0.168   8.363
  522    HA   ILE  71           HA       ILE  71   8.212  -1.618   9.249
  523    HB   ILE  71           HB       ILE  71   9.782  -1.433   6.648
  524   1HG1  ILE  71          2HG1      ILE  71   7.021  -0.473   7.577
  525   2HG1  ILE  71          1HG1      ILE  71   8.419   0.539   7.200
  526   1HG2  ILE  71          1HG2      ILE  71   7.977  -2.874   5.694
  527   2HG2  ILE  71          2HG2      ILE  71   8.915  -3.726   6.903
  528   3HG2  ILE  71          3HG2      ILE  71   7.314  -3.088   7.331
  529   1HD1  ILE  71          1HD1      ILE  71   6.749  -1.061   5.241
  530   2HD1  ILE  71          2HD1      ILE  71   8.326  -0.339   4.839
  531   3HD1  ILE  71          3HD1      ILE  71   6.971   0.688   5.361
  532    H    ARG  72           HN       ARG  72   8.349  -3.582  10.094
  533    HA   ARG  72           HA       ARG  72  10.924  -4.713  10.772
  534   1HB   ARG  72          2HB       ARG  72   8.980  -4.739  12.293
  535   2HB   ARG  72          1HB       ARG  72   8.074  -5.723  11.129
  536   1HG   ARG  72          2HG       ARG  72   9.782  -7.543  11.385
  537   2HG   ARG  72          1HG       ARG  72  10.650  -6.546  12.548
  538   1HD   ARG  72          2HD       ARG  72   9.185  -8.290  13.608
  539   2HD   ARG  72          1HD       ARG  72   8.829  -6.640  14.117
  540    HE   ARG  72           HE       ARG  72   6.725  -6.857  13.342
  541   1HH1  ARG  72          2HH1      ARG  72   8.661  -9.160  11.444
  542   2HH1  ARG  72          1HH1      ARG  72   7.278 -10.010  10.840
  543   1HH2  ARG  72          2HH2      ARG  72   4.932  -7.933  12.494
  544   2HH2  ARG  72          1HH2      ARG  72   5.127  -9.275  11.403
  545    H    SER  73           H        SER  73   8.251  -5.679   8.528
  546    HA   SER  73           HA       SER  73  10.049  -7.317   6.955
  547   1HB   SER  73          2HB       SER  73   7.712  -8.642   8.421
  548   2HB   SER  73          1HB       SER  73   8.816  -9.420   7.273
  549    HG   SER  73           HG       SER  73  10.400  -8.409   9.044
  550    H    ILE  74           H        ILE  74   8.552  -8.368   5.119
  551    HA   ILE  74           HA       ILE  74   6.311  -6.519   4.572
  552    HB   ILE  74           HB       ILE  74   7.029  -6.651   2.139
  553   1HG1  ILE  74          1HG1      ILE  74   9.772  -7.325   3.196
  554   2HG1  ILE  74          2HG1      ILE  74   8.684  -8.529   2.476
  555   1HG2  ILE  74          1HG2      ILE  74   8.877  -5.199   4.088
  556   2HG2  ILE  74          2HG2      ILE  74   8.489  -4.717   2.428
  557   3HG2  ILE  74          3HG2      ILE  74   7.239  -4.663   3.659
  558   1HD1  ILE  74          1HD1      ILE  74   8.481  -7.080   0.429
  559   2HD1  ILE  74          2HD1      ILE  74   9.726  -6.010   1.109
  560   3HD1  ILE  74          3HD1      ILE  74  10.109  -7.682   0.711
  561    HA   PRO  75           HA       PRO  75   4.910  -6.608   2.393
  562   1HB   PRO  75          2HB       PRO  75   2.209  -6.920   2.379
  563   2HB   PRO  75          1HB       PRO  75   3.290  -7.644   1.172
  564   1HG   PRO  75          1HG       PRO  75   2.158  -8.869   3.678
  565   2HG   PRO  75          2HG       PRO  75   2.191  -9.603   2.041
  566   1HD   PRO  75          1HD       PRO  75   4.048 -10.236   3.984
  567   2HD   PRO  75          2HD       PRO  75   4.493 -10.135   2.261
  568    H    THR  76           H        THR  76   4.052  -4.778   3.113
  569    HA   THR  76           HA       THR  76   2.819  -4.588   5.784
  570    HB   THR  76           HB       THR  76   5.430  -3.260   5.012
  571    HG1  THR  76           HG1      THR  76   5.740  -4.971   6.361
  572   1HG2  THR  76          1HG2      THR  76   3.328  -2.291   6.994
  573   2HG2  THR  76          2HG2      THR  76   4.132  -1.383   5.683
  574   3HG2  THR  76          3HG2      THR  76   5.046  -1.867   7.112
  575    H    ILE  77           H        ILE  77   0.927  -4.003   5.069
  576    HA   ILE  77           HA       ILE  77   0.602  -2.249   2.703
  577    HB   ILE  77           HB       ILE  77  -1.373  -3.839   4.383
  578   1HG1  ILE  77          2HG1      ILE  77  -0.692  -4.441   1.497
  579   2HG1  ILE  77          1HG1      ILE  77   0.348  -5.070   2.776
  580   1HG2  ILE  77          1HG2      ILE  77  -2.469  -1.878   3.404
  581   2HG2  ILE  77          2HG2      ILE  77  -2.956  -3.299   2.478
  582   3HG2  ILE  77          3HG2      ILE  77  -1.710  -2.209   1.835
  583   1HD1  ILE  77          1HD1      ILE  77  -2.642  -5.555   2.629
  584   2HD1  ILE  77          2HD1      ILE  77  -1.366  -6.713   2.211
  585   3HD1  ILE  77          3HD1      ILE  77  -1.542  -6.161   3.883
  586    H    MET  78           H        MET  78   0.554  -0.077   3.159
  587    HA   MET  78           HA       MET  78  -0.712   0.737   5.741
  588   1HB   MET  78          2HB       MET  78   1.682   2.149   4.552
  589   2HB   MET  78          1HB       MET  78   0.939   2.409   6.128
  590   1HG   MET  78          2HG       MET  78   1.584  -0.145   6.512
  591   2HG   MET  78          1HG       MET  78   2.678   0.172   5.170
  592   1HE   MET  78          1HE       MET  78   4.823   1.794   5.442
  593   2HE   MET  78          2HE       MET  78   3.654   3.105   5.763
  594   3HE   MET  78          3HE       MET  78   5.048   2.858   6.842
  595    H    VAL  79           H        VAL  79  -1.624   2.792   5.687
  596    HA   VAL  79           HA       VAL  79  -2.505   3.567   2.914
  597    HB   VAL  79           HB       VAL  79  -4.146   3.725   5.452
  598   1HG1  VAL  79          1HG1      VAL  79  -5.696   2.269   4.196
  599   2HG1  VAL  79          2HG1      VAL  79  -4.121   1.476   4.343
  600   3HG1  VAL  79          3HG1      VAL  79  -4.595   2.244   2.815
  601   1HG2  VAL  79          1HG2      VAL  79  -5.882   4.703   3.895
  602   2HG2  VAL  79          2HG2      VAL  79  -4.610   4.871   2.665
  603   3HG2  VAL  79          3HG2      VAL  79  -4.515   5.771   4.186
  604    H    PHE  80           H        PHE  80  -2.253   5.674   2.404
  605    HA   PHE  80           HA       PHE  80  -1.366   7.574   4.534
  606   1HB   PHE  80          2HB       PHE  80  -0.417   7.284   1.666
  607   2HB   PHE  80          1HB       PHE  80  -0.123   8.685   2.650
  608    HD1  PHE  80           HD1      PHE  80   0.490   4.981   2.621
  609    HD2  PHE  80           HD2      PHE  80   1.812   8.854   3.969
  610    HE1  PHE  80           HE1      PHE  80   2.549   3.964   3.551
  611    HE2  PHE  80           HE2      PHE  80   3.842   7.834   4.930
  612    HZ   PHE  80           HZ       PHE  80   4.197   5.372   4.786
  613    H    LYS  81           HN       LYS  81  -1.647   9.804   3.877
  614    HA   LYS  81           HA       LYS  81  -3.432  10.700   1.854
  615   1HB   LYS  81          2HB       LYS  81  -5.181  11.549   3.618
  616   2HB   LYS  81          1HB       LYS  81  -5.335   9.953   2.924
  617   1HG   LYS  81          1HG       LYS  81  -5.856   9.929   5.288
  618   2HG   LYS  81          2HG       LYS  81  -4.530   8.859   4.885
  619   1HD   LYS  81          2HD       LYS  81  -4.117   9.991   7.012
  620   2HD   LYS  81          1HD       LYS  81  -2.897  10.426   5.843
  621   1HE   LYS  81          1HE       LYS  81  -3.539  12.366   7.111
  622   2HE   LYS  81          2HE       LYS  81  -4.124  12.612   5.466
  623   1HZ   LYS  81          1HZ       LYS  81  -6.289  11.907   6.182
  624   2HZ   LYS  81          2HZ       LYS  81  -5.748  11.668   7.721
  625   3HZ   LYS  81          3HZ       LYS  81  -5.771  13.186   7.080
  626    H    GLY  82           H        GLY  82  -3.551  13.095   2.028
  627   1HA   GLY  82          2HA       GLY  82  -2.518  15.127   2.463
  628   2HA   GLY  82          1HA       GLY  82  -3.074  14.695   4.095
  629    H    GLY  83           H        GLY  83  -0.274  13.478   2.142
  630   1HA   GLY  83          2HA       GLY  83   1.957  13.501   2.570
  631   2HA   GLY  83          1HA       GLY  83   1.690  14.910   3.586
  632    H    LYS  84           HN       LYS  84  -0.023  12.041   4.668
  633    HA   LYS  84           HA       LYS  84   2.206  11.127   6.377
  634   1HB   LYS  84          2HB       LYS  84  -0.413  12.291   7.430
  635   2HB   LYS  84          1HB       LYS  84   0.729  11.350   8.402
  636   1HG   LYS  84          1HG       LYS  84   2.519  13.069   7.718
  637   2HG   LYS  84          2HG       LYS  84   1.176  14.094   7.191
  638   1HD   LYS  84          1HD       LYS  84   1.556  12.908   9.987
  639   2HD   LYS  84          2HD       LYS  84   1.954  14.564   9.507
  640   1HE   LYS  84          1HE       LYS  84  -0.457  14.941   8.888
  641   2HE   LYS  84          2HE       LYS  84  -0.841  13.315   9.488
  642   1HZ   LYS  84          1HZ       LYS  84  -0.063  13.983  11.636
  643   2HZ   LYS  84          2HZ       LYS  84  -1.273  14.974  11.118
  644   3HZ   LYS  84          3HZ       LYS  84   0.289  15.497  11.085
  645    H    LYS  85           HN       LYS  85   1.350   9.362   7.856
  646    HA   LYS  85           HA       LYS  85   0.045   7.335   6.177
  647   1HB   LYS  85          1HB       LYS  85   2.201   6.970   7.419
  648   2HB   LYS  85          2HB       LYS  85   1.284   7.086   8.933
  649   1HG   LYS  85          1HG       LYS  85  -0.051   5.074   8.237
  650   2HG   LYS  85          2HG       LYS  85   0.777   5.088   6.671
  651   1HD   LYS  85          1HD       LYS  85   1.711   3.387   8.041
  652   2HD   LYS  85          2HD       LYS  85   2.933   4.651   7.859
  653   1HE   LYS  85          1HE       LYS  85   2.336   5.493  10.151
  654   2HE   LYS  85          2HE       LYS  85   1.077   4.251  10.269
  655   1HZ   LYS  85          1HZ       LYS  85   3.956   3.758   9.997
  656   2HZ   LYS  85          2HZ       LYS  85   3.068   3.592  11.374
  657   3HZ   LYS  85          3HZ       LYS  85   2.794   2.596  10.089
  658    H    CYS  86           H        CYS  86  -1.632   6.006   7.134
  659    HA   CYS  86           HA       CYS  86  -3.359   7.247   9.243
  660   1HB   CYS  86          2HB       CYS  86  -4.300   7.677   6.989
  661   2HB   CYS  86          1HB       CYS  86  -4.270   5.955   6.622
  662    HG   CYS  86           HG       CYS  86  -6.693   6.485   7.191
  663    H    GLU  87           HN       GLU  87  -3.064   4.326   7.216
  664    HA   GLU  87           HA       GLU  87  -3.540   2.593   9.629
  665   1HB   GLU  87          1HB       GLU  87  -4.044   1.852   6.730
  666   2HB   GLU  87          2HB       GLU  87  -4.536   0.973   8.173
  667   1HG   GLU  87          2HG       GLU  87  -6.133   2.754   8.765
  668   2HG   GLU  87          1HG       GLU  87  -5.596   3.728   7.395
  669    H    THR  88           H        THR  88  -2.473   0.458   9.549
  670    HA   THR  88           HA       THR  88  -0.288  -0.017   7.718
  671    HB   THR  88           HB       THR  88   0.876   1.447   9.223
  672    HG1  THR  88           HG1      THR  88   2.415  -0.070   9.987
  673   1HG2  THR  88          1HG2      THR  88  -0.029  -0.338  11.534
  674   2HG2  THR  88          2HG2      THR  88   1.090   1.030  11.634
  675   3HG2  THR  88          3HG2      THR  88  -0.606   1.315  11.227
  676    H    ILE  89           H        ILE  89  -0.225  -2.189   7.372
  677    HA   ILE  89           HA       ILE  89  -1.226  -4.066   9.447
  678    HB   ILE  89           HB       ILE  89  -1.963  -4.284   6.500
  679   1HG1  ILE  89          2HG1      ILE  89  -3.755  -3.100   8.658
  680   2HG1  ILE  89          1HG1      ILE  89  -3.006  -2.195   7.329
  681   1HG2  ILE  89          1HG2      ILE  89  -3.125  -5.539   9.029
  682   2HG2  ILE  89          2HG2      ILE  89  -3.573  -5.923   7.356
  683   3HG2  ILE  89          3HG2      ILE  89  -1.963  -6.331   7.944
  684   1HD1  ILE  89          1HD1      ILE  89  -4.164  -3.671   5.678
  685   2HD1  ILE  89          2HD1      ILE  89  -5.205  -2.608   6.636
  686   3HD1  ILE  89          3HD1      ILE  89  -5.120  -4.333   7.028
  687    H    ILE  90           H        ILE  90   0.518  -5.410   9.790
  688    HA   ILE  90           HA       ILE  90   2.524  -5.796   7.619
  689    HB   ILE  90           HB       ILE  90   2.715  -6.357  10.604
  690   1HG1  ILE  90          2HG1      ILE  90   3.724  -4.012   8.923
  691   2HG1  ILE  90          1HG1      ILE  90   2.503  -3.949  10.198
  692   1HG2  ILE  90          1HG2      ILE  90   4.813  -6.361   8.377
  693   2HG2  ILE  90          2HG2      ILE  90   4.204  -7.789   9.233
  694   3HG2  ILE  90          3HG2      ILE  90   5.151  -6.596  10.101
  695   1HD1  ILE  90          1HD1      ILE  90   5.470  -4.452  10.559
  696   2HD1  ILE  90          2HD1      ILE  90   4.258  -4.713  11.842
  697   3HD1  ILE  90          3HD1      ILE  90   4.494  -3.100  11.139
  698    H    GLY  91           H        GLY  91   2.879  -7.779   6.757
  699   1HA   GLY  91          2HA       GLY  91   2.980 -10.145   6.825
  700   2HA   GLY  91          1HA       GLY  91   1.625 -10.214   7.961
  701    H    ALA  92           H        ALA  92   1.967 -11.557   5.304
  702    HA   ALA  92           HA       ALA  92   0.233 -10.247   3.396
  703   1HB   ALA  92          1HB       ALA  92   1.145 -13.142   3.648
  704   2HB   ALA  92          2HB       ALA  92   1.966 -11.841   2.753
  705   3HB   ALA  92          3HB       ALA  92   0.371 -12.408   2.227
  706    H    VAL  93           H        VAL  93  -1.489  -9.725   5.039
  707    HA   VAL  93           HA       VAL  93  -3.183 -11.921   5.869
  708    HB   VAL  93           HB       VAL  93  -4.740 -10.245   6.619
  709   1HG1  VAL  93          1HG2      VAL  93  -2.928  -8.136   5.354
  710   2HG1  VAL  93          2HG2      VAL  93  -4.339  -7.845   6.395
  711   3HG1  VAL  93          3HG2      VAL  93  -4.560  -8.569   4.811
  712   1HG2  VAL  93          1HG1      VAL  93  -3.352  -9.150   8.283
  713   2HG2  VAL  93          2HG1      VAL  93  -1.891  -9.430   7.322
  714   3HG2  VAL  93          3HG1      VAL  93  -2.776 -10.805   8.017
  715    HA   PRO  94           HA       PRO  94  -5.316 -12.420   2.009
  716   1HB   PRO  94          1HB       PRO  94  -7.830 -12.834   3.633
  717   2HB   PRO  94          2HB       PRO  94  -7.179 -13.854   2.317
  718   1HG   PRO  94          2HG       PRO  94  -6.879 -14.615   4.903
  719   2HG   PRO  94          1HG       PRO  94  -5.494 -14.746   3.776
  720   1HD   PRO  94          2HD       PRO  94  -6.043 -12.550   5.793
  721   2HD   PRO  94          1HD       PRO  94  -4.543 -13.460   5.469
  722    H    LYS  95           HN       LYS  95  -6.822 -11.432   0.581
  723    HA   LYS  95           HA       LYS  95  -7.358  -8.784   0.583
  724   1HB   LYS  95          2HB       LYS  95  -7.781 -10.106  -1.369
  725   2HB   LYS  95          1HB       LYS  95  -8.957 -11.134  -0.551
  726   1HG   LYS  95          2HG       LYS  95 -10.623  -9.456  -0.522
  727   2HG   LYS  95          1HG       LYS  95  -9.472  -8.165  -0.901
  728   1HD   LYS  95          2HD       LYS  95  -9.121  -9.059  -3.141
  729   2HD   LYS  95          1HD       LYS  95 -10.223 -10.417  -2.819
  730   1HE   LYS  95          2HE       LYS  95 -10.941  -7.443  -2.783
  731   2HE   LYS  95          1HE       LYS  95 -11.260  -8.550  -4.125
  732   1HZ   LYS  95          1HZ       LYS  95 -12.665  -9.825  -2.683
  733   2HZ   LYS  95          2HZ       LYS  95 -12.418  -8.762  -1.445
  734   3HZ   LYS  95          3HZ       LYS  95 -13.173  -8.263  -2.822
  735    H    ALA  96           H        ALA  96  -9.546 -11.284   1.785
  736    HA   ALA  96           HA       ALA  96 -11.759  -9.809   2.600
  737   1HB   ALA  96          1HB       ALA  96 -10.452 -12.123   4.105
  738   2HB   ALA  96          2HB       ALA  96 -11.603 -12.268   2.757
  739   3HB   ALA  96          3HB       ALA  96 -12.128 -11.566   4.300
  740    H    THR  97           H        THR  97  -8.656 -10.175   4.408
  741    HA   THR  97           HA       THR  97  -9.590  -8.749   6.741
  742    HB   THR  97           HB       THR  97  -6.734  -9.240   5.807
  743    HG1  THR  97           HG1      THR  97  -8.537 -10.965   7.158
  744   1HG2  THR  97          1HG2      THR  97  -6.952  -7.804   7.809
  745   2HG2  THR  97          2HG2      THR  97  -6.299  -9.392   8.250
  746   3HG2  THR  97          3HG2      THR  97  -8.000  -9.016   8.581
  747    H    ILE  98           H        ILE  98  -7.617  -7.968   3.847
  748    HA   ILE  98           HA       ILE  98  -6.929  -5.287   4.535
  749    HB   ILE  98           HB       ILE  98  -7.386  -6.517   1.760
  750   1HG1  ILE  98          2HG1      ILE  98  -4.838  -6.277   3.408
  751   2HG1  ILE  98          1HG1      ILE  98  -5.742  -7.764   3.089
  752   1HG2  ILE  98          1HG2      ILE  98  -5.855  -4.025   2.683
  753   2HG2  ILE  98          2HG2      ILE  98  -5.882  -4.636   1.022
  754   3HG2  ILE  98          3HG2      ILE  98  -7.359  -4.015   1.740
  755   1HD1  ILE  98          1HD1      ILE  98  -3.910  -7.756   1.597
  756   2HD1  ILE  98          2HD1      ILE  98  -5.377  -7.481   0.644
  757   3HD1  ILE  98          3HD1      ILE  98  -4.277  -6.133   1.000
  758    H    VAL  99           H        VAL  99  -9.574  -6.548   2.572
  759    HA   VAL  99           HA       VAL  99 -11.081  -4.321   1.935
  760    HB   VAL  99           HB       VAL  99 -11.680  -7.236   2.515
  761   1HG1  VAL  99          1HG1      VAL  99 -13.903  -7.079   1.567
  762   2HG1  VAL  99          2HG1      VAL  99 -13.803  -5.320   1.532
  763   3HG1  VAL  99          3HG1      VAL  99 -13.823  -6.182   3.081
  764   1HG2  VAL  99          1HG2      VAL  99 -11.865  -5.615  -0.057
  765   2HG2  VAL  99          2HG2      VAL  99 -11.939  -7.377   0.116
  766   3HG2  VAL  99          3HG2      VAL  99 -10.426  -6.509   0.447
  767    H    GLN 100           H        GLN 100 -11.755  -6.484   4.762
  768    HA   GLN 100           HA       GLN 100 -13.669  -4.777   5.943
  769   1HB   GLN 100          2HB       GLN 100 -11.758  -6.842   7.102
  770   2HB   GLN 100          1HB       GLN 100 -12.993  -6.031   8.081
  771   1HG   GLN 100          1HG       GLN 100 -14.786  -6.862   6.740
  772   2HG   GLN 100          2HG       GLN 100 -13.695  -7.512   5.511
  773   1HE2  GLN 100          1HE2      GLN 100 -12.131  -9.186   6.228
  774   2HE2  GLN 100          2HE2      GLN 100 -12.676 -10.357   7.442
  775    H    THR 101           H        THR 101 -10.137  -4.954   6.557
  776    HA   THR 101           HA       THR 101 -10.110  -3.090   8.673
  777    HB   THR 101           HB       THR 101  -7.885  -3.632   6.655
  778    HG1  THR 101           HG1      THR 101  -8.549  -5.511   7.665
  779   1HG2  THR 101          1HG2      THR 101  -7.907  -2.456   9.478
  780   2HG2  THR 101          2HG2      THR 101  -7.365  -1.646   7.990
  781   3HG2  THR 101          3HG2      THR 101  -6.447  -3.011   8.651
  782    H    VAL 102           H        VAL 102  -9.566  -2.461   5.124
  783    HA   VAL 102           HA       VAL 102  -9.272   0.381   5.627
  784    HB   VAL 102           HB       VAL 102  -8.453  -1.197   3.692
  785   1HG1  VAL 102          1HG2      VAL 102  -8.045   0.825   2.311
  786   2HG1  VAL 102          2HG2      VAL 102  -7.777   1.141   4.029
  787   3HG1  VAL 102          3HG2      VAL 102  -9.270   1.708   3.249
  788   1HG2  VAL 102          1HG1      VAL 102 -10.899  -0.067   2.314
  789   2HG2  VAL 102          2HG1      VAL 102 -10.584  -1.789   2.677
  790   3HG2  VAL 102          3HG1      VAL 102  -9.526  -0.905   1.573
  791    H    GLU 103           HN       GLU 103 -11.959  -1.654   4.535
  792    HA   GLU 103           HA       GLU 103 -13.837   0.336   3.976
  793   1HB   GLU 103          2HB       GLU 103 -14.110  -2.474   5.070
  794   2HB   GLU 103          1HB       GLU 103 -15.517  -1.439   4.846
  795   1HG   GLU 103          2HG       GLU 103 -15.021  -1.065   2.496
  796   2HG   GLU 103          1HG       GLU 103 -13.517  -1.982   2.622
  797    H    LYS 104           HN       LYS 104 -12.931  -0.909   7.173
  798    HA   LYS 104           HA       LYS 104 -14.802   0.320   8.830
  799   1HB   LYS 104          1HB       LYS 104 -12.852  -0.986   9.638
  800   2HB   LYS 104          2HB       LYS 104 -11.776   0.333   9.119
  801   1HG   LYS 104          1HG       LYS 104 -12.994   1.872  10.745
  802   2HG   LYS 104          2HG       LYS 104 -13.759   0.421  11.394
  803   1HD   LYS 104          1HD       LYS 104 -10.802   1.174  11.273
  804   2HD   LYS 104          2HD       LYS 104 -11.825   1.097  12.699
  805   1HE   LYS 104          1HE       LYS 104 -10.625  -0.885  12.893
  806   2HE   LYS 104          2HE       LYS 104 -12.097  -1.458  12.093
  807   1HZ   LYS 104          1HZ       LYS 104 -10.857  -1.312  10.001
  808   2HZ   LYS 104          2HZ       LYS 104  -9.525  -0.800  10.812
  809   3HZ   LYS 104          3HZ       LYS 104 -10.116  -2.315  11.077
  810    H    TYR 105           H        TYR 105 -12.018   1.819   7.180
  811    HA   TYR 105           HA       TYR 105 -12.539   4.458   8.391
  812   1HB   TYR 105          1HB       TYR 105 -10.345   3.501   6.517
  813   2HB   TYR 105          2HB       TYR 105 -10.401   5.002   7.422
  814    HD1  TYR 105           HD1      TYR 105 -10.142   5.069   9.904
  815    HD2  TYR 105           HD2      TYR 105  -9.571   1.506   7.579
  816    HE1  TYR 105           HE1      TYR 105  -8.734   4.108  11.713
  817    HE2  TYR 105           HE2      TYR 105  -8.190   0.525   9.383
  818    HH   TYR 105           HH       TYR 105  -7.178   0.908  11.434
  819    H    LEU 106           H        LEU 106 -12.539   2.852   5.182
  820    HA   LEU 106           HA       LEU 106 -14.136   5.122   4.063
  821   1HB   LEU 106          2HB       LEU 106 -11.695   3.776   2.830
  822   2HB   LEU 106          1HB       LEU 106 -12.962   4.551   1.886
  823    HG   LEU 106           HG       LEU 106 -12.506   6.567   3.663
  824   1HD1  LEU 106          1HD1      LEU 106 -11.219   7.588   1.797
  825   2HD1  LEU 106          2HD1      LEU 106 -12.691   6.765   1.267
  826   3HD1  LEU 106          3HD1      LEU 106 -11.122   5.993   1.018
  827   1HD2  LEU 106          1HD2      LEU 106 -10.634   5.335   4.741
  828   2HD2  LEU 106          2HD2      LEU 106 -10.104   6.835   3.966
  829   3HD2  LEU 106          3HD2      LEU 106  -9.793   5.267   3.180
  830    H    ASN 107           H        ASN 107 -15.865   3.889   4.609
  831    HA   ASN 107           HA       ASN 107 -16.369   1.231   3.554
  832   1HB   ASN 107          1HB       ASN 107 -18.738   1.701   4.163
  833   2HB   ASN 107          2HB       ASN 107 -17.590   1.882   5.488
  834   1HD2  ASN 107          1HD2      ASN 107 -17.923   4.512   3.068
  835   2HD2  ASN 107          2HD2      ASN 107 -18.752   5.599   4.189
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1  -8.357   2.288  -6.670
    2   2H    MET   1          2H        MET   1  -9.614   1.593  -7.449
    3   3H    MET   1          3H        MET   1  -9.823   3.018  -6.739
    4    HA   MET   1           HA       MET   1  -9.637   3.254  -9.111
    5   1HB   MET   1          1HB       MET   1  -8.559   4.985  -7.622
    6   2HB   MET   1          2HB       MET   1  -7.005   4.186  -7.849
    7   1HG   MET   1          2HG       MET   1  -7.258   6.087  -9.359
    8   2HG   MET   1          1HG       MET   1  -7.194   4.609 -10.314
    9   1HE   MET   1          1HE       MET   1  -8.389   4.984 -12.496
   10   2HE   MET   1          2HE       MET   1  -9.192   3.622 -11.675
   11   3HE   MET   1          3HE       MET   1 -10.161   4.861 -12.503
   12    H    GLU   2           HN       GLU   2  -6.160   2.422  -8.414
   13    HA   GLU   2           HA       GLU   2  -6.262  -0.008  -9.939
   14   1HB   GLU   2          1HB       GLU   2  -4.939   0.772 -11.852
   15   2HB   GLU   2          2HB       GLU   2  -6.450   1.672 -11.776
   16   1HG   GLU   2          2HG       GLU   2  -5.095   3.505 -10.502
   17   2HG   GLU   2          1HG       GLU   2  -3.654   2.620 -11.017
   18    H    ALA   3           H        ALA   3  -3.759  -0.571 -10.397
   19    HA   ALA   3           HA       ALA   3  -2.324  -0.064  -7.869
   20   1HB   ALA   3          1HB       ALA   3  -1.943  -2.142 -10.041
   21   2HB   ALA   3          2HB       ALA   3  -0.987  -2.008  -8.552
   22   3HB   ALA   3          3HB       ALA   3  -2.714  -2.375  -8.454
   23    H    GLY   4           H        GLY   4  -0.321   0.869  -7.778
   24   1HA   GLY   4          2HA       GLY   4   1.218   1.382 -10.300
   25   2HA   GLY   4          1HA       GLY   4   1.060   2.575  -8.994
   26    H    ALA   5           H        ALA   5   3.602   2.022  -9.473
   27    HA   ALA   5           HA       ALA   5   4.477   0.226  -7.282
   28   1HB   ALA   5          1HB       ALA   5   6.411  -0.447  -8.657
   29   2HB   ALA   5          2HB       ALA   5   4.889  -0.987  -9.396
   30   3HB   ALA   5          3HB       ALA   5   5.741   0.431 -10.051
   31    H    VAL   6           H        VAL   6   6.198   1.209  -6.082
   32    HA   VAL   6           HA       VAL   6   7.154   3.856  -7.048
   33    HB   VAL   6           HB       VAL   6   6.585   4.846  -4.778
   34   1HG1  VAL   6          1HG1      VAL   6   4.750   2.429  -4.507
   35   2HG1  VAL   6          2HG1      VAL   6   4.771   3.868  -3.472
   36   3HG1  VAL   6          3HG1      VAL   6   6.182   2.812  -3.527
   37   1HG2  VAL   6          1HG2      VAL   6   4.270   5.344  -5.268
   38   2HG2  VAL   6          2HG2      VAL   6   5.297   5.491  -6.705
   39   3HG2  VAL   6          3HG2      VAL   6   4.239   4.085  -6.519
   40    H    ASN   7           H        ASN   7   8.559   4.847  -5.544
   41    HA   ASN   7           HA       ASN   7  10.248   3.284  -3.763
   42   1HB   ASN   7          2HB       ASN   7  11.592   2.977  -5.756
   43   2HB   ASN   7          1HB       ASN   7  11.083   4.562  -6.372
   44   1HD2  ASN   7          1HD2      ASN   7  13.567   2.980  -4.417
   45   2HD2  ASN   7          2HD2      ASN   7  14.488   4.442  -4.201
   46    H    ASP   8           HN       ASP   8  11.708   4.900  -2.767
   47    HA   ASP   8           HA       ASP   8  10.585   6.812  -1.263
   48   1HB   ASP   8          2HB       ASP   8  12.993   5.966  -1.257
   49   2HB   ASP   8          1HB       ASP   8  13.364   7.128  -2.512
   50    H    ASP   9           HN       ASP   9  12.120   7.562  -4.359
   51    HA   ASP   9           HA       ASP   9  11.578  10.380  -4.368
   52   1HB   ASP   9          2HB       ASP   9  13.140   9.428  -5.944
   53   2HB   ASP   9          1HB       ASP   9  11.920   8.380  -6.655
   54    H    THR  10           H        THR  10   9.920   7.992  -6.398
   55    HA   THR  10           HA       THR  10   7.734   9.526  -7.159
   56    HB   THR  10           HB       THR  10   6.660   7.250  -7.589
   57    HG1  THR  10           HG1      THR  10   8.633   6.574  -5.850
   58   1HG2  THR  10          1HG2      THR  10   9.550   7.612  -8.523
   59   2HG2  THR  10          2HG2      THR  10   8.316   6.588  -9.280
   60   3HG2  THR  10          3HG2      THR  10   8.116   8.350  -9.263
   61    H    PHE  11           H        PHE  11   8.059   7.557  -4.241
   62    HA   PHE  11           HA       PHE  11   5.544   7.207  -3.262
   63   1HB   PHE  11          2HB       PHE  11   7.744   6.536  -2.255
   64   2HB   PHE  11          1HB       PHE  11   7.982   8.173  -1.711
   65    HD1  PHE  11           HD1      PHE  11   7.063   8.960   0.330
   66    HD2  PHE  11           HD2      PHE  11   5.768   5.188  -1.313
   67    HE1  PHE  11           HE1      PHE  11   6.070   8.352   2.508
   68    HE2  PHE  11           HE2      PHE  11   4.642   4.656   0.835
   69    HZ   PHE  11           HZ       PHE  11   4.795   6.234   2.747
   70    H    LYS  12           HN       LYS  12   7.533  10.072  -2.990
   71    HA   LYS  12           HA       LYS  12   5.855  11.648  -1.308
   72   1HB   LYS  12          2HB       LYS  12   7.648  12.678  -3.548
   73   2HB   LYS  12          1HB       LYS  12   7.126  13.568  -2.120
   74   1HG   LYS  12          1HG       LYS  12   8.968  11.127  -2.195
   75   2HG   LYS  12          2HG       LYS  12   9.480  12.785  -1.971
   76   1HD   LYS  12          1HD       LYS  12   8.676  12.888   0.240
   77   2HD   LYS  12          2HD       LYS  12   7.533  11.560   0.000
   78   1HE   LYS  12          2HE       LYS  12   9.418  10.867   1.411
   79   2HE   LYS  12          1HE       LYS  12   9.210   9.890  -0.046
   80   1HZ   LYS  12          1HZ       LYS  12  10.951  11.142  -1.086
   81   2HZ   LYS  12          2HZ       LYS  12  11.467  10.362   0.261
   82   3HZ   LYS  12          3HZ       LYS  12  11.216  11.999   0.304
   83    H    ASN  13           H        ASN  13   6.015  11.640  -4.878
   84    HA   ASN  13           HA       ASN  13   3.786  13.439  -5.222
   85   1HB   ASN  13          1HB       ASN  13   5.005  11.432  -7.163
   86   2HB   ASN  13          2HB       ASN  13   3.965  12.795  -7.559
   87   1HD2  ASN  13          2HD2      ASN  13   5.550  14.552  -5.437
   88   2HD2  ASN  13          1HD2      ASN  13   6.980  14.934  -6.375
   89    H    VAL  14           H        VAL  14   4.160   9.936  -5.673
   90    HA   VAL  14           HA       VAL  14   1.464   9.483  -6.515
   91    HB   VAL  14           HB       VAL  14   3.712   7.645  -5.587
   92   1HG1  VAL  14          1HG1      VAL  14   2.726   8.423  -8.371
   93   2HG1  VAL  14          2HG1      VAL  14   4.245   8.965  -7.635
   94   3HG1  VAL  14          3HG1      VAL  14   4.017   7.259  -8.024
   95   1HG2  VAL  14          1HG2      VAL  14   2.475   5.880  -6.911
   96   2HG2  VAL  14          2HG2      VAL  14   1.682   6.344  -5.399
   97   3HG2  VAL  14          3HG2      VAL  14   1.082   6.973  -6.954
   98    H    VAL  15           H        VAL  15   2.980   9.402  -3.291
   99    HA   VAL  15           HA       VAL  15   0.434   8.309  -2.163
  100    HB   VAL  15           HB       VAL  15   3.181   8.193  -0.864
  101   1HG1  VAL  15          1HG1      VAL  15   2.164   6.555   0.542
  102   2HG1  VAL  15          2HG1      VAL  15   1.179   8.019   0.587
  103   3HG1  VAL  15          3HG1      VAL  15   0.637   6.624  -0.368
  104   1HG2  VAL  15          1HG2      VAL  15   1.825   6.103  -2.598
  105   2HG2  VAL  15          2HG2      VAL  15   3.341   6.938  -2.969
  106   3HG2  VAL  15          3HG2      VAL  15   3.265   5.847  -1.590
  107    H    LEU  16           H        LEU  16   3.186  10.283  -0.899
  108    HA   LEU  16           HA       LEU  16   1.660  11.398   1.178
  109   1HB   LEU  16          1HB       LEU  16   4.036  12.690  -0.222
  110   2HB   LEU  16          2HB       LEU  16   3.357  13.141   1.323
  111    HG   LEU  16           HG       LEU  16   4.850  10.585   0.620
  112   1HD1  LEU  16          1HD2      LEU  16   6.058  12.751   1.210
  113   2HD1  LEU  16          2HD2      LEU  16   6.410  11.385   2.298
  114   3HD1  LEU  16          3HD2      LEU  16   5.292  12.670   2.803
  115   1HD2  LEU  16          1HD1      LEU  16   4.532   9.967   3.057
  116   2HD2  LEU  16          2HD1      LEU  16   3.256  11.193   3.144
  117   3HD2  LEU  16          3HD1      LEU  16   3.084   9.787   2.057
  118    H    GLU  17           HN       GLU  17   2.220  12.792  -2.050
  119    HA   GLU  17           HA       GLU  17   0.452  15.078  -1.471
  120   1HB   GLU  17          2HB       GLU  17   2.000  14.199  -3.933
  121   2HB   GLU  17          1HB       GLU  17   1.159  15.735  -3.754
  122   1HG   GLU  17          2HG       GLU  17   2.620  16.417  -1.924
  123   2HG   GLU  17          1HG       GLU  17   3.447  14.857  -1.927
  124    H    SER  18           H        SER  18  -0.535  12.011  -1.945
  125    HA   SER  18           HA       SER  18  -2.095  12.260  -4.362
  126   1HB   SER  18          2HB       SER  18  -1.313  10.111  -3.392
  127   2HB   SER  18          1HB       SER  18  -2.451  10.324  -2.044
  128    HG   SER  18           HG       SER  18  -4.052   9.783  -3.362
  129    H    SER  19           H        SER  19  -4.276  12.658  -4.655
  130    HA   SER  19           HA       SER  19  -5.669  14.307  -2.691
  131   1HB   SER  19          2HB       SER  19  -7.364  14.232  -4.645
  132   2HB   SER  19          1HB       SER  19  -5.782  14.971  -4.981
  133    HG   SER  19           HG       SER  19  -6.330  13.449  -6.608
  134    H    VAL  20           H        VAL  20  -6.441  11.408  -4.596
  135    HA   VAL  20           HA       VAL  20  -8.533  10.547  -2.760
  136    HB   VAL  20           HB       VAL  20  -8.413   8.396  -4.154
  137   1HG1  VAL  20          1HG1      VAL  20  -6.077   8.696  -5.012
  138   2HG1  VAL  20          2HG1      VAL  20  -7.288   8.399  -6.266
  139   3HG1  VAL  20          3HG1      VAL  20  -6.661  10.034  -6.028
  140   1HG2  VAL  20          1HG2      VAL  20  -9.042  11.016  -5.538
  141   2HG2  VAL  20          2HG2      VAL  20 -10.137  10.012  -4.550
  142   3HG2  VAL  20          3HG2      VAL  20  -9.541   9.408  -6.102
  143    HA   PRO  21           HA       PRO  21  -6.050   8.193  -0.002
  144   1HB   PRO  21          2HB       PRO  21  -7.941   5.883  -0.386
  145   2HB   PRO  21          1HB       PRO  21  -7.305   6.515   1.124
  146   1HG   PRO  21          1HG       PRO  21  -9.806   7.151   0.295
  147   2HG   PRO  21          2HG       PRO  21  -8.785   8.433   1.012
  148   1HD   PRO  21          2HD       PRO  21  -9.389   7.961  -1.915
  149   2HD   PRO  21          1HD       PRO  21  -9.225   9.483  -1.000
  150    H    VAL  22           H        VAL  22  -4.786   6.266   0.254
  151    HA   VAL  22           HA       VAL  22  -4.136   4.817  -2.230
  152    HB   VAL  22           HB       VAL  22  -2.086   6.280  -0.513
  153   1HG1  VAL  22          1HG2      VAL  22  -0.641   5.905  -2.423
  154   2HG1  VAL  22          2HG2      VAL  22  -1.300   4.386  -1.767
  155   3HG1  VAL  22          3HG2      VAL  22  -1.953   5.077  -3.273
  156   1HG2  VAL  22          1HG1      VAL  22  -3.389   7.273  -3.081
  157   2HG2  VAL  22          2HG1      VAL  22  -1.870   7.894  -2.419
  158   3HG2  VAL  22          3HG1      VAL  22  -3.361   8.084  -1.497
  159    H    LEU  23           H        LEU  23  -3.240   2.838  -1.855
  160    HA   LEU  23           HA       LEU  23  -2.873   1.852   0.950
  161   1HB   LEU  23          2HB       LEU  23  -4.921   1.026  -0.253
  162   2HB   LEU  23          1HB       LEU  23  -3.916   0.297  -1.473
  163    HG   LEU  23           HG       LEU  23  -3.600  -0.372   1.494
  164   1HD1  LEU  23          1HD1      LEU  23  -2.767  -2.569   0.470
  165   2HD1  LEU  23          2HD1      LEU  23  -2.793  -1.750  -1.105
  166   3HD1  LEU  23          3HD1      LEU  23  -1.711  -1.191   0.181
  167   1HD2  LEU  23          1HD2      LEU  23  -5.040  -2.336   1.070
  168   2HD2  LEU  23          2HD2      LEU  23  -5.390  -1.726  -0.564
  169   3HD2  LEU  23          3HD2      LEU  23  -5.921  -0.816   0.871
  170    H    VAL  24           H        VAL  24  -0.602   1.882   1.076
  171    HA   VAL  24           HA       VAL  24   0.946   1.050  -1.348
  172    HB   VAL  24           HB       VAL  24   1.939   2.280   1.236
  173   1HG1  VAL  24          1HG1      VAL  24   4.002   2.662  -0.127
  174   2HG1  VAL  24          2HG1      VAL  24   3.666   0.948   0.112
  175   3HG1  VAL  24          3HG1      VAL  24   3.287   1.718  -1.444
  176   1HG2  VAL  24          1HG2      VAL  24   2.250   4.330  -0.055
  177   2HG2  VAL  24          2HG2      VAL  24   0.535   3.904  -0.047
  178   3HG2  VAL  24          3HG2      VAL  24   1.524   3.585  -1.489
  179    H    ASP  25           HN       ASP  25   1.742  -1.047  -1.377
  180    HA   ASP  25           HA       ASP  25   1.999  -2.497   1.233
  181   1HB   ASP  25          1HB       ASP  25   0.654  -3.727  -0.394
  182   2HB   ASP  25          2HB       ASP  25   1.947  -3.576  -1.601
  183    H    PHE  26           H        PHE  26   4.040  -2.683   2.018
  184    HA   PHE  26           HA       PHE  26   6.361  -1.797   0.390
  185   1HB   PHE  26          2HB       PHE  26   6.035  -2.819   3.245
  186   2HB   PHE  26          1HB       PHE  26   7.583  -2.494   2.479
  187    HD1  PHE  26           HD1      PHE  26   8.585  -0.624   3.394
  188    HD2  PHE  26           HD2      PHE  26   4.316  -0.518   2.698
  189    HE1  PHE  26           HE1      PHE  26   8.485   1.701   4.212
  190    HE2  PHE  26           HE2      PHE  26   4.274   1.845   3.347
  191    HZ   PHE  26           HZ       PHE  26   6.332   2.952   4.183
  192    H    TRP  27           H        TRP  27   6.986  -3.208  -1.109
  193    HA   TRP  27           HA       TRP  27   6.824  -6.140  -0.426
  194   1HB   TRP  27          2HB       TRP  27   6.188  -6.688  -2.633
  195   2HB   TRP  27          1HB       TRP  27   5.115  -5.372  -2.185
  196    HD1  TRP  27           HD1      TRP  27   6.014  -2.946  -3.093
  197    HE1  TRP  27           HE1      TRP  27   7.138  -2.270  -5.344
  198    HE3  TRP  27           HE3      TRP  27   7.363  -7.629  -4.768
  199    HZ2  TRP  27           HZ2      TRP  27   8.646  -3.595  -7.391
  200    HZ3  TRP  27           HZ3      TRP  27   8.578  -7.845  -6.836
  201    HH2  TRP  27           HH2      TRP  27   9.344  -5.900  -8.120
  202    H    ALA  28           H        ALA  28   8.059  -7.344  -2.244
  203    HA   ALA  28           HA       ALA  28  10.353  -6.196  -3.405
  204   1HB   ALA  28          1HB       ALA  28  10.853  -8.179  -1.131
  205   2HB   ALA  28          2HB       ALA  28  12.078  -7.488  -2.208
  206   3HB   ALA  28          3HB       ALA  28  11.255  -6.437  -1.050
  207    HA   PRO  29           HA       PRO  29   8.912  -9.690  -5.700
  208   1HB   PRO  29          2HB       PRO  29  10.914 -10.617  -7.149
  209   2HB   PRO  29          1HB       PRO  29  10.355  -8.970  -7.232
  210   1HG   PRO  29          1HG       PRO  29  12.819  -9.715  -5.713
  211   2HG   PRO  29          2HG       PRO  29  12.639  -8.489  -6.996
  212   1HD   PRO  29          1HD       PRO  29  12.333  -7.818  -4.373
  213   2HD   PRO  29          2HD       PRO  29  11.306  -7.076  -5.628
  214    H    TRP  30           H        TRP  30  11.904 -10.412  -4.123
  215    HA   TRP  30           HA       TRP  30  11.505 -13.198  -3.645
  216   1HB   TRP  30          1HB       TRP  30  13.088 -12.972  -1.782
  217   2HB   TRP  30          2HB       TRP  30  13.652 -12.227  -3.269
  218    HD1  TRP  30           HD1      TRP  30  14.558  -9.873  -3.091
  219    HE1  TRP  30           HE1      TRP  30  14.723  -8.063  -1.268
  220    HE3  TRP  30           HE3      TRP  30  11.591 -12.031   0.503
  221    HZ2  TRP  30           HZ2      TRP  30  13.611  -7.560   1.322
  222    HZ3  TRP  30           HZ3      TRP  30  11.095 -10.815   2.590
  223    HH2  TRP  30           HH2      TRP  30  12.040  -8.559   2.991
  224    H    CYS  31           H        CYS  31   9.664 -10.532  -2.347
  225    HA   CYS  31           HA       CYS  31   9.024 -11.962   0.189
  226   1HB   CYS  31          2HB       CYS  31   9.076  -9.589   0.362
  227   2HB   CYS  31          1HB       CYS  31   7.937  -9.400  -0.973
  228    H    GLY  32           H        GLY  32   8.327 -13.911  -0.745
  229   1HA   GLY  32          1HA       GLY  32   6.501 -14.631  -2.537
  230   2HA   GLY  32          2HA       GLY  32   6.502 -15.378  -0.940
  231    HA   PRO  33           HA       PRO  33   2.506 -13.808   0.195
  232   1HB   PRO  33          1HB       PRO  33   3.798 -11.721   1.977
  233   2HB   PRO  33          2HB       PRO  33   2.353 -12.721   2.313
  234   1HG   PRO  33          2HG       PRO  33   4.738 -13.476   3.331
  235   2HG   PRO  33          1HG       PRO  33   3.677 -14.671   2.521
  236   1HD   PRO  33          1HD       PRO  33   6.107 -13.220   1.389
  237   2HD   PRO  33          2HD       PRO  33   5.688 -14.952   1.253
  238    H    CYS  34           H        CYS  34   4.835 -11.159  -0.222
  239    HA   CYS  34           HA       CYS  34   2.927  -9.094  -0.872
  240   1HB   CYS  34          2HB       CYS  34   5.789  -9.175  -1.843
  241   2HB   CYS  34          1HB       CYS  34   4.676  -7.829  -1.615
  242    H    ARG  35           HN       ARG  35   5.049 -11.182  -2.818
  243    HA   ARG  35           HA       ARG  35   4.288 -10.414  -5.395
  244   1HB   ARG  35          1HB       ARG  35   6.164 -11.964  -4.553
  245   2HB   ARG  35          2HB       ARG  35   4.976 -13.256  -4.533
  246   1HG   ARG  35          1HG       ARG  35   4.531 -12.672  -7.028
  247   2HG   ARG  35          2HG       ARG  35   6.031 -11.728  -6.926
  248   1HD   ARG  35          2HD       ARG  35   5.626 -14.695  -6.403
  249   2HD   ARG  35          1HD       ARG  35   6.568 -13.976  -7.725
  250    HE   ARG  35           HE       ARG  35   7.893 -12.951  -5.630
  251   1HH1  ARG  35          2HH1      ARG  35   6.900 -16.314  -6.161
  252   2HH1  ARG  35          1HH1      ARG  35   8.017 -16.947  -4.982
  253   1HH2  ARG  35          1HH2      ARG  35   9.271 -13.720  -4.176
  254   2HH2  ARG  35          2HH2      ARG  35   9.440 -15.427  -3.803
  255    H    ILE  36           H        ILE  36   2.995 -13.168  -3.468
  256    HA   ILE  36           HA       ILE  36   1.028 -13.762  -5.536
  257    HB   ILE  36           HB       ILE  36   0.273 -15.556  -4.136
  258   1HG1  ILE  36          2HG1      ILE  36   1.879 -15.764  -1.918
  259   2HG1  ILE  36          1HG1      ILE  36   1.571 -14.028  -1.936
  260   1HG2  ILE  36          1HG2      ILE  36   2.369 -15.778  -5.449
  261   2HG2  ILE  36          2HG2      ILE  36   2.333 -16.818  -4.018
  262   3HG2  ILE  36          3HG2      ILE  36   3.314 -15.343  -4.011
  263   1HD1  ILE  36          1HD1      ILE  36  -0.904 -14.533  -2.046
  264   2HD1  ILE  36          2HD1      ILE  36  -0.508 -16.260  -1.956
  265   3HD1  ILE  36          3HD1      ILE  36  -0.117 -15.192  -0.596
  266    H    ILE  37           H        ILE  37   0.852 -11.762  -2.579
  267    HA   ILE  37           HA       ILE  37  -2.084 -11.639  -2.783
  268    HB   ILE  37           HB       ILE  37  -0.103 -10.137  -1.033
  269   1HG1  ILE  37          2HG1      ILE  37  -0.323 -12.648  -0.605
  270   2HG1  ILE  37          1HG1      ILE  37  -0.738 -11.598   0.740
  271   1HG2  ILE  37          1HG2      ILE  37  -2.057  -8.769  -1.172
  272   2HG2  ILE  37          2HG2      ILE  37  -2.157  -9.633   0.354
  273   3HG2  ILE  37          3HG2      ILE  37  -3.147 -10.154  -1.027
  274   1HD1  ILE  37          1HD1      ILE  37  -2.765 -12.953  -1.094
  275   2HD1  ILE  37          2HD1      ILE  37  -3.133 -11.990   0.356
  276   3HD1  ILE  37          3HD1      ILE  37  -2.261 -13.517   0.504
  277    H    ALA  38           H        ALA  38   0.689  -9.740  -3.962
  278    HA   ALA  38           HA       ALA  38  -0.211  -7.326  -4.553
  279   1HB   ALA  38          1HB       ALA  38   1.220  -9.126  -6.556
  280   2HB   ALA  38          2HB       ALA  38   1.137  -7.367  -6.593
  281   3HB   ALA  38          3HB       ALA  38   1.967  -8.163  -5.266
  282    HA   PRO  39           HA       PRO  39  -2.803  -8.456  -8.476
  283   1HB   PRO  39          2HB       PRO  39  -3.880 -11.169  -7.840
  284   2HB   PRO  39          1HB       PRO  39  -3.282 -10.544  -9.398
  285   1HG   PRO  39          2HG       PRO  39  -1.816 -12.339  -7.948
  286   2HG   PRO  39          1HG       PRO  39  -1.011 -10.968  -8.774
  287   1HD   PRO  39          1HD       PRO  39  -1.956 -11.087  -5.891
  288   2HD   PRO  39          2HD       PRO  39  -0.314 -10.715  -6.489
  289    H    VAL  40           H        VAL  40  -3.522  -9.808  -5.292
  290    HA   VAL  40           HA       VAL  40  -6.368  -9.281  -5.326
  291    HB   VAL  40           HB       VAL  40  -4.596  -9.732  -2.888
  292   1HG1  VAL  40          1HG1      VAL  40  -6.904  -9.023  -2.525
  293   2HG1  VAL  40          2HG1      VAL  40  -7.481 -10.398  -3.502
  294   3HG1  VAL  40          3HG1      VAL  40  -6.621 -10.686  -1.967
  295   1HG2  VAL  40          1HG2      VAL  40  -5.805 -11.826  -4.758
  296   2HG2  VAL  40          2HG2      VAL  40  -5.146 -12.164  -3.144
  297   3HG2  VAL  40          3HG2      VAL  40  -4.074 -11.605  -4.427
  298    H    VAL  41           H        VAL  41  -3.377  -7.730  -4.050
  299    HA   VAL  41           HA       VAL  41  -4.677  -5.463  -2.895
  300    HB   VAL  41           HB       VAL  41  -1.925  -5.390  -4.229
  301   1HG1  VAL  41          1HG1      VAL  41  -2.702  -6.431  -1.481
  302   2HG1  VAL  41          2HG1      VAL  41  -1.788  -7.254  -2.766
  303   3HG1  VAL  41          3HG1      VAL  41  -1.060  -5.903  -1.917
  304   1HG2  VAL  41          1HG2      VAL  41  -3.018  -3.993  -1.740
  305   2HG2  VAL  41          2HG2      VAL  41  -3.086  -3.232  -3.327
  306   3HG2  VAL  41          3HG2      VAL  41  -1.513  -3.617  -2.607
  307    H    ASP  42           HN       ASP  42  -3.499  -6.066  -6.233
  308    HA   ASP  42           HA       ASP  42  -4.202  -3.565  -7.364
  309   1HB   ASP  42          2HB       ASP  42  -2.886  -5.190  -8.608
  310   2HB   ASP  42          1HB       ASP  42  -4.189  -6.349  -8.628
  311    H    GLU  43           HN       GLU  43  -6.133  -6.605  -7.592
  312    HA   GLU  43           HA       GLU  43  -8.363  -5.273  -8.663
  313   1HB   GLU  43          2HB       GLU  43  -9.614  -7.159  -8.373
  314   2HB   GLU  43          1HB       GLU  43  -7.977  -7.711  -8.504
  315   1HG   GLU  43          2HG       GLU  43  -8.100  -7.703  -5.812
  316   2HG   GLU  43          1HG       GLU  43  -9.829  -7.556  -6.069
  317    H    ILE  44           H        ILE  44  -7.491  -5.616  -5.166
  318    HA   ILE  44           HA       ILE  44 -10.004  -4.625  -4.226
  319    HB   ILE  44           HB       ILE  44  -7.181  -4.473  -3.132
  320   1HG1  ILE  44          1HG1      ILE  44  -9.687  -5.896  -2.096
  321   2HG1  ILE  44          2HG1      ILE  44  -8.641  -6.635  -3.295
  322   1HG2  ILE  44          1HG2      ILE  44  -8.344  -2.494  -2.291
  323   2HG2  ILE  44          2HG2      ILE  44  -8.221  -3.688  -1.000
  324   3HG2  ILE  44          3HG2      ILE  44  -9.765  -3.478  -1.861
  325   1HD1  ILE  44          1HD1      ILE  44  -7.891  -5.830  -0.471
  326   2HD1  ILE  44          2HD1      ILE  44  -6.687  -6.319  -1.690
  327   3HD1  ILE  44          3HD1      ILE  44  -7.946  -7.450  -1.174
  328    H    ALA  45           H        ALA  45  -7.093  -2.889  -5.495
  329    HA   ALA  45           HA       ALA  45  -8.398  -0.312  -5.181
  330   1HB   ALA  45          1HB       ALA  45  -6.124  -1.187  -6.997
  331   2HB   ALA  45          2HB       ALA  45  -6.714   0.476  -6.800
  332   3HB   ALA  45          3HB       ALA  45  -6.056  -0.381  -5.403
  333    H    GLY  46           H        GLY  46  -8.194  -2.665  -7.970
  334   1HA   GLY  46          2HA       GLY  46  -9.549  -1.171  -9.905
  335   2HA   GLY  46          1HA       GLY  46  -9.669  -2.931  -9.731
  336    H    GLU  47           HN       GLU  47 -11.055  -3.562  -7.755
  337    HA   GLU  47           HA       GLU  47 -13.758  -2.985  -8.004
  338   1HB   GLU  47          2HB       GLU  47 -12.122  -3.810  -5.581
  339   2HB   GLU  47          1HB       GLU  47 -13.891  -3.833  -5.600
  340   1HG   GLU  47          1HG       GLU  47 -13.917  -5.507  -7.361
  341   2HG   GLU  47          2HG       GLU  47 -12.163  -5.431  -7.549
  342    H    TYR  48           H        TYR  48 -11.544  -1.517  -5.584
  343    HA   TYR  48           HA       TYR  48 -13.601   0.461  -4.801
  344   1HB   TYR  48          1HB       TYR  48 -10.809  -0.114  -3.751
  345   2HB   TYR  48          2HB       TYR  48 -11.837   1.187  -3.202
  346    HD1  TYR  48           HD1      TYR  48 -12.151  -2.598  -3.686
  347    HD2  TYR  48           HD2      TYR  48 -13.072   0.846  -1.263
  348    HE1  TYR  48           HE1      TYR  48 -13.777  -3.925  -2.427
  349    HE2  TYR  48           HE2      TYR  48 -14.716  -0.496  -0.004
  350    HH   TYR  48           HH       TYR  48 -15.792  -2.554   0.170
  351    H    LYS  49           HN       LYS  49 -13.421   0.851  -7.223
  352    HA   LYS  49           HA       LYS  49 -11.634   2.475  -8.514
  353   1HB   LYS  49          1HB       LYS  49 -13.569   3.316  -9.801
  354   2HB   LYS  49          2HB       LYS  49 -13.552   1.559  -9.604
  355   1HG   LYS  49          1HG       LYS  49 -15.263   1.720  -7.812
  356   2HG   LYS  49          2HG       LYS  49 -15.263   3.487  -7.973
  357   1HD   LYS  49          1HD       LYS  49 -16.027   3.277 -10.326
  358   2HD   LYS  49          2HD       LYS  49 -15.952   1.512 -10.196
  359   1HE   LYS  49          2HE       LYS  49 -18.261   2.265  -9.943
  360   2HE   LYS  49          1HE       LYS  49 -17.691   1.544  -8.429
  361   1HZ   LYS  49          1HZ       LYS  49 -17.335   3.747  -7.585
  362   2HZ   LYS  49          2HZ       LYS  49 -18.895   3.579  -8.084
  363   3HZ   LYS  49          3HZ       LYS  49 -17.823   4.425  -9.006
  364    H    ASP  50           HN       ASP  50 -11.134   4.635  -8.564
  365    HA   ASP  50           HA       ASP  50 -10.816   6.762  -8.003
  366   1HB   ASP  50          2HB       ASP  50 -13.284   6.960  -8.324
  367   2HB   ASP  50          1HB       ASP  50 -13.537   6.678  -6.606
  368    H    LYS  51           HN       LYS  51 -12.441   5.285  -5.260
  369    HA   LYS  51           HA       LYS  51 -11.188   6.982  -3.361
  370   1HB   LYS  51          1HB       LYS  51 -12.326   5.620  -1.695
  371   2HB   LYS  51          2HB       LYS  51 -13.387   5.966  -3.035
  372   1HG   LYS  51          2HG       LYS  51 -12.819   3.654  -3.969
  373   2HG   LYS  51          1HG       LYS  51 -11.998   3.338  -2.434
  374   1HD   LYS  51          2HD       LYS  51 -14.937   4.117  -2.726
  375   2HD   LYS  51          1HD       LYS  51 -14.336   2.461  -2.603
  376   1HE   LYS  51          2HE       LYS  51 -13.285   3.076  -0.365
  377   2HE   LYS  51          1HE       LYS  51 -14.124   4.632  -0.464
  378   1HZ   LYS  51          1HZ       LYS  51 -15.432   2.005  -0.537
  379   2HZ   LYS  51          2HZ       LYS  51 -15.301   2.953   0.795
  380   3HZ   LYS  51          3HZ       LYS  51 -16.186   3.472  -0.500
  381    H    LEU  52           H        LEU  52  -9.830   4.094  -4.707
  382    HA   LEU  52           HA       LEU  52  -7.821   4.129  -2.460
  383   1HB   LEU  52          1HB       LEU  52  -9.866   2.333  -2.548
  384   2HB   LEU  52          2HB       LEU  52  -8.701   1.466  -3.555
  385    HG   LEU  52           HG       LEU  52  -7.081   2.079  -1.488
  386   1HD1  LEU  52          1HD1      LEU  52  -8.871   3.585  -0.529
  387   2HD1  LEU  52          2HD1      LEU  52  -9.925   2.185  -0.325
  388   3HD1  LEU  52          3HD1      LEU  52  -8.407   2.305   0.593
  389   1HD2  LEU  52          1HD2      LEU  52  -9.293  -0.028  -1.370
  390   2HD2  LEU  52          2HD2      LEU  52  -7.689  -0.211  -2.118
  391   3HD2  LEU  52          3HD2      LEU  52  -7.830  -0.015  -0.362
  392    H    LYS  53           HN       LYS  53  -5.864   4.730  -3.426
  393    HA   LYS  53           HA       LYS  53  -5.342   3.626  -6.143
  394   1HB   LYS  53          1HB       LYS  53  -5.052   6.077  -5.280
  395   2HB   LYS  53          2HB       LYS  53  -3.561   5.498  -4.593
  396   1HG   LYS  53          2HG       LYS  53  -4.435   5.450  -7.526
  397   2HG   LYS  53          1HG       LYS  53  -3.214   6.497  -6.791
  398   1HD   LYS  53          1HD       LYS  53  -1.788   4.494  -6.332
  399   2HD   LYS  53          2HD       LYS  53  -3.002   3.460  -7.099
  400   1HE   LYS  53          1HE       LYS  53  -1.263   3.841  -8.679
  401   2HE   LYS  53          2HE       LYS  53  -2.723   4.669  -9.239
  402   1HZ   LYS  53          1HZ       LYS  53  -0.460   5.928  -7.849
  403   2HZ   LYS  53          2HZ       LYS  53  -0.760   6.013  -9.468
  404   3HZ   LYS  53          3HZ       LYS  53  -1.800   6.712  -8.400
  405    H    CYS  54           H        CYS  54  -4.368   1.605  -6.167
  406    HA   CYS  54           HA       CYS  54  -3.020   0.618  -3.707
  407   1HB   CYS  54          1HB       CYS  54  -4.156  -1.173  -4.647
  408   2HB   CYS  54          2HB       CYS  54  -3.866  -0.637  -6.320
  409    HG   CYS  54           HG       CYS  54  -2.705  -2.906  -5.851
  410    H    VAL  55           H        VAL  55  -0.890   0.490  -3.419
  411    HA   VAL  55           HA       VAL  55   0.810   0.785  -5.790
  412    HB   VAL  55           HB       VAL  55   2.033   2.334  -3.632
  413   1HG1  VAL  55          1HG1      VAL  55  -0.249   3.000  -3.049
  414   2HG1  VAL  55          2HG1      VAL  55  -0.532   3.535  -4.726
  415   3HG1  VAL  55          3HG1      VAL  55   0.697   4.340  -3.739
  416   1HG2  VAL  55          1HG2      VAL  55   2.738   2.274  -5.979
  417   2HG2  VAL  55          2HG2      VAL  55   1.175   2.966  -6.481
  418   3HG2  VAL  55          3HG2      VAL  55   2.286   3.923  -5.478
  419    H    LYS  56           HN       LYS  56   2.950   0.201  -5.527
  420    HA   LYS  56           HA       LYS  56   3.425  -1.693  -3.271
  421   1HB   LYS  56          1HB       LYS  56   3.994  -2.065  -6.214
  422   2HB   LYS  56          2HB       LYS  56   4.191  -3.260  -4.903
  423   1HG   LYS  56          2HG       LYS  56   1.701  -3.133  -4.495
  424   2HG   LYS  56          1HG       LYS  56   1.590  -2.088  -5.935
  425   1HD   LYS  56          1HD       LYS  56   2.817  -3.875  -7.209
  426   2HD   LYS  56          2HD       LYS  56   2.562  -4.953  -5.819
  427   1HE   LYS  56          1HE       LYS  56   0.160  -4.873  -6.085
  428   2HE   LYS  56          2HE       LYS  56   0.231  -3.422  -7.091
  429   1HZ   LYS  56          1HZ       LYS  56  -0.240  -5.386  -8.351
  430   2HZ   LYS  56          2HZ       LYS  56   1.133  -4.627  -8.853
  431   3HZ   LYS  56          3HZ       LYS  56   1.238  -6.015  -7.981
  432    H    LEU  57           H        LEU  57   5.081  -0.842  -2.175
  433    HA   LEU  57           HA       LEU  57   7.131   0.714  -3.642
  434   1HB   LEU  57          2HB       LEU  57   7.618   1.875  -2.015
  435   2HB   LEU  57          1HB       LEU  57   5.959   1.666  -1.539
  436    HG   LEU  57           HG       LEU  57   6.917   0.293   0.376
  437   1HD1  LEU  57          1HD1      LEU  57   6.465   2.678   0.564
  438   2HD1  LEU  57          2HD1      LEU  57   7.928   2.272   1.464
  439   3HD1  LEU  57          3HD1      LEU  57   8.065   3.070  -0.105
  440   1HD2  LEU  57          1HD2      LEU  57   9.019  -0.609  -0.126
  441   2HD2  LEU  57          2HD2      LEU  57   9.502   0.807  -1.090
  442   3HD2  LEU  57          3HD2      LEU  57   9.518   0.860   0.682
  443    H    ASN  58           H        ASN  58   8.980  -0.119  -4.252
  444    HA   ASN  58           HA       ASN  58   9.548  -2.871  -3.389
  445   1HB   ASN  58          2HB       ASN  58   9.961  -2.165  -5.716
  446   2HB   ASN  58          1HB       ASN  58  11.203  -1.041  -5.163
  447   1HD2  ASN  58          2HD2      ASN  58  10.765  -4.140  -6.389
  448   2HD2  ASN  58          1HD2      ASN  58  12.231  -4.873  -5.760
  449    H    THR  59           H        THR  59  10.327  -3.179  -1.473
  450    HA   THR  59           HA       THR  59  11.455  -1.113   0.191
  451    HB   THR  59           HB       THR  59  11.365  -4.127   0.657
  452    HG1  THR  59           HG1      THR  59   9.320  -3.468   0.094
  453   1HG2  THR  59          1HG2      THR  59  11.087  -3.459   3.024
  454   2HG2  THR  59          2HG2      THR  59  11.249  -1.751   2.562
  455   3HG2  THR  59          3HG2      THR  59  12.625  -2.864   2.375
  456    H    ASP  60           HN       ASP  60  12.791  -3.624  -1.837
  457    HA   ASP  60           HA       ASP  60  15.391  -3.840  -0.601
  458   1HB   ASP  60          1HB       ASP  60  13.964  -5.406  -2.203
  459   2HB   ASP  60          2HB       ASP  60  14.745  -4.496  -3.497
  460    H    GLU  61           HN       GLU  61  13.937  -2.113  -3.278
  461    HA   GLU  61           HA       GLU  61  16.292  -0.603  -4.095
  462   1HB   GLU  61          2HB       GLU  61  14.522  -1.496  -5.620
  463   2HB   GLU  61          1HB       GLU  61  13.343  -0.440  -4.822
  464   1HG   GLU  61          2HG       GLU  61  14.581   1.556  -5.632
  465   2HG   GLU  61          1HG       GLU  61  15.757   0.489  -6.422
  466    H    SER  62           H        SER  62  13.478  -0.076  -1.999
  467    HA   SER  62           HA       SER  62  14.245   2.780  -1.547
  468   1HB   SER  62          2HB       SER  62  12.194   2.304  -2.956
  469   2HB   SER  62          1HB       SER  62  11.474   1.570  -1.525
  470    HG   SER  62           HG       SER  62  11.685   3.476  -0.430
  471    HA   PRO  63           HA       PRO  63  14.079   0.240   2.502
  472   1HB   PRO  63          1HB       PRO  63  16.669   0.543   3.280
  473   2HB   PRO  63          2HB       PRO  63  16.186  -0.745   2.133
  474   1HG   PRO  63          2HG       PRO  63  17.279   2.012   1.432
  475   2HG   PRO  63          1HG       PRO  63  17.885   0.451   0.868
  476   1HD   PRO  63          1HD       PRO  63  16.139   1.831  -0.635
  477   2HD   PRO  63          2HD       PRO  63  15.956   0.052  -0.484
  478    H    ASN  64           H        ASN  64  15.545   3.194   1.291
  479    HA   ASN  64           HA       ASN  64  15.814   4.950   3.304
  480   1HB   ASN  64          1HB       ASN  64  14.095   5.561   0.851
  481   2HB   ASN  64          2HB       ASN  64  14.932   6.733   1.875
  482   1HD2  ASN  64          1HD2      ASN  64  15.707   7.395  -0.324
  483   2HD2  ASN  64          2HD2      ASN  64  17.163   6.597  -0.929
  484    H    VAL  65           H        VAL  65  12.626   4.360   1.819
  485    HA   VAL  65           HA       VAL  65  11.104   5.919   3.632
  486    HB   VAL  65           HB       VAL  65  10.330   3.576   1.825
  487   1HG1  VAL  65          1HG2      VAL  65   8.050   4.655   1.950
  488   2HG1  VAL  65          2HG2      VAL  65   8.671   5.667   3.276
  489   3HG1  VAL  65          3HG2      VAL  65   8.587   3.899   3.455
  490   1HG2  VAL  65          1HG1      VAL  65  10.234   6.602   1.418
  491   2HG2  VAL  65          2HG1      VAL  65  11.350   5.486   0.610
  492   3HG2  VAL  65          3HG1      VAL  65   9.613   5.374   0.290
  493    H    ALA  66           H        ALA  66  11.672   2.436   3.449
  494    HA   ALA  66           HA       ALA  66  10.195   1.630   5.737
  495   1HB   ALA  66          1HB       ALA  66  12.808   0.419   4.719
  496   2HB   ALA  66          2HB       ALA  66  11.184   0.057   4.095
  497   3HB   ALA  66          3HB       ALA  66  11.616  -0.367   5.762
  498    H    SER  67           H        SER  67  13.516   2.897   5.505
  499    HA   SER  67           HA       SER  67  14.148   2.582   8.291
  500   1HB   SER  67          1HB       SER  67  15.383   4.528   6.290
  501   2HB   SER  67          2HB       SER  67  16.089   3.930   7.796
  502    HG   SER  67           HG       SER  67  15.400   2.351   5.522
  503    H    GLU  68           HN       GLU  68  12.944   5.297   6.327
  504    HA   GLU  68           HA       GLU  68  12.880   7.307   8.333
  505   1HB   GLU  68          2HB       GLU  68  11.110   6.825   5.900
  506   2HB   GLU  68          1HB       GLU  68  10.991   8.261   6.909
  507   1HG   GLU  68          1HG       GLU  68  13.150   9.033   6.325
  508   2HG   GLU  68          2HG       GLU  68  13.661   7.469   5.695
  509    H    TYR  69           H        TYR  69  10.431   4.831   7.457
  510    HA   TYR  69           HA       TYR  69   8.621   5.698   9.595
  511   1HB   TYR  69          2HB       TYR  69   8.718   3.349   7.679
  512   2HB   TYR  69          1HB       TYR  69   7.583   3.381   9.017
  513    HD1  TYR  69           HD1      TYR  69   6.110   5.546   9.295
  514    HD2  TYR  69           HD2      TYR  69   8.045   4.372   5.633
  515    HE1  TYR  69           HE1      TYR  69   4.641   7.087   8.027
  516    HE2  TYR  69           HE2      TYR  69   6.554   5.908   4.360
  517    HH   TYR  69           HH       TYR  69   4.181   8.008   5.977
  518    H    GLY  70           H        GLY  70  11.115   3.198   9.240
  519   1HA   GLY  70          2HA       GLY  70  12.480   2.514  11.038
  520   2HA   GLY  70          1HA       GLY  70  11.214   2.913  12.204
  521    H    ILE  71           H        ILE  71  11.159   0.939   9.167
  522    HA   ILE  71           HA       ILE  71  10.599  -1.527  10.680
  523    HB   ILE  71           HB       ILE  71   8.935  -1.978   8.852
  524   1HG1  ILE  71          1HG1      ILE  71   8.948   1.020   8.363
  525   2HG1  ILE  71          2HG1      ILE  71   9.758  -0.159   7.315
  526   1HG2  ILE  71          1HG2      ILE  71   8.194   0.404  10.615
  527   2HG2  ILE  71          2HG2      ILE  71   8.323  -1.266  11.202
  528   3HG2  ILE  71          3HG2      ILE  71   7.099  -0.851  10.003
  529   1HD1  ILE  71          1HD1      ILE  71   7.576   0.409   6.423
  530   2HD1  ILE  71          2HD1      ILE  71   7.618  -1.301   6.893
  531   3HD1  ILE  71          3HD1      ILE  71   6.782  -0.105   7.916
  532    H    ARG  72           HN       ARG  72  10.571  -3.312   8.758
  533    HA   ARG  72           HA       ARG  72  12.573  -2.863   6.689
  534   1HB   ARG  72          1HB       ARG  72  14.119  -3.104   8.529
  535   2HB   ARG  72          2HB       ARG  72  13.194  -4.453   9.197
  536   1HG   ARG  72          2HG       ARG  72  13.781  -5.817   7.169
  537   2HG   ARG  72          1HG       ARG  72  14.733  -4.464   6.556
  538   1HD   ARG  72          2HD       ARG  72  16.102  -6.258   7.713
  539   2HD   ARG  72          1HD       ARG  72  16.310  -4.628   8.355
  540    HE   ARG  72           HE       ARG  72  15.687  -5.397  10.375
  541   1HH1  ARG  72          1HH1      ARG  72  14.182  -7.564   8.029
  542   2HH1  ARG  72          2HH1      ARG  72  12.945  -8.108   9.134
  543   1HH2  ARG  72          2HH2      ARG  72  14.373  -6.435  11.917
  544   2HH2  ARG  72          1HH2      ARG  72  13.288  -7.712  11.433
  545    H    SER  73           H        SER  73  11.364  -5.633   8.706
  546    HA   SER  73           HA       SER  73  11.092  -7.433   6.622
  547   1HB   SER  73          1HB       SER  73   9.226  -7.167   8.973
  548   2HB   SER  73          2HB       SER  73   9.613  -8.666   8.116
  549    HG   SER  73           HG       SER  73  10.770  -8.404  10.114
  550    H    ILE  74           H        ILE  74   9.174  -8.254   5.565
  551    HA   ILE  74           HA       ILE  74   6.931  -6.439   5.158
  552    HB   ILE  74           HB       ILE  74   7.321  -6.757   2.606
  553   1HG1  ILE  74          1HG1      ILE  74  10.216  -7.092   3.427
  554   2HG1  ILE  74          2HG1      ILE  74   9.176  -8.427   2.882
  555   1HG2  ILE  74          1HG2      ILE  74   7.539  -4.610   3.945
  556   2HG2  ILE  74          2HG2      ILE  74   8.553  -4.676   2.506
  557   3HG2  ILE  74          3HG2      ILE  74   9.273  -4.944   4.097
  558   1HD1  ILE  74          1HD1      ILE  74   8.728  -7.194   0.767
  559   2HD1  ILE  74          2HD1      ILE  74   9.884  -5.939   1.271
  560   3HD1  ILE  74          3HD1      ILE  74  10.435  -7.591   1.003
  561    HA   PRO  75           HA       PRO  75   5.164  -6.889   3.021
  562   1HB   PRO  75          2HB       PRO  75   2.566  -7.515   3.494
  563   2HB   PRO  75          1HB       PRO  75   3.538  -8.325   2.255
  564   1HG   PRO  75          1HG       PRO  75   3.028  -9.288   5.096
  565   2HG   PRO  75          2HG       PRO  75   2.819 -10.219   3.585
  566   1HD   PRO  75          1HD       PRO  75   5.070 -10.408   5.098
  567   2HD   PRO  75          2HD       PRO  75   5.190 -10.416   3.322
  568    H    THR  76           H        THR  76   3.993  -5.107   3.667
  569    HA   THR  76           HA       THR  76   2.948  -4.693   6.308
  570    HB   THR  76           HB       THR  76   5.631  -3.443   5.599
  571    HG1  THR  76           HG1      THR  76   5.229  -5.441   6.973
  572   1HG2  THR  76          1HG2      THR  76   3.561  -2.529   7.642
  573   2HG2  THR  76          2HG2      THR  76   4.199  -1.567   6.285
  574   3HG2  THR  76          3HG2      THR  76   5.256  -2.012   7.637
  575    H    ILE  77           H        ILE  77   1.209  -3.543   5.775
  576    HA   ILE  77           HA       ILE  77   1.145  -2.063   3.196
  577    HB   ILE  77           HB       ILE  77  -1.024  -3.285   4.927
  578   1HG1  ILE  77          2HG1      ILE  77  -0.184  -3.922   2.061
  579   2HG1  ILE  77          1HG1      ILE  77   0.379  -4.825   3.471
  580   1HG2  ILE  77          1HG2      ILE  77  -2.586  -2.543   3.072
  581   2HG2  ILE  77          2HG2      ILE  77  -1.912  -1.208   3.986
  582   3HG2  ILE  77          3HG2      ILE  77  -1.237  -1.607   2.395
  583   1HD1  ILE  77          1HD1      ILE  77  -1.408  -6.061   2.514
  584   2HD1  ILE  77          2HD1      ILE  77  -2.495  -4.669   2.504
  585   3HD1  ILE  77          3HD1      ILE  77  -1.984  -5.389   4.050
  586    H    MET  78           H        MET  78   0.400   0.133   3.239
  587    HA   MET  78           HA       MET  78  -0.205   1.323   5.895
  588   1HB   MET  78          1HB       MET  78   1.794   2.366   3.874
  589   2HB   MET  78          2HB       MET  78   1.106   3.338   5.193
  590   1HG   MET  78          2HG       MET  78   1.978   1.654   6.830
  591   2HG   MET  78          1HG       MET  78   2.810   0.855   5.489
  592   1HE   MET  78          1HE       MET  78   4.437   1.556   7.961
  593   2HE   MET  78          2HE       MET  78   5.114   0.944   6.430
  594   3HE   MET  78          3HE       MET  78   5.856   2.347   7.231
  595    H    VAL  79           H        VAL  79  -1.868   2.666   5.823
  596    HA   VAL  79           HA       VAL  79  -3.168   3.134   3.179
  597    HB   VAL  79           HB       VAL  79  -4.219   3.149   6.043
  598   1HG1  VAL  79          1HG1      VAL  79  -4.900   1.413   3.634
  599   2HG1  VAL  79          2HG1      VAL  79  -3.894   0.922   5.012
  600   3HG1  VAL  79          3HG1      VAL  79  -5.604   1.283   5.263
  601   1HG2  VAL  79          1HG2      VAL  79  -5.708   3.909   3.481
  602   2HG2  VAL  79          2HG2      VAL  79  -6.468   3.625   5.058
  603   3HG2  VAL  79          3HG2      VAL  79  -5.375   4.980   4.849
  604    H    PHE  80           H        PHE  80  -3.529   5.220   2.490
  605    HA   PHE  80           HA       PHE  80  -2.841   7.470   4.293
  606   1HB   PHE  80          1HB       PHE  80  -2.067   7.296   1.360
  607   2HB   PHE  80          2HB       PHE  80  -1.756   8.626   2.445
  608    HD1  PHE  80           HD1      PHE  80   0.396   8.786   3.417
  609    HD2  PHE  80           HD2      PHE  80  -0.960   4.990   1.898
  610    HE1  PHE  80           HE1      PHE  80   2.542   7.751   4.080
  611    HE2  PHE  80           HE2      PHE  80   1.182   3.974   2.535
  612    HZ   PHE  80           HZ       PHE  80   2.893   5.300   3.772
  613    H    LYS  81           HN       LYS  81  -4.086   9.326   3.910
  614    HA   LYS  81           HA       LYS  81  -6.076   9.426   1.812
  615   1HB   LYS  81          1HB       LYS  81  -7.948   9.672   3.618
  616   2HB   LYS  81          2HB       LYS  81  -7.467   8.096   3.010
  617   1HG   LYS  81          2HG       LYS  81  -7.852   7.875   5.302
  618   2HG   LYS  81          1HG       LYS  81  -6.142   7.624   5.022
  619   1HD   LYS  81          2HD       LYS  81  -6.912  10.433   5.667
  620   2HD   LYS  81          1HD       LYS  81  -7.344   9.273   6.926
  621   1HE   LYS  81          1HE       LYS  81  -5.224   8.947   7.608
  622   2HE   LYS  81          2HE       LYS  81  -4.547   8.981   5.970
  623   1HZ   LYS  81          1HZ       LYS  81  -3.803  10.753   7.308
  624   2HZ   LYS  81          2HZ       LYS  81  -4.680  11.327   6.030
  625   3HZ   LYS  81          3HZ       LYS  81  -5.340  11.315   7.548
  626    H    GLY  82           H        GLY  82  -6.594  11.559   1.413
  627   1HA   GLY  82          2HA       GLY  82  -6.169  13.830   1.481
  628   2HA   GLY  82          1HA       GLY  82  -6.139  13.709   3.258
  629    H    GLY  83           H        GLY  83  -4.154  12.211   0.653
  630   1HA   GLY  83          2HA       GLY  83  -1.933  12.213   0.218
  631   2HA   GLY  83          1HA       GLY  83  -1.791  13.663   1.213
  632    H    LYS  84           HN       LYS  84  -2.220  12.940   3.695
  633    HA   LYS  84           HA       LYS  84   0.176  11.326   4.257
  634   1HB   LYS  84          1HB       LYS  84  -1.639  12.831   6.176
  635   2HB   LYS  84          2HB       LYS  84   0.004  12.255   6.501
  636   1HG   LYS  84          2HG       LYS  84  -0.812  14.418   4.513
  637   2HG   LYS  84          1HG       LYS  84   0.024  14.649   6.042
  638   1HD   LYS  84          1HD       LYS  84   2.014  13.480   5.235
  639   2HD   LYS  84          2HD       LYS  84   1.235  13.071   3.700
  640   1HE   LYS  84          2HE       LYS  84   1.714  15.928   4.597
  641   2HE   LYS  84          1HE       LYS  84   2.764  15.001   3.512
  642   1HZ   LYS  84          1HZ       LYS  84  -0.049  15.654   3.000
  643   2HZ   LYS  84          2HZ       LYS  84   1.262  16.328   2.271
  644   3HZ   LYS  84          3HZ       LYS  84   0.903  14.740   2.017
  645    H    LYS  85           HN       LYS  85   0.247  10.022   6.225
  646    HA   LYS  85           HA       LYS  85  -1.066   7.588   5.618
  647   1HB   LYS  85          2HB       LYS  85   1.251   7.877   6.446
  648   2HB   LYS  85          1HB       LYS  85   0.619   8.382   8.023
  649   1HG   LYS  85          2HG       LYS  85  -0.375   6.168   8.366
  650   2HG   LYS  85          1HG       LYS  85   0.083   5.669   6.718
  651   1HD   LYS  85          1HD       LYS  85   2.448   5.818   7.302
  652   2HD   LYS  85          2HD       LYS  85   2.052   6.516   8.893
  653   1HE   LYS  85          1HE       LYS  85   0.820   4.427   9.486
  654   2HE   LYS  85          2HE       LYS  85   1.264   3.733   7.916
  655   1HZ   LYS  85          1HZ       LYS  85   2.717   2.998   9.600
  656   2HZ   LYS  85          2HZ       LYS  85   3.569   3.971   8.575
  657   3HZ   LYS  85          3HZ       LYS  85   3.111   4.537  10.054
  658    H    CYS  86           H        CYS  86  -2.324   6.274   6.913
  659    HA   CYS  86           HA       CYS  86  -4.054   7.512   9.018
  660   1HB   CYS  86          2HB       CYS  86  -5.322   6.847   6.964
  661   2HB   CYS  86          1HB       CYS  86  -4.659   5.230   7.064
  662    HG   CYS  86           HG       CYS  86  -6.395   6.850   9.352
  663    H    GLU  87           HN       GLU  87  -3.195   4.197   7.932
  664    HA   GLU  87           HA       GLU  87  -2.112   3.481  10.567
  665   1HB   GLU  87          1HB       GLU  87  -4.632   2.338   9.276
  666   2HB   GLU  87          2HB       GLU  87  -3.728   1.408  10.466
  667   1HG   GLU  87          1HG       GLU  87  -4.967   4.142  10.980
  668   2HG   GLU  87          2HG       GLU  87  -5.648   2.594  11.468
  669    H    THR  88           H        THR  88  -1.552   1.079  10.489
  670    HA   THR  88           HA       THR  88  -0.190   0.415   7.937
  671    HB   THR  88           HB       THR  88   0.734  -0.175  10.779
  672    HG1  THR  88           HG1      THR  88   0.772   2.051  10.283
  673   1HG2  THR  88          1HG2      THR  88   2.216  -0.347   8.113
  674   2HG2  THR  88          2HG2      THR  88   1.674  -1.731   9.088
  675   3HG2  THR  88          3HG2      THR  88   2.916  -0.636   9.715
  676    H    ILE  89           H        ILE  89  -0.223  -1.892   7.440
  677    HA   ILE  89           HA       ILE  89  -1.716  -3.699   9.202
  678    HB   ILE  89           HB       ILE  89  -2.519  -4.058   6.369
  679   1HG1  ILE  89          1HG1      ILE  89  -3.691  -1.637   7.804
  680   2HG1  ILE  89          2HG1      ILE  89  -2.610  -1.565   6.398
  681   1HG2  ILE  89          1HG2      ILE  89  -4.159  -3.808   8.918
  682   2HG2  ILE  89          2HG2      ILE  89  -3.348  -5.299   8.417
  683   3HG2  ILE  89          3HG2      ILE  89  -4.624  -4.630   7.410
  684   1HD1  ILE  89          1HD1      ILE  89  -4.240  -2.877   5.065
  685   2HD1  ILE  89          2HD1      ILE  89  -4.850  -1.306   5.617
  686   3HD1  ILE  89          3HD1      ILE  89  -5.387  -2.783   6.419
  687    H    ILE  90           H        ILE  90  -1.638  -5.980   7.624
  688    HA   ILE  90           HA       ILE  90   1.151  -6.245   6.668
  689    HB   ILE  90           HB       ILE  90  -0.206  -8.020   8.755
  690   1HG1  ILE  90          1HG1      ILE  90   2.194  -6.129   8.944
  691   2HG1  ILE  90          2HG1      ILE  90   0.623  -5.922   9.734
  692   1HG2  ILE  90          1HG2      ILE  90   2.555  -8.246   7.464
  693   2HG2  ILE  90          2HG2      ILE  90   1.937  -9.276   8.770
  694   3HG2  ILE  90          3HG2      ILE  90   1.189  -9.356   7.199
  695   1HD1  ILE  90          1HD1      ILE  90   2.089  -6.687  11.401
  696   2HD1  ILE  90          2HD1      ILE  90   1.029  -8.054  11.005
  697   3HD1  ILE  90          3HD1      ILE  90   2.709  -8.007  10.406
  698    H    GLY  91           H        GLY  91   1.353  -8.032   5.227
  699   1HA   GLY  91          2HA       GLY  91  -1.022  -8.530   3.585
  700   2HA   GLY  91          1HA       GLY  91   0.634  -9.071   3.279
  701    H    ALA  92           H        ALA  92  -0.075 -11.247   2.802
  702    HA   ALA  92           HA       ALA  92  -0.853 -13.350   3.166
  703   1HB   ALA  92          1HB       ALA  92   0.069 -14.424   5.154
  704   2HB   ALA  92          2HB       ALA  92   1.254 -13.280   4.501
  705   3HB   ALA  92          3HB       ALA  92   0.312 -12.857   5.947
  706    H    VAL  93           H        VAL  93  -2.971 -11.551   3.369
  707    HA   VAL  93           HA       VAL  93  -4.779 -12.992   5.179
  708    HB   VAL  93           HB       VAL  93  -5.880 -10.823   5.783
  709   1HG1  VAL  93          1HG2      VAL  93  -4.689  -8.715   5.631
  710   2HG1  VAL  93          2HG2      VAL  93  -4.859  -9.398   4.010
  711   3HG1  VAL  93          3HG2      VAL  93  -3.303  -9.495   4.846
  712   1HG2  VAL  93          1HG1      VAL  93  -3.045 -11.078   6.845
  713   2HG2  VAL  93          2HG1      VAL  93  -4.450 -12.010   7.397
  714   3HG2  VAL  93          3HG1      VAL  93  -4.405 -10.251   7.620
  715    HA   PRO  94           HA       PRO  94  -7.038 -12.733   1.406
  716   1HB   PRO  94          1HB       PRO  94  -9.630 -13.209   2.131
  717   2HB   PRO  94          2HB       PRO  94  -8.337 -14.429   2.242
  718   1HG   PRO  94          1HG       PRO  94  -9.417 -12.633   4.432
  719   2HG   PRO  94          2HG       PRO  94  -9.127 -14.391   4.526
  720   1HD   PRO  94          2HD       PRO  94  -7.345 -12.523   5.471
  721   2HD   PRO  94          1HD       PRO  94  -6.802 -14.070   4.783
  722    H    LYS  95           HN       LYS  95  -8.517 -11.542   0.166
  723    HA   LYS  95           HA       LYS  95  -8.415  -8.832   0.434
  724   1HB   LYS  95          1HB       LYS  95 -10.288  -8.725  -1.206
  725   2HB   LYS  95          2HB       LYS  95  -8.992  -9.822  -1.696
  726   1HG   LYS  95          2HG       LYS  95 -10.428 -11.754  -0.896
  727   2HG   LYS  95          1HG       LYS  95 -11.746 -10.594  -0.642
  728   1HD   LYS  95          1HD       LYS  95 -10.330 -11.124  -3.294
  729   2HD   LYS  95          2HD       LYS  95 -11.902 -11.769  -2.804
  730   1HE   LYS  95          2HE       LYS  95 -12.766  -9.404  -2.603
  731   2HE   LYS  95          1HE       LYS  95 -11.222  -8.824  -3.263
  732   1HZ   LYS  95          1HZ       LYS  95 -11.627 -10.083  -5.221
  733   2HZ   LYS  95          2HZ       LYS  95 -12.863  -9.032  -4.946
  734   3HZ   LYS  95          3HZ       LYS  95 -13.068 -10.639  -4.633
  735    H    ALA  96           H        ALA  96 -11.088 -10.893   1.511
  736    HA   ALA  96           HA       ALA  96 -12.944  -8.975   2.316
  737   1HB   ALA  96          1HB       ALA  96 -13.699 -10.646   3.978
  738   2HB   ALA  96          2HB       ALA  96 -12.189 -11.558   3.762
  739   3HB   ALA  96          3HB       ALA  96 -13.342 -11.409   2.416
  740    H    THR  97           H        THR  97 -10.016 -10.084   4.118
  741    HA   THR  97           HA       THR  97 -10.605  -8.581   6.501
  742    HB   THR  97           HB       THR  97  -7.930  -9.604   5.444
  743    HG1  THR  97           HG1      THR  97  -9.952 -10.899   6.962
  744   1HG2  THR  97          1HG2      THR  97  -8.944  -9.111   8.283
  745   2HG2  THR  97          2HG2      THR  97  -7.384  -9.837   7.843
  746   3HG2  THR  97          3HG2      THR  97  -7.718  -8.146   7.430
  747    H    ILE  98           H        ILE  98  -8.487  -8.067   3.653
  748    HA   ILE  98           HA       ILE  98  -7.379  -5.558   4.446
  749    HB   ILE  98           HB       ILE  98  -7.913  -6.726   1.671
  750   1HG1  ILE  98          2HG1      ILE  98  -5.412  -6.765   3.417
  751   2HG1  ILE  98          1HG1      ILE  98  -6.499  -8.129   3.119
  752   1HG2  ILE  98          1HG2      ILE  98  -7.534  -4.243   1.591
  753   2HG2  ILE  98          2HG2      ILE  98  -6.078  -4.438   2.586
  754   3HG2  ILE  98          3HG2      ILE  98  -6.138  -5.086   0.938
  755   1HD1  ILE  98          1HD1      ILE  98  -5.994  -7.977   0.672
  756   2HD1  ILE  98          2HD1      ILE  98  -4.622  -8.425   1.699
  757   3HD1  ILE  98          3HD1      ILE  98  -4.729  -6.784   1.057
  758    H    VAL  99           H        VAL  99 -10.194  -6.268   2.386
  759    HA   VAL  99           HA       VAL  99 -11.085  -3.667   1.877
  760    HB   VAL  99           HB       VAL  99 -12.494  -6.351   2.093
  761   1HG1  VAL  99          1HG1      VAL  99 -14.392  -5.223   0.855
  762   2HG1  VAL  99          2HG1      VAL  99 -13.665  -3.664   1.308
  763   3HG1  VAL  99          3HG1      VAL  99 -14.259  -4.782   2.558
  764   1HG2  VAL  99          1HG2      VAL  99 -11.849  -4.541  -0.287
  765   2HG2  VAL  99          2HG2      VAL  99 -10.854  -5.921   0.199
  766   3HG2  VAL  99          3HG2      VAL  99 -12.516  -6.184  -0.353
  767    H    GLN 100           H        GLN 100 -12.258  -5.895   4.527
  768    HA   GLN 100           HA       GLN 100 -13.910  -3.951   5.757
  769   1HB   GLN 100          1HB       GLN 100 -12.380  -6.342   6.846
  770   2HB   GLN 100          2HB       GLN 100 -13.452  -5.363   7.863
  771   1HG   GLN 100          1HG       GLN 100 -15.366  -5.811   6.516
  772   2HG   GLN 100          2HG       GLN 100 -14.416  -6.591   5.248
  773   1HE2  GLN 100          1HE2      GLN 100 -13.107  -8.506   5.945
  774   2HE2  GLN 100          2HE2      GLN 100 -13.863  -9.635   7.086
  775    H    THR 101           H        THR 101 -10.462  -4.687   6.359
  776    HA   THR 101           HA       THR 101 -10.151  -2.854   8.511
  777    HB   THR 101           HB       THR 101  -8.024  -3.815   6.550
  778    HG1  THR 101           HG1      THR 101  -9.076  -5.550   7.495
  779   1HG2  THR 101          1HG2      THR 101  -7.890  -2.759   9.418
  780   2HG2  THR 101          2HG2      THR 101  -7.192  -1.993   7.974
  781   3HG2  THR 101          3HG2      THR 101  -6.546  -3.533   8.564
  782    H    VAL 102           H        VAL 102  -9.655  -2.341   4.947
  783    HA   VAL 102           HA       VAL 102  -8.738   0.360   5.446
  784    HB   VAL 102           HB       VAL 102  -8.277  -1.223   3.479
  785   1HG1  VAL 102          1HG2      VAL 102  -7.668   0.699   2.079
  786   2HG1  VAL 102          2HG2      VAL 102  -7.372   1.077   3.777
  787   3HG1  VAL 102          3HG2      VAL 102  -8.808   1.736   2.974
  788   1HG2  VAL 102          1HG1      VAL 102 -10.667   0.147   2.227
  789   2HG2  VAL 102          2HG1      VAL 102  -9.441  -0.845   1.415
  790   3HG2  VAL 102          3HG1      VAL 102 -10.501  -1.587   2.605
  791    H    GLU 103           HN       GLU 103 -11.801  -1.061   4.396
  792    HA   GLU 103           HA       GLU 103 -13.361   1.243   4.065
  793   1HB   GLU 103          1HB       GLU 103 -14.046  -1.521   5.137
  794   2HB   GLU 103          2HB       GLU 103 -15.252  -0.253   4.925
  795   1HG   GLU 103          1HG       GLU 103 -14.786  -0.046   2.560
  796   2HG   GLU 103          2HG       GLU 103 -13.534  -1.286   2.640
  797    H    LYS 104           HN       LYS 104 -12.708  -0.542   7.085
  798    HA   LYS 104           HA       LYS 104 -14.204   0.939   8.912
  799   1HB   LYS 104          2HB       LYS 104 -12.925  -0.988   9.581
  800   2HB   LYS 104          1HB       LYS 104 -11.403  -0.207   9.127
  801   1HG   LYS 104          1HG       LYS 104 -11.911   1.549  10.953
  802   2HG   LYS 104          2HG       LYS 104 -13.136   0.425  11.530
  803   1HD   LYS 104          2HD       LYS 104 -10.154  -0.179  11.107
  804   2HD   LYS 104          1HD       LYS 104 -10.854   0.393  12.617
  805   1HE   LYS 104          1HE       LYS 104 -10.678  -1.917  12.957
  806   2HE   LYS 104          2HE       LYS 104 -12.387  -1.695  12.556
  807   1HZ   LYS 104          1HZ       LYS 104 -11.844  -2.406  10.317
  808   2HZ   LYS 104          2HZ       LYS 104 -10.257  -2.570  10.722
  809   3HZ   LYS 104          3HZ       LYS 104 -11.390  -3.542  11.415
  810    H    TYR 105           H        TYR 105 -11.036   1.831   7.449
  811    HA   TYR 105           HA       TYR 105 -10.861   4.261   9.087
  812   1HB   TYR 105          1HB       TYR 105  -9.166   3.660   6.670
  813   2HB   TYR 105          2HB       TYR 105  -8.808   4.588   8.133
  814    HD1  TYR 105           HD1      TYR 105  -9.369   2.801  10.357
  815    HD2  TYR 105           HD2      TYR 105  -7.461   2.070   6.566
  816    HE1  TYR 105           HE1      TYR 105  -7.967   1.051  11.398
  817    HE2  TYR 105           HE2      TYR 105  -6.056   0.314   7.611
  818    HH   TYR 105           HH       TYR 105  -6.269  -0.488  11.080
  819    H    LEU 106           H        LEU 106 -11.638   3.348   5.732
  820    HA   LEU 106           HA       LEU 106 -12.229   6.170   4.981
  821   1HB   LEU 106          2HB       LEU 106 -12.213   3.573   3.376
  822   2HB   LEU 106          1HB       LEU 106 -12.530   5.192   2.722
  823    HG   LEU 106           HG       LEU 106  -9.932   4.166   3.942
  824   1HD1  LEU 106          1HD2      LEU 106 -10.082   6.557   4.425
  825   2HD1  LEU 106          2HD2      LEU 106 -10.602   6.898   2.757
  826   3HD1  LEU 106          3HD2      LEU 106  -8.961   6.300   3.087
  827   1HD2  LEU 106          1HD1      LEU 106  -9.106   4.362   1.632
  828   2HD2  LEU 106          2HD1      LEU 106 -10.704   4.886   1.067
  829   3HD2  LEU 106          3HD1      LEU 106 -10.491   3.253   1.716
  830    H    ASN 107           H        ASN 107 -14.134   3.632   3.495
  831    HA   ASN 107           HA       ASN 107 -16.351   3.567   5.188
  832   1HB   ASN 107          1HB       ASN 107 -16.533   5.931   4.100
  833   2HB   ASN 107          2HB       ASN 107 -16.735   5.085   2.563
  834   1HD2  ASN 107          1HD2      ASN 107 -18.409   2.880   3.554
  835   2HD2  ASN 107          2HD2      ASN 107 -19.951   3.618   4.008
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1  -6.341  -3.862 -13.234
    2   2H    MET   1          2H        MET   1  -5.815  -3.534 -11.714
    3   3H    MET   1          3H        MET   1  -6.902  -2.543 -12.451
    4    HA   MET   1           HA       MET   1  -4.063  -2.816 -13.090
    5   1HB   MET   1          2HB       MET   1  -4.513  -1.464 -15.123
    6   2HB   MET   1          1HB       MET   1  -5.205  -3.075 -15.201
    7   1HG   MET   1          1HG       MET   1  -6.861  -0.644 -14.362
    8   2HG   MET   1          2HG       MET   1  -6.642  -1.117 -16.045
    9   1HE   MET   1          1HE       MET   1  -7.726  -3.067 -17.226
   10   2HE   MET   1          2HE       MET   1  -8.681  -4.338 -16.434
   11   3HE   MET   1          3HE       MET   1  -6.924  -4.273 -16.187
   12    H    GLU   2           HN       GLU   2  -4.954  -1.787 -10.651
   13    HA   GLU   2           HA       GLU   2  -4.846   1.186 -10.999
   14   1HB   GLU   2          2HB       GLU   2  -6.059  -0.401  -8.706
   15   2HB   GLU   2          1HB       GLU   2  -6.031   1.351  -8.918
   16   1HG   GLU   2          2HG       GLU   2  -8.203   0.771  -9.612
   17   2HG   GLU   2          1HG       GLU   2  -7.323   0.956 -11.135
   18    H    ALA   3           H        ALA   3  -3.588  -1.652  -9.293
   19    HA   ALA   3           HA       ALA   3  -2.001  -0.253  -7.376
   20   1HB   ALA   3          1HB       ALA   3  -1.720  -3.042  -8.553
   21   2HB   ALA   3          2HB       ALA   3  -0.886  -2.430  -7.106
   22   3HB   ALA   3          3HB       ALA   3  -2.646  -2.576  -7.109
   23    H    GLY   4           H        GLY   4  -0.725   1.420  -8.321
   24   1HA   GLY   4          2HA       GLY   4   1.062   0.856 -10.572
   25   2HA   GLY   4          1HA       GLY   4   1.029   2.304  -9.554
   26    H    ALA   5           H        ALA   5   3.510   1.862  -9.900
   27    HA   ALA   5           HA       ALA   5   4.527   0.232  -7.621
   28   1HB   ALA   5          1HB       ALA   5   5.781   0.534 -10.376
   29   2HB   ALA   5          2HB       ALA   5   6.506  -0.289  -8.977
   30   3HB   ALA   5          3HB       ALA   5   5.033  -0.943  -9.723
   31    H    VAL   6           H        VAL   6   6.095   1.327  -6.372
   32    HA   VAL   6           HA       VAL   6   7.058   3.962  -7.343
   33    HB   VAL   6           HB       VAL   6   6.529   4.820  -4.915
   34   1HG1  VAL   6          1HG1      VAL   6   4.364   2.689  -5.123
   35   2HG1  VAL   6          2HG1      VAL   6   4.409   4.034  -3.974
   36   3HG1  VAL   6          3HG1      VAL   6   5.647   2.789  -3.919
   37   1HG2  VAL   6          1HG2      VAL   6   4.454   4.628  -7.089
   38   2HG2  VAL   6          2HG2      VAL   6   4.337   5.667  -5.648
   39   3HG2  VAL   6          3HG2      VAL   6   5.646   5.904  -6.811
   40    H    ASN   7           H        ASN   7   8.577   4.954  -5.853
   41    HA   ASN   7           HA       ASN   7  10.160   3.186  -4.168
   42   1HB   ASN   7          2HB       ASN   7  11.319   2.859  -6.249
   43   2HB   ASN   7          1HB       ASN   7  11.177   4.579  -6.678
   44   1HD2  ASN   7          2HD2      ASN   7  12.508   2.758  -3.811
   45   2HD2  ASN   7          1HD2      ASN   7  14.091   3.469  -3.924
   46    H    ASP   8           HN       ASP   8  11.882   4.689  -3.177
   47    HA   ASP   8           HA       ASP   8  10.856   6.537  -1.497
   48   1HB   ASP   8          2HB       ASP   8  13.623   6.728  -2.808
   49   2HB   ASP   8          1HB       ASP   8  13.119   7.626  -1.374
   50    H    ASP   9           HN       ASP   9  12.138   7.394  -4.694
   51    HA   ASP   9           HA       ASP   9  11.605  10.222  -4.466
   52   1HB   ASP   9          1HB       ASP   9  13.231   9.422  -6.065
   53   2HB   ASP   9          2HB       ASP   9  12.052   8.406  -6.884
   54    H    THR  10           H        THR  10  10.050   7.994  -6.776
   55    HA   THR  10           HA       THR  10   7.914   9.579  -7.492
   56    HB   THR  10           HB       THR  10   6.847   7.350  -8.140
   57    HG1  THR  10           HG1      THR  10   8.413   5.595  -7.935
   58   1HG2  THR  10          1HG2      THR  10   8.358   8.616  -9.637
   59   2HG2  THR  10          2HG2      THR  10   9.764   7.798  -8.933
   60   3HG2  THR  10          3HG2      THR  10   8.555   6.869  -9.841
   61    H    PHE  11           H        PHE  11   8.066   7.354  -4.771
   62    HA   PHE  11           HA       PHE  11   5.569   7.126  -3.728
   63   1HB   PHE  11          1HB       PHE  11   7.639   6.316  -2.712
   64   2HB   PHE  11          2HB       PHE  11   8.155   7.937  -2.336
   65    HD1  PHE  11           HD1      PHE  11   7.849   8.707  -0.146
   66    HD2  PHE  11           HD2      PHE  11   5.343   5.545  -1.661
   67    HE1  PHE  11           HE1      PHE  11   6.927   8.352   2.117
   68    HE2  PHE  11           HE2      PHE  11   4.335   5.268   0.590
   69    HZ   PHE  11           HZ       PHE  11   5.162   6.630   2.490
   70    H    LYS  12           HN       LYS  12   7.673   9.895  -3.405
   71    HA   LYS  12           HA       LYS  12   6.259  11.608  -1.688
   72   1HB   LYS  12          1HB       LYS  12   7.882  12.249  -4.190
   73   2HB   LYS  12          2HB       LYS  12   7.202  13.470  -3.137
   74   1HG   LYS  12          1HG       LYS  12   8.540  12.601  -1.226
   75   2HG   LYS  12          2HG       LYS  12   9.050  11.207  -2.190
   76   1HD   LYS  12          2HD       LYS  12  10.871  12.770  -2.100
   77   2HD   LYS  12          1HD       LYS  12  10.260  12.676  -3.758
   78   1HE   LYS  12          1HE       LYS  12   9.029  14.808  -3.442
   79   2HE   LYS  12          2HE       LYS  12   9.543  14.869  -1.744
   80   1HZ   LYS  12          1HZ       LYS  12  11.314  14.953  -4.085
   81   2HZ   LYS  12          2HZ       LYS  12  11.800  15.024  -2.511
   82   3HZ   LYS  12          3HZ       LYS  12  10.887  16.240  -3.149
   83    H    ASN  13           H        ASN  13   6.081  11.821  -5.272
   84    HA   ASN  13           HA       ASN  13   3.838  13.622  -5.102
   85   1HB   ASN  13          2HB       ASN  13   5.552  13.466  -7.006
   86   2HB   ASN  13          1HB       ASN  13   4.711  12.037  -7.561
   87   1HD2  ASN  13          1HD2      ASN  13   3.880  15.396  -6.402
   88   2HD2  ASN  13          2HD2      ASN  13   2.713  15.674  -7.691
   89    H    VAL  14           H        VAL  14   4.337  10.253  -5.914
   90    HA   VAL  14           HA       VAL  14   1.732   9.941  -6.980
   91    HB   VAL  14           HB       VAL  14   3.830   7.911  -6.081
   92   1HG1  VAL  14          1HG1      VAL  14   2.959   8.845  -8.856
   93   2HG1  VAL  14          2HG1      VAL  14   4.435   9.373  -8.032
   94   3HG1  VAL  14          3HG1      VAL  14   4.250   7.680  -8.505
   95   1HG2  VAL  14          1HG2      VAL  14   2.615   6.245  -7.523
   96   2HG2  VAL  14          2HG2      VAL  14   1.245   7.363  -7.600
   97   3HG2  VAL  14          3HG2      VAL  14   1.751   6.668  -6.043
   98    H    VAL  15           H        VAL  15   3.091   9.383  -3.751
   99    HA   VAL  15           HA       VAL  15   0.473   8.366  -2.755
  100    HB   VAL  15           HB       VAL  15   3.183   8.214  -1.374
  101   1HG1  VAL  15          1HG1      VAL  15   0.632   6.679  -0.852
  102   2HG1  VAL  15          2HG1      VAL  15   1.096   8.141   0.040
  103   3HG1  VAL  15          3HG1      VAL  15   2.136   6.731   0.110
  104   1HG2  VAL  15          1HG2      VAL  15   3.347   6.926  -3.429
  105   2HG2  VAL  15          2HG2      VAL  15   1.767   6.185  -3.123
  106   3HG2  VAL  15          3HG2      VAL  15   3.140   5.832  -2.059
  107    H    LEU  16           H        LEU  16   3.187  10.273  -1.348
  108    HA   LEU  16           HA       LEU  16   1.629  11.277   0.762
  109   1HB   LEU  16          1HB       LEU  16   4.021  12.707  -0.460
  110   2HB   LEU  16          2HB       LEU  16   3.376  12.873   1.160
  111    HG   LEU  16           HG       LEU  16   4.740  10.401  -0.010
  112   1HD1  LEU  16          1HD1      LEU  16   6.461  10.909   1.646
  113   2HD1  LEU  16          2HD1      LEU  16   5.520  12.294   2.244
  114   3HD1  LEU  16          3HD1      LEU  16   6.200  12.321   0.605
  115   1HD2  LEU  16          1HD2      LEU  16   3.007   9.602   1.519
  116   2HD2  LEU  16          2HD2      LEU  16   3.466  10.825   2.728
  117   3HD2  LEU  16          3HD2      LEU  16   4.569   9.499   2.332
  118    H    GLU  17           HN       GLU  17   2.501  13.008  -2.250
  119    HA   GLU  17           HA       GLU  17   0.697  15.226  -1.595
  120   1HB   GLU  17          1HB       GLU  17   2.137  14.642  -4.196
  121   2HB   GLU  17          2HB       GLU  17   1.457  16.182  -3.681
  122   1HG   GLU  17          2HG       GLU  17   3.058  16.287  -1.786
  123   2HG   GLU  17          1HG       GLU  17   3.830  14.797  -2.341
  124    H    SER  18           H        SER  18  -0.341  12.228  -2.381
  125    HA   SER  18           HA       SER  18  -1.852  12.703  -4.779
  126   1HB   SER  18          2HB       SER  18  -1.361  10.456  -3.893
  127   2HB   SER  18          1HB       SER  18  -2.398  10.789  -2.483
  128    HG   SER  18           HG       SER  18  -4.099  10.425  -3.692
  129    H    SER  19           H        SER  19  -4.167  13.094  -4.932
  130    HA   SER  19           HA       SER  19  -5.173  15.097  -3.049
  131   1HB   SER  19          2HB       SER  19  -7.090  14.988  -4.774
  132   2HB   SER  19          1HB       SER  19  -5.503  15.513  -5.377
  133    HG   SER  19           HG       SER  19  -6.382  13.897  -6.739
  134    H    VAL  20           H        VAL  20  -6.476  12.150  -4.525
  135    HA   VAL  20           HA       VAL  20  -8.272  11.641  -2.271
  136    HB   VAL  20           HB       VAL  20  -8.929   9.623  -3.526
  137   1HG1  VAL  20          1HG2      VAL  20  -6.825  10.411  -5.592
  138   2HG1  VAL  20          2HG2      VAL  20  -6.774   8.974  -4.549
  139   3HG1  VAL  20          3HG2      VAL  20  -8.051   9.143  -5.756
  140   1HG2  VAL  20          1HG1      VAL  20  -9.919  10.743  -5.447
  141   2HG2  VAL  20          2HG1      VAL  20  -8.766  12.085  -5.315
  142   3HG2  VAL  20          3HG1      VAL  20  -9.968  11.811  -4.035
  143    HA   PRO  21           HA       PRO  21  -5.556   9.139   0.169
  144   1HB   PRO  21          1HB       PRO  21  -7.730   7.030   0.132
  145   2HB   PRO  21          2HB       PRO  21  -6.810   7.603   1.544
  146   1HG   PRO  21          1HG       PRO  21  -9.291   8.476   1.083
  147   2HG   PRO  21          2HG       PRO  21  -8.041   9.639   1.617
  148   1HD   PRO  21          1HD       PRO  21  -9.196   9.304  -1.147
  149   2HD   PRO  21          2HD       PRO  21  -8.628  10.762  -0.297
  150    H    VAL  22           H        VAL  22  -4.464   6.997   0.289
  151    HA   VAL  22           HA       VAL  22  -4.346   5.545  -2.277
  152    HB   VAL  22           HB       VAL  22  -1.912   6.786  -0.923
  153   1HG1  VAL  22          1HG2      VAL  22  -0.937   6.267  -3.205
  154   2HG1  VAL  22          2HG2      VAL  22  -2.421   5.340  -3.527
  155   3HG1  VAL  22          3HG2      VAL  22  -1.352   4.868  -2.191
  156   1HG2  VAL  22          1HG1      VAL  22  -3.160   8.681  -1.740
  157   2HG2  VAL  22          2HG1      VAL  22  -3.446   7.884  -3.302
  158   3HG2  VAL  22          3HG1      VAL  22  -1.813   8.363  -2.831
  159    H    LEU  23           H        LEU  23  -3.622   3.435  -2.083
  160    HA   LEU  23           HA       LEU  23  -2.937   2.372   0.613
  161   1HB   LEU  23          2HB       LEU  23  -4.885   1.467  -0.672
  162   2HB   LEU  23          1HB       LEU  23  -3.810   0.927  -1.937
  163    HG   LEU  23           HG       LEU  23  -3.133   0.051   0.866
  164   1HD1  LEU  23          1HD1      LEU  23  -1.795  -0.722  -1.118
  165   2HD1  LEU  23          2HD1      LEU  23  -3.281  -1.395  -1.819
  166   3HD1  LEU  23          3HD1      LEU  23  -2.620  -2.079  -0.333
  167   1HD2  LEU  23          1HD2      LEU  23  -4.782  -1.801   0.769
  168   2HD2  LEU  23          2HD2      LEU  23  -5.514  -1.065  -0.673
  169   3HD2  LEU  23          3HD2      LEU  23  -5.560  -0.217   0.892
  170    H    VAL  24           H        VAL  24  -0.795   1.655   0.908
  171    HA   VAL  24           HA       VAL  24   0.922   1.369  -1.544
  172    HB   VAL  24           HB       VAL  24   1.729   2.583   1.107
  173   1HG1  VAL  24          1HG1      VAL  24   3.265   2.132  -1.500
  174   2HG1  VAL  24          2HG1      VAL  24   3.572   1.292   0.033
  175   3HG1  VAL  24          3HG1      VAL  24   3.868   3.024  -0.090
  176   1HG2  VAL  24          1HG2      VAL  24   0.368   4.157  -0.209
  177   2HG2  VAL  24          2HG2      VAL  24   2.080   4.599  -0.280
  178   3HG2  VAL  24          3HG2      VAL  24   1.321   3.796  -1.667
  179    H    ASP  25           HN       ASP  25   1.327  -0.773  -1.749
  180    HA   ASP  25           HA       ASP  25   1.644  -2.436   0.713
  181   1HB   ASP  25          1HB       ASP  25   0.319  -3.445  -1.070
  182   2HB   ASP  25          2HB       ASP  25   1.648  -3.199  -2.219
  183    H    PHE  26           H        PHE  26   3.678  -2.459   1.610
  184    HA   PHE  26           HA       PHE  26   6.030  -1.681  -0.018
  185   1HB   PHE  26          1HB       PHE  26   5.618  -2.479   2.873
  186   2HB   PHE  26          2HB       PHE  26   7.207  -2.378   2.138
  187    HD1  PHE  26           HD1      PHE  26   8.398  -0.400   2.380
  188    HD2  PHE  26           HD2      PHE  26   4.081  -0.200   2.304
  189    HE1  PHE  26           HE1      PHE  26   8.486   1.941   3.138
  190    HE2  PHE  26           HE2      PHE  26   4.204   2.214   2.795
  191    HZ   PHE  26           HZ       PHE  26   6.372   3.233   3.467
  192    H    TRP  27           H        TRP  27   6.889  -3.189  -1.363
  193    HA   TRP  27           HA       TRP  27   6.711  -6.073  -0.598
  194   1HB   TRP  27          2HB       TRP  27   6.105  -6.641  -2.844
  195   2HB   TRP  27          1HB       TRP  27   4.972  -5.421  -2.298
  196    HD1  TRP  27           HD1      TRP  27   5.620  -2.868  -3.219
  197    HE1  TRP  27           HE1      TRP  27   6.719  -2.067  -5.431
  198    HE3  TRP  27           HE3      TRP  27   7.435  -7.337  -4.834
  199    HZ2  TRP  27           HZ2      TRP  27   8.423  -3.217  -7.436
  200    HZ3  TRP  27           HZ3      TRP  27   8.856  -7.451  -6.882
  201    HH2  TRP  27           HH2      TRP  27   9.328  -5.410  -8.193
  202    H    ALA  28           H        ALA  28   8.018  -7.265  -2.548
  203    HA   ALA  28           HA       ALA  28  10.306  -5.944  -3.573
  204   1HB   ALA  28          1HB       ALA  28  11.091  -6.182  -1.163
  205   2HB   ALA  28          2HB       ALA  28  12.052  -7.181  -2.247
  206   3HB   ALA  28          3HB       ALA  28  10.786  -7.930  -1.274
  207    HA   PRO  29           HA       PRO  29   9.681  -9.470  -6.204
  208   1HB   PRO  29          1HB       PRO  29  12.198 -10.288  -6.990
  209   2HB   PRO  29          2HB       PRO  29  11.342  -8.844  -7.615
  210   1HG   PRO  29          2HG       PRO  29  13.427  -8.955  -5.428
  211   2HG   PRO  29          1HG       PRO  29  13.344  -7.817  -6.803
  212   1HD   PRO  29          1HD       PRO  29  12.442  -7.090  -4.364
  213   2HD   PRO  29          2HD       PRO  29  11.496  -6.656  -5.799
  214    H    TRP  30           H        TRP  30  12.231  -9.956  -3.754
  215    HA   TRP  30           HA       TRP  30  11.825 -12.815  -3.552
  216   1HB   TRP  30          1HB       TRP  30  13.215 -12.547  -1.508
  217   2HB   TRP  30          2HB       TRP  30  13.938 -11.884  -2.966
  218    HD1  TRP  30           HD1      TRP  30  14.630  -9.412  -2.963
  219    HE1  TRP  30           HE1      TRP  30  14.702  -7.546  -1.209
  220    HE3  TRP  30           HE3      TRP  30  11.590 -11.516   0.605
  221    HZ2  TRP  30           HZ2      TRP  30  13.503  -6.982   1.343
  222    HZ3  TRP  30           HZ3      TRP  30  11.027 -10.254   2.646
  223    HH2  TRP  30           HH2      TRP  30  11.909  -7.964   2.996
  224    H    CYS  31           H        CYS  31   9.789 -10.211  -2.580
  225    HA   CYS  31           HA       CYS  31   8.988 -11.427  -0.012
  226   1HB   CYS  31          1HB       CYS  31   8.823  -9.001  -0.284
  227   2HB   CYS  31          2HB       CYS  31   7.706  -9.230  -1.620
  228    H    GLY  32           H        GLY  32   8.655 -13.552  -0.936
  229   1HA   GLY  32          1HA       GLY  32   7.023 -14.577  -2.758
  230   2HA   GLY  32          2HA       GLY  32   7.016 -15.236  -1.122
  231    HA   PRO  33           HA       PRO  33   2.841 -14.113  -0.370
  232   1HB   PRO  33          2HB       PRO  33   3.506 -11.871   1.503
  233   2HB   PRO  33          1HB       PRO  33   2.366 -13.221   1.746
  234   1HG   PRO  33          1HG       PRO  33   4.775 -13.231   2.931
  235   2HG   PRO  33          2HG       PRO  33   4.163 -14.737   2.175
  236   1HD   PRO  33          1HD       PRO  33   6.176 -12.791   1.028
  237   2HD   PRO  33          2HD       PRO  33   6.202 -14.576   1.007
  238    H    CYS  34           H        CYS  34   4.869 -11.215  -0.782
  239    HA   CYS  34           HA       CYS  34   2.835  -9.296  -1.395
  240   1HB   CYS  34          2HB       CYS  34   5.637  -9.313  -2.474
  241   2HB   CYS  34          1HB       CYS  34   4.445  -8.025  -2.455
  242    H    ARG  35           HN       ARG  35   4.802 -11.507  -3.447
  243    HA   ARG  35           HA       ARG  35   3.821 -10.671  -5.960
  244   1HB   ARG  35          2HB       ARG  35   4.706 -13.477  -5.129
  245   2HB   ARG  35          1HB       ARG  35   4.626 -12.821  -6.755
  246   1HG   ARG  35          1HG       ARG  35   6.567 -12.084  -4.539
  247   2HG   ARG  35          2HG       ARG  35   6.921 -12.800  -6.104
  248   1HD   ARG  35          1HD       ARG  35   5.990  -9.960  -5.547
  249   2HD   ARG  35          2HD       ARG  35   7.583 -10.480  -6.110
  250    HE   ARG  35           HE       ARG  35   5.940 -11.485  -8.043
  251   1HH1  ARG  35          1HH1      ARG  35   6.386  -8.247  -6.709
  252   2HH1  ARG  35          2HH1      ARG  35   5.868  -7.421  -8.151
  253   1HH2  ARG  35          1HH2      ARG  35   5.254 -10.430  -9.933
  254   2HH2  ARG  35          2HH2      ARG  35   5.219  -8.691 -10.024
  255    H    ILE  36           H        ILE  36   2.650 -13.374  -3.895
  256    HA   ILE  36           HA       ILE  36   0.499 -13.959  -5.775
  257    HB   ILE  36           HB       ILE  36  -0.291 -15.523  -4.037
  258   1HG1  ILE  36          1HG1      ILE  36   2.181 -14.776  -2.430
  259   2HG1  ILE  36          2HG1      ILE  36   0.588 -14.078  -2.091
  260   1HG2  ILE  36          1HG2      ILE  36   1.645 -17.038  -4.239
  261   2HG2  ILE  36          2HG2      ILE  36   2.715 -15.673  -4.610
  262   3HG2  ILE  36          3HG2      ILE  36   1.429 -16.133  -5.742
  263   1HD1  ILE  36          1HD1      ILE  36   0.952 -15.895  -0.614
  264   2HD1  ILE  36          2HD1      ILE  36   1.228 -17.013  -1.971
  265   3HD1  ILE  36          3HD1      ILE  36  -0.378 -16.266  -1.733
  266    H    ILE  37           H        ILE  37   0.699 -11.992  -2.828
  267    HA   ILE  37           HA       ILE  37  -2.156 -11.480  -2.728
  268    HB   ILE  37           HB       ILE  37   0.219 -10.135  -1.388
  269   1HG1  ILE  37          2HG1      ILE  37  -1.950 -11.990  -0.257
  270   2HG1  ILE  37          1HG1      ILE  37  -0.399 -12.585  -0.818
  271   1HG2  ILE  37          1HG2      ILE  37  -1.698  -8.543  -1.453
  272   2HG2  ILE  37          2HG2      ILE  37  -1.408  -9.113   0.168
  273   3HG2  ILE  37          3HG2      ILE  37  -2.753  -9.791  -0.766
  274   1HD1  ILE  37          1HD1      ILE  37   0.746 -11.071   0.836
  275   2HD1  ILE  37          2HD1      ILE  37  -0.856 -10.742   1.543
  276   3HD1  ILE  37          3HD1      ILE  37  -0.221 -12.391   1.520
  277    H    ALA  38           H        ALA  38   0.498  -9.957  -4.535
  278    HA   ALA  38           HA       ALA  38  -0.294  -7.499  -5.149
  279   1HB   ALA  38          1HB       ALA  38   0.613  -7.769  -7.388
  280   2HB   ALA  38          2HB       ALA  38   1.592  -8.667  -6.217
  281   3HB   ALA  38          3HB       ALA  38   0.471  -9.529  -7.290
  282    HA   PRO  39           HA       PRO  39  -3.772  -8.611  -8.331
  283   1HB   PRO  39          2HB       PRO  39  -4.926 -11.135  -7.229
  284   2HB   PRO  39          1HB       PRO  39  -4.622 -10.697  -8.931
  285   1HG   PRO  39          2HG       PRO  39  -3.052 -12.533  -7.645
  286   2HG   PRO  39          1HG       PRO  39  -2.324 -11.331  -8.758
  287   1HD   PRO  39          1HD       PRO  39  -2.632 -11.098  -5.745
  288   2HD   PRO  39          2HD       PRO  39  -1.121 -10.982  -6.704
  289    H    VAL  40           H        VAL  40  -3.902  -9.679  -4.949
  290    HA   VAL  40           HA       VAL  40  -6.611  -8.887  -4.388
  291    HB   VAL  40           HB       VAL  40  -4.284  -9.365  -2.479
  292   1HG1  VAL  40          1HG1      VAL  40  -5.996  -9.715  -0.837
  293   2HG1  VAL  40          2HG1      VAL  40  -7.245  -9.222  -2.025
  294   3HG1  VAL  40          3HG1      VAL  40  -6.003  -8.066  -1.469
  295   1HG2  VAL  40          1HG2      VAL  40  -4.746 -11.395  -3.839
  296   2HG2  VAL  40          2HG2      VAL  40  -6.478 -11.236  -3.474
  297   3HG2  VAL  40          3HG2      VAL  40  -5.317 -11.596  -2.179
  298    H    VAL  41           H        VAL  41  -3.337  -7.501  -3.890
  299    HA   VAL  41           HA       VAL  41  -4.008  -5.027  -2.722
  300    HB   VAL  41           HB       VAL  41  -1.820  -5.528  -4.805
  301   1HG1  VAL  41          1HG1      VAL  41  -1.483  -7.060  -3.004
  302   2HG1  VAL  41          2HG1      VAL  41  -0.307  -5.773  -2.847
  303   3HG1  VAL  41          3HG1      VAL  41  -1.732  -5.796  -1.780
  304   1HG2  VAL  41          1HG2      VAL  41  -2.042  -3.210  -4.630
  305   2HG2  VAL  41          2HG2      VAL  41  -2.215  -3.246  -2.856
  306   3HG2  VAL  41          3HG2      VAL  41  -0.664  -3.616  -3.626
  307    H    ASP  42           HN       ASP  42  -3.925  -5.960  -6.169
  308    HA   ASP  42           HA       ASP  42  -4.734  -3.401  -7.164
  309   1HB   ASP  42          2HB       ASP  42  -3.599  -5.308  -8.421
  310   2HB   ASP  42          1HB       ASP  42  -5.159  -6.104  -8.526
  311    H    GLU  43           HN       GLU  43  -6.710  -6.431  -7.010
  312    HA   GLU  43           HA       GLU  43  -9.055  -5.133  -7.870
  313   1HB   GLU  43          1HB       GLU  43 -10.208  -7.065  -7.352
  314   2HB   GLU  43          2HB       GLU  43  -8.585  -7.624  -7.770
  315   1HG   GLU  43          1HG       GLU  43  -8.108  -7.650  -5.261
  316   2HG   GLU  43          2HG       GLU  43  -9.839  -7.403  -4.987
  317    H    ILE  44           H        ILE  44  -7.859  -5.546  -4.480
  318    HA   ILE  44           HA       ILE  44 -10.244  -4.508  -3.268
  319    HB   ILE  44           HB       ILE  44  -7.334  -4.561  -2.352
  320   1HG1  ILE  44          2HG1      ILE  44  -9.879  -6.118  -1.662
  321   2HG1  ILE  44          1HG1      ILE  44  -8.492  -6.744  -2.556
  322   1HG2  ILE  44          1HG2      ILE  44  -8.140  -3.917  -0.111
  323   2HG2  ILE  44          2HG2      ILE  44  -9.788  -3.721  -0.748
  324   3HG2  ILE  44          3HG2      ILE  44  -8.474  -2.634  -1.251
  325   1HD1  ILE  44          1HD1      ILE  44  -8.628  -6.038   0.393
  326   2HD1  ILE  44          2HD1      ILE  44  -8.299  -7.605  -0.348
  327   3HD1  ILE  44          3HD1      ILE  44  -7.091  -6.305  -0.465
  328    H    ALA  45           H        ALA  45  -7.402  -2.930  -4.788
  329    HA   ALA  45           HA       ALA  45  -8.162  -0.270  -3.990
  330   1HB   ALA  45          1HB       ALA  45  -6.686   0.476  -5.675
  331   2HB   ALA  45          2HB       ALA  45  -6.724  -1.045  -6.561
  332   3HB   ALA  45          3HB       ALA  45  -5.958  -1.008  -4.965
  333    H    GLY  46           H        GLY  46  -8.733  -2.253  -6.948
  334   1HA   GLY  46          1HA       GLY  46 -10.279  -0.593  -8.497
  335   2HA   GLY  46          2HA       GLY  46 -10.550  -2.339  -8.357
  336    H    GLU  47           HN       GLU  47 -11.539  -2.760  -5.923
  337    HA   GLU  47           HA       GLU  47 -14.246  -2.157  -5.994
  338   1HB   GLU  47          1HB       GLU  47 -12.362  -2.785  -3.681
  339   2HB   GLU  47          2HB       GLU  47 -14.089  -2.601  -3.471
  340   1HG   GLU  47          1HG       GLU  47 -14.505  -4.406  -5.137
  341   2HG   GLU  47          2HG       GLU  47 -12.765  -4.617  -5.356
  342    H    TYR  48           H        TYR  48 -11.679  -0.192  -4.591
  343    HA   TYR  48           HA       TYR  48 -13.653   1.945  -3.836
  344   1HB   TYR  48          1HB       TYR  48 -10.937   1.393  -2.615
  345   2HB   TYR  48          2HB       TYR  48 -12.158   2.517  -2.018
  346    HD1  TYR  48           HD1      TYR  48 -14.568   1.266  -1.581
  347    HD2  TYR  48           HD2      TYR  48 -10.661  -0.555  -1.367
  348    HE1  TYR  48           HE1      TYR  48 -15.472  -0.510  -0.116
  349    HE2  TYR  48           HE2      TYR  48 -11.591  -2.363   0.044
  350    HH   TYR  48           HH       TYR  48 -14.983  -2.409   1.088
  351    H    LYS  49           HN       LYS  49 -12.075   1.486  -6.442
  352    HA   LYS  49           HA       LYS  49  -9.861   2.859  -6.873
  353   1HB   LYS  49          2HB       LYS  49 -11.145   1.788  -8.632
  354   2HB   LYS  49          1HB       LYS  49 -12.394   3.041  -8.559
  355   1HG   LYS  49          1HG       LYS  49 -10.819   4.719  -9.404
  356   2HG   LYS  49          2HG       LYS  49  -9.485   3.547  -9.329
  357   1HD   LYS  49          1HD       LYS  49 -10.500   2.190 -11.078
  358   2HD   LYS  49          2HD       LYS  49 -12.010   3.110 -10.990
  359   1HE   LYS  49          2HE       LYS  49 -10.711   3.761 -12.970
  360   2HE   LYS  49          1HE       LYS  49 -10.913   5.123 -11.858
  361   1HZ   LYS  49          1HZ       LYS  49  -8.513   3.442 -12.084
  362   2HZ   LYS  49          2HZ       LYS  49  -8.698   4.726 -11.065
  363   3HZ   LYS  49          3HZ       LYS  49  -8.689   4.963 -12.695
  364    H    ASP  50           HN       ASP  50 -12.945   4.600  -6.805
  365    HA   ASP  50           HA       ASP  50 -12.019   7.217  -7.309
  366   1HB   ASP  50          2HB       ASP  50 -14.381   6.529  -7.298
  367   2HB   ASP  50          1HB       ASP  50 -14.340   6.233  -5.571
  368    H    LYS  51           HN       LYS  51 -12.647   5.626  -4.247
  369    HA   LYS  51           HA       LYS  51 -11.845   7.875  -2.591
  370   1HB   LYS  51          2HB       LYS  51 -12.460   4.980  -1.888
  371   2HB   LYS  51          1HB       LYS  51 -12.425   6.345  -0.770
  372   1HG   LYS  51          1HG       LYS  51 -14.411   7.317  -1.649
  373   2HG   LYS  51          2HG       LYS  51 -14.383   6.321  -3.094
  374   1HD   LYS  51          2HD       LYS  51 -16.084   5.428  -1.685
  375   2HD   LYS  51          1HD       LYS  51 -14.757   4.270  -1.760
  376   1HE   LYS  51          1HE       LYS  51 -15.629   4.398   0.504
  377   2HE   LYS  51          2HE       LYS  51 -13.983   5.041   0.503
  378   1HZ   LYS  51          1HZ       LYS  51 -15.644   6.325   1.745
  379   2HZ   LYS  51          2HZ       LYS  51 -14.887   7.226   0.576
  380   3HZ   LYS  51          3HZ       LYS  51 -16.426   6.669   0.350
  381    H    LEU  52           H        LEU  52 -10.208   5.050  -3.895
  382    HA   LEU  52           HA       LEU  52  -7.841   5.587  -2.143
  383   1HB   LEU  52          2HB       LEU  52  -9.417   3.864  -1.218
  384   2HB   LEU  52          1HB       LEU  52  -9.248   2.958  -2.696
  385    HG   LEU  52           HG       LEU  52  -6.745   2.762  -2.129
  386   1HD1  LEU  52          1HD1      LEU  52  -7.814   3.760   0.556
  387   2HD1  LEU  52          2HD1      LEU  52  -6.222   3.048   0.310
  388   3HD1  LEU  52          3HD1      LEU  52  -6.626   4.597  -0.455
  389   1HD2  LEU  52          1HD2      LEU  52  -8.854   1.568  -0.275
  390   2HD2  LEU  52          2HD2      LEU  52  -7.212   0.937  -0.494
  391   3HD2  LEU  52          3HD2      LEU  52  -8.349   0.923  -1.849
  392    H    LYS  53           HN       LYS  53  -6.120   5.953  -3.478
  393    HA   LYS  53           HA       LYS  53  -5.931   4.654  -6.129
  394   1HB   LYS  53          2HB       LYS  53  -4.779   6.976  -4.782
  395   2HB   LYS  53          1HB       LYS  53  -3.484   5.923  -5.350
  396   1HG   LYS  53          1HG       LYS  53  -5.755   6.872  -7.117
  397   2HG   LYS  53          2HG       LYS  53  -4.175   7.663  -6.984
  398   1HD   LYS  53          2HD       LYS  53  -3.041   5.525  -7.650
  399   2HD   LYS  53          1HD       LYS  53  -4.618   4.778  -7.936
  400   1HE   LYS  53          1HE       LYS  53  -3.527   7.242  -9.371
  401   2HE   LYS  53          2HE       LYS  53  -3.604   5.598 -10.024
  402   1HZ   LYS  53          1HZ       LYS  53  -5.987   5.691  -9.814
  403   2HZ   LYS  53          2HZ       LYS  53  -5.912   7.235  -9.242
  404   3HZ   LYS  53          3HZ       LYS  53  -5.426   6.903 -10.779
  405    H    CYS  54           H        CYS  54  -3.694   3.367  -6.433
  406    HA   CYS  54           HA       CYS  54  -2.949   2.063  -3.901
  407   1HB   CYS  54          1HB       CYS  54  -4.821   0.795  -4.515
  408   2HB   CYS  54          2HB       CYS  54  -4.242   0.574  -6.206
  409    HG   CYS  54           HG       CYS  54  -3.969  -1.636  -4.733
  410    H    VAL  55           H        VAL  55  -0.952   1.194  -3.868
  411    HA   VAL  55           HA       VAL  55   0.591   1.128  -6.341
  412    HB   VAL  55           HB       VAL  55   1.923   2.859  -4.336
  413   1HG1  VAL  55          1HG1      VAL  55   0.778   4.936  -4.778
  414   2HG1  VAL  55          2HG1      VAL  55  -0.436   4.154  -5.777
  415   3HG1  VAL  55          3HG1      VAL  55  -0.356   3.820  -4.030
  416   1HG2  VAL  55          1HG2      VAL  55   2.752   2.432  -6.644
  417   2HG2  VAL  55          2HG2      VAL  55   1.293   3.204  -7.302
  418   3HG2  VAL  55          3HG2      VAL  55   2.443   4.155  -6.351
  419    H    LYS  56           HN       LYS  56   2.716   0.325  -6.046
  420    HA   LYS  56           HA       LYS  56   3.083  -1.300  -3.574
  421   1HB   LYS  56          2HB       LYS  56   3.651  -1.928  -6.486
  422   2HB   LYS  56          1HB       LYS  56   3.942  -3.000  -5.099
  423   1HG   LYS  56          1HG       LYS  56   1.510  -2.810  -4.497
  424   2HG   LYS  56          2HG       LYS  56   1.228  -1.988  -6.037
  425   1HD   LYS  56          2HD       LYS  56   2.536  -4.723  -5.787
  426   2HD   LYS  56          1HD       LYS  56   0.789  -4.471  -5.979
  427   1HE   LYS  56          2HE       LYS  56   1.226  -3.183  -8.105
  428   2HE   LYS  56          1HE       LYS  56   2.946  -3.560  -7.951
  429   1HZ   LYS  56          1HZ       LYS  56   0.776  -5.518  -8.226
  430   2HZ   LYS  56          2HZ       LYS  56   1.835  -5.069  -9.404
  431   3HZ   LYS  56          3HZ       LYS  56   2.378  -5.883  -8.077
  432    H    LEU  57           H        LEU  57   4.766  -0.602  -2.455
  433    HA   LEU  57           HA       LEU  57   6.877   1.020  -3.816
  434   1HB   LEU  57          1HB       LEU  57   5.875   1.955  -1.753
  435   2HB   LEU  57          2HB       LEU  57   6.487   0.556  -0.860
  436    HG   LEU  57           HG       LEU  57   8.810   1.450  -2.117
  437   1HD1  LEU  57          1HD2      LEU  57   9.298   2.556   0.064
  438   2HD1  LEU  57          2HD2      LEU  57   7.589   2.356   0.484
  439   3HD1  LEU  57          3HD2      LEU  57   8.627   0.920   0.213
  440   1HD2  LEU  57          1HD1      LEU  57   8.898   3.882  -1.901
  441   2HD2  LEU  57          2HD1      LEU  57   7.672   3.430  -3.094
  442   3HD2  LEU  57          3HD1      LEU  57   7.182   3.933  -1.463
  443    H    ASN  58           H        ASN  58   8.708   0.116  -4.465
  444    HA   ASN  58           HA       ASN  58   9.342  -2.625  -3.626
  445   1HB   ASN  58          1HB       ASN  58   9.816  -1.800  -5.924
  446   2HB   ASN  58          2HB       ASN  58  11.037  -0.707  -5.259
  447   1HD2  ASN  58          2HD2      ASN  58  10.636  -3.760  -6.620
  448   2HD2  ASN  58          1HD2      ASN  58  12.096  -4.500  -5.986
  449    H    THR  59           H        THR  59  10.002  -2.964  -1.682
  450    HA   THR  59           HA       THR  59  11.087  -1.009   0.112
  451    HB   THR  59           HB       THR  59  11.066  -4.046   0.366
  452    HG1  THR  59           HG1      THR  59   9.012  -3.411  -0.109
  453   1HG2  THR  59          1HG2      THR  59  12.331  -2.854   2.161
  454   2HG2  THR  59          2HG2      THR  59  10.840  -3.587   2.775
  455   3HG2  THR  59          3HG2      THR  59  10.900  -1.844   2.463
  456    H    ASP  60           HN       ASP  60  12.502  -3.447  -1.997
  457    HA   ASP  60           HA       ASP  60  15.096  -3.646  -0.775
  458   1HB   ASP  60          1HB       ASP  60  13.770  -5.167  -2.482
  459   2HB   ASP  60          2HB       ASP  60  14.480  -4.126  -3.712
  460    H    GLU  61           HN       GLU  61  13.612  -1.753  -3.322
  461    HA   GLU  61           HA       GLU  61  15.962  -0.131  -3.930
  462   1HB   GLU  61          2HB       GLU  61  14.001  -0.923  -5.498
  463   2HB   GLU  61          1HB       GLU  61  13.093   0.405  -4.759
  464   1HG   GLU  61          2HG       GLU  61  14.000   1.265  -6.772
  465   2HG   GLU  61          1HG       GLU  61  15.031   1.942  -5.510
  466    H    SER  62           H        SER  62  13.239   0.007  -1.715
  467    HA   SER  62           HA       SER  62  13.809   2.842  -1.032
  468   1HB   SER  62          1HB       SER  62  11.227   1.312  -0.624
  469   2HB   SER  62          2HB       SER  62  11.533   3.042  -0.479
  470    HG   SER  62           HG       SER  62  11.414   1.384  -2.748
  471    HA   PRO  63           HA       PRO  63  14.456   0.088   2.797
  472   1HB   PRO  63          1HB       PRO  63  17.127   0.600   3.213
  473   2HB   PRO  63          2HB       PRO  63  16.513  -0.777   2.246
  474   1HG   PRO  63          1HG       PRO  63  17.513   1.902   1.259
  475   2HG   PRO  63          2HG       PRO  63  17.898   0.278   0.616
  476   1HD   PRO  63          1HD       PRO  63  16.010   1.867  -0.527
  477   2HD   PRO  63          2HD       PRO  63  15.734   0.102  -0.417
  478    H    ASN  64           H        ASN  64  15.388   3.235   1.619
  479    HA   ASN  64           HA       ASN  64  15.905   4.682   4.007
  480   1HB   ASN  64          2HB       ASN  64  14.565   5.545   1.418
  481   2HB   ASN  64          1HB       ASN  64  14.997   6.631   2.723
  482   1HD2  ASN  64          1HD2      ASN  64  16.001   5.396  -0.240
  483   2HD2  ASN  64          2HD2      ASN  64  17.722   5.693  -0.069
  484    H    VAL  65           H        VAL  65  12.845   4.998   2.207
  485    HA   VAL  65           HA       VAL  65  11.334   6.054   4.303
  486    HB   VAL  65           HB       VAL  65  10.675   4.504   1.766
  487   1HG1  VAL  65          1HG2      VAL  65   8.373   5.384   1.976
  488   2HG1  VAL  65          2HG2      VAL  65   8.761   4.199   3.227
  489   3HG1  VAL  65          3HG2      VAL  65   8.768   5.933   3.630
  490   1HG2  VAL  65          1HG1      VAL  65  10.442   7.456   2.533
  491   2HG2  VAL  65          2HG1      VAL  65  10.154   6.753   0.925
  492   3HG2  VAL  65          3HG1      VAL  65  11.787   6.781   1.611
  493    H    ALA  66           H        ALA  66  11.764   2.711   3.305
  494    HA   ALA  66           HA       ALA  66   9.917   1.474   5.084
  495   1HB   ALA  66          1HB       ALA  66  12.581   0.367   4.105
  496   2HB   ALA  66          2HB       ALA  66  11.216  -0.576   4.732
  497   3HB   ALA  66          3HB       ALA  66  11.046   0.325   3.207
  498    H    SER  67           H        SER  67  13.401   2.249   5.641
  499    HA   SER  67           HA       SER  67  13.376   1.186   8.333
  500   1HB   SER  67          1HB       SER  67  15.581   2.244   8.531
  501   2HB   SER  67          2HB       SER  67  15.448   1.274   7.054
  502    HG   SER  67           HG       SER  67  15.047   3.246   5.916
  503    H    GLU  68           HN       GLU  68  12.990   4.422   6.917
  504    HA   GLU  68           HA       GLU  68  12.855   5.937   9.308
  505   1HB   GLU  68          2HB       GLU  68  11.398   6.272   6.655
  506   2HB   GLU  68          1HB       GLU  68  11.339   7.461   7.953
  507   1HG   GLU  68          2HG       GLU  68  13.704   7.877   7.837
  508   2HG   GLU  68          1HG       GLU  68  13.981   6.506   6.763
  509    H    TYR  69           H        TYR  69  10.263   4.127   7.602
  510    HA   TYR  69           HA       TYR  69   8.294   4.714   9.682
  511   1HB   TYR  69          2HB       TYR  69   8.431   2.882   7.266
  512   2HB   TYR  69          1HB       TYR  69   7.141   2.694   8.432
  513    HD1  TYR  69           HD1      TYR  69   7.833   4.204   5.394
  514    HD2  TYR  69           HD2      TYR  69   5.949   5.009   9.181
  515    HE1  TYR  69           HE1      TYR  69   6.609   6.110   4.384
  516    HE2  TYR  69           HE2      TYR  69   4.766   6.946   8.177
  517    HH   TYR  69           HH       TYR  69   5.406   8.036   4.850
  518    H    GLY  70           H        GLY  70  10.586   2.090   9.036
  519   1HA   GLY  70          2HA       GLY  70  11.593   0.772  10.696
  520   2HA   GLY  70          1HA       GLY  70  10.321   1.191  11.851
  521    H    ILE  71           H        ILE  71  10.233  -0.115   8.509
  522    HA   ILE  71           HA       ILE  71   8.161  -2.026   9.199
  523    HB   ILE  71           HB       ILE  71   9.883  -1.650   6.720
  524   1HG1  ILE  71          2HG1      ILE  71   7.023  -0.844   7.489
  525   2HG1  ILE  71          1HG1      ILE  71   8.403   0.246   7.289
  526   1HG2  ILE  71          1HG2      ILE  71   9.033  -3.997   6.847
  527   2HG2  ILE  71          2HG2      ILE  71   8.257  -3.091   5.562
  528   3HG2  ILE  71          3HG2      ILE  71   7.389  -3.368   7.084
  529   1HD1  ILE  71          1HD1      ILE  71   6.954  -1.295   5.133
  530   2HD1  ILE  71          2HD1      ILE  71   8.578  -0.590   4.899
  531   3HD1  ILE  71          3HD1      ILE  71   7.201   0.448   5.325
  532    H    ARG  72           HN       ARG  72   8.551  -3.773  10.419
  533    HA   ARG  72           HA       ARG  72  11.203  -4.889  10.659
  534   1HB   ARG  72          2HB       ARG  72  10.332  -6.284  12.282
  535   2HB   ARG  72          1HB       ARG  72   9.553  -4.732  12.543
  536   1HG   ARG  72          2HG       ARG  72   8.079  -6.912  10.994
  537   2HG   ARG  72          1HG       ARG  72   8.323  -7.073  12.705
  538   1HD   ARG  72          1HD       ARG  72   6.144  -6.149  12.355
  539   2HD   ARG  72          2HD       ARG  72   7.177  -5.027  13.231
  540    HE   ARG  72           HE       ARG  72   6.745  -3.484  11.652
  541   1HH1  ARG  72          1HH1      ARG  72   6.290  -6.638  10.083
  542   2HH1  ARG  72          2HH1      ARG  72   5.900  -5.923   8.528
  543   1HH2  ARG  72          1HH2      ARG  72   5.884  -2.614   9.711
  544   2HH2  ARG  72          2HH2      ARG  72   5.470  -3.695   8.395
  545    H    SER  73           H        SER  73   8.339  -5.680   8.720
  546    HA   SER  73           HA       SER  73   9.867  -7.575   7.154
  547   1HB   SER  73          1HB       SER  73   7.366  -8.620   8.559
  548   2HB   SER  73          2HB       SER  73   8.483  -9.519   7.527
  549    HG   SER  73           HG       SER  73  10.049  -8.696   9.344
  550    H    ILE  74           H        ILE  74   8.519  -8.296   5.252
  551    HA   ILE  74           HA       ILE  74   6.285  -6.461   4.677
  552    HB   ILE  74           HB       ILE  74   7.071  -6.548   2.281
  553   1HG1  ILE  74          1HG1      ILE  74   9.737  -7.379   3.454
  554   2HG1  ILE  74          2HG1      ILE  74   8.667  -8.410   2.483
  555   1HG2  ILE  74          1HG2      ILE  74   8.518  -4.612   2.596
  556   2HG2  ILE  74          2HG2      ILE  74   8.923  -5.126   4.247
  557   3HG2  ILE  74          3HG2      ILE  74   7.279  -4.581   3.844
  558   1HD1  ILE  74          1HD1      ILE  74   8.734  -6.585   0.689
  559   2HD1  ILE  74          2HD1      ILE  74  10.100  -5.889   1.592
  560   3HD1  ILE  74          3HD1      ILE  74  10.206  -7.520   0.922
  561    HA   PRO  75           HA       PRO  75   4.784  -6.704   2.482
  562   1HB   PRO  75          2HB       PRO  75   2.116  -7.325   2.688
  563   2HB   PRO  75          1HB       PRO  75   3.190  -7.910   1.411
  564   1HG   PRO  75          1HG       PRO  75   2.462  -9.325   4.006
  565   2HG   PRO  75          2HG       PRO  75   2.396 -10.007   2.350
  566   1HD   PRO  75          2HD       PRO  75   4.452 -10.415   4.108
  567   2HD   PRO  75          1HD       PRO  75   4.811 -10.204   2.383
  568    H    THR  76           H        THR  76   3.877  -4.907   3.203
  569    HA   THR  76           HA       THR  76   2.555  -4.675   5.797
  570    HB   THR  76           HB       THR  76   5.169  -3.242   5.168
  571    HG1  THR  76           HG1      THR  76   5.483  -5.103   6.395
  572   1HG2  THR  76          1HG2      THR  76   3.092  -2.602   7.309
  573   2HG2  THR  76          2HG2      THR  76   4.721  -1.900   7.214
  574   3HG2  THR  76          3HG2      THR  76   3.544  -1.547   5.948
  575    H    ILE  77           H        ILE  77   0.725  -3.646   5.190
  576    HA   ILE  77           HA       ILE  77   0.727  -2.044   2.677
  577    HB   ILE  77           HB       ILE  77  -1.480  -3.521   4.150
  578   1HG1  ILE  77          1HG1      ILE  77  -0.324  -3.956   1.359
  579   2HG1  ILE  77          2HG1      ILE  77   0.162  -4.892   2.776
  580   1HG2  ILE  77          1HG2      ILE  77  -1.537  -1.737   1.680
  581   2HG2  ILE  77          2HG2      ILE  77  -2.895  -2.762   2.198
  582   3HG2  ILE  77          3HG2      ILE  77  -2.371  -1.430   3.214
  583   1HD1  ILE  77          1HD1      ILE  77  -2.613  -4.854   1.542
  584   2HD1  ILE  77          2HD1      ILE  77  -2.201  -5.631   3.091
  585   3HD1  ILE  77          3HD1      ILE  77  -1.445  -6.180   1.583
  586    H    MET  78           H        MET  78   0.674   0.103   2.983
  587    HA   MET  78           HA       MET  78  -0.335   1.216   5.573
  588   1HB   MET  78          2HB       MET  78   1.380   2.553   3.484
  589   2HB   MET  78          1HB       MET  78   0.918   3.190   5.061
  590   1HG   MET  78          2HG       MET  78   2.119   1.160   6.067
  591   2HG   MET  78          1HG       MET  78   2.808   0.901   4.471
  592   1HE   MET  78          1HE       MET  78   4.535   1.392   7.319
  593   2HE   MET  78          2HE       MET  78   4.946   0.771   5.701
  594   3HE   MET  78          3HE       MET  78   5.858   2.133   6.388
  595    H    VAL  79           H        VAL  79  -1.572   3.157   5.405
  596    HA   VAL  79           HA       VAL  79  -2.974   3.604   2.802
  597    HB   VAL  79           HB       VAL  79  -4.205   3.549   5.574
  598   1HG1  VAL  79          1HG1      VAL  79  -4.721   1.836   3.102
  599   2HG1  VAL  79          2HG1      VAL  79  -5.662   1.778   4.608
  600   3HG1  VAL  79          3HG1      VAL  79  -3.961   1.292   4.613
  601   1HG2  VAL  79          1HG2      VAL  79  -5.145   5.424   4.263
  602   2HG2  VAL  79          2HG2      VAL  79  -6.328   4.126   4.399
  603   3HG2  VAL  79          3HG2      VAL  79  -5.418   4.345   2.887
  604    H    PHE  80           H        PHE  80  -2.911   5.701   2.227
  605    HA   PHE  80           HA       PHE  80  -2.027   7.788   4.169
  606   1HB   PHE  80          1HB       PHE  80  -1.390   7.437   1.222
  607   2HB   PHE  80          2HB       PHE  80  -1.112   8.923   2.118
  608    HD1  PHE  80           HD1      PHE  80  -0.108   5.327   1.894
  609    HD2  PHE  80           HD2      PHE  80   0.766   9.200   3.578
  610    HE1  PHE  80           HE1      PHE  80   2.104   4.505   2.670
  611    HE2  PHE  80           HE2      PHE  80   2.931   8.364   4.394
  612    HZ   PHE  80           HZ       PHE  80   3.559   5.960   4.041
  613    H    LYS  81           HN       LYS  81  -3.080   9.751   4.036
  614    HA   LYS  81           HA       LYS  81  -5.336  10.059   2.133
  615   1HB   LYS  81          1HB       LYS  81  -7.015  10.262   3.731
  616   2HB   LYS  81          2HB       LYS  81  -6.159   8.783   4.134
  617   1HG   LYS  81          2HG       LYS  81  -6.339  11.383   5.626
  618   2HG   LYS  81          1HG       LYS  81  -6.629   9.741   6.190
  619   1HD   LYS  81          1HD       LYS  81  -4.151   9.299   6.013
  620   2HD   LYS  81          2HD       LYS  81  -3.913  11.013   5.618
  621   1HE   LYS  81          1HE       LYS  81  -5.125   9.958   8.208
  622   2HE   LYS  81          2HE       LYS  81  -3.500  10.627   7.997
  623   1HZ   LYS  81          1HZ       LYS  81  -4.490  12.694   7.335
  624   2HZ   LYS  81          2HZ       LYS  81  -6.001  12.093   7.600
  625   3HZ   LYS  81          3HZ       LYS  81  -4.951  12.258   8.857
  626    H    GLY  82           H        GLY  82  -3.117  11.349   1.762
  627   1HA   GLY  82          2HA       GLY  82  -2.777  13.652   1.205
  628   2HA   GLY  82          1HA       GLY  82  -3.799  14.112   2.584
  629    H    GLY  83           H        GLY  83  -0.559  12.993   1.653
  630   1HA   GLY  83          2HA       GLY  83   1.447  13.230   2.690
  631   2HA   GLY  83          1HA       GLY  83   0.693  14.349   3.819
  632    H    LYS  84           HN       LYS  84  -0.817  13.116   5.424
  633    HA   LYS  84           HA       LYS  84   0.957  11.331   6.940
  634   1HB   LYS  84          1HB       LYS  84  -1.818  12.392   7.600
  635   2HB   LYS  84          2HB       LYS  84  -0.684  11.657   8.738
  636   1HG   LYS  84          2HG       LYS  84  -0.299  14.312   7.265
  637   2HG   LYS  84          1HG       LYS  84  -0.740  14.090   8.961
  638   1HD   LYS  84          1HD       LYS  84   1.442  12.893   9.343
  639   2HD   LYS  84          2HD       LYS  84   1.901  13.269   7.666
  640   1HE   LYS  84          1HE       LYS  84   1.666  15.695   8.139
  641   2HE   LYS  84          2HE       LYS  84   1.232  15.325   9.820
  642   1HZ   LYS  84          1HZ       LYS  84   3.376  14.311  10.083
  643   2HZ   LYS  84          2HZ       LYS  84   3.779  14.656   8.522
  644   3HZ   LYS  84          3HZ       LYS  84   3.529  15.878   9.598
  645    H    LYS  85           HN       LYS  85   0.059   9.460   8.067
  646    HA   LYS  85           HA       LYS  85  -1.240   7.647   6.151
  647   1HB   LYS  85          1HB       LYS  85   0.128   7.131   8.817
  648   2HB   LYS  85          2HB       LYS  85  -0.597   5.902   7.759
  649   1HG   LYS  85          2HG       LYS  85   0.928   6.816   5.909
  650   2HG   LYS  85          1HG       LYS  85   1.853   7.607   7.199
  651   1HD   LYS  85          2HD       LYS  85   1.280   4.636   6.788
  652   2HD   LYS  85          1HD       LYS  85   2.847   5.446   6.673
  653   1HE   LYS  85          2HE       LYS  85   2.716   5.937   9.140
  654   2HE   LYS  85          1HE       LYS  85   1.177   5.049   9.204
  655   1HZ   LYS  85          1HZ       LYS  85   2.289   3.110   8.464
  656   2HZ   LYS  85          2HZ       LYS  85   3.734   3.899   8.357
  657   3HZ   LYS  85          3HZ       LYS  85   3.020   3.682   9.830
  658    H    CYS  86           H        CYS  86  -2.979   6.375   6.702
  659    HA   CYS  86           HA       CYS  86  -4.890   7.486   8.710
  660   1HB   CYS  86          2HB       CYS  86  -5.645   6.971   6.341
  661   2HB   CYS  86          1HB       CYS  86  -5.337   5.263   6.666
  662    HG   CYS  86           HG       CYS  86  -6.754   5.276   8.966
  663    H    GLU  87           HN       GLU  87  -3.455   4.422   7.580
  664    HA   GLU  87           HA       GLU  87  -2.897   3.454  10.242
  665   1HB   GLU  87          1HB       GLU  87  -4.338   1.496  10.152
  666   2HB   GLU  87          2HB       GLU  87  -5.310   2.948  10.112
  667   1HG   GLU  87          1HG       GLU  87  -6.284   2.348   8.184
  668   2HG   GLU  87          2HG       GLU  87  -4.778   2.306   7.351
  669    H    THR  88           H        THR  88  -2.274   0.913   9.878
  670    HA   THR  88           HA       THR  88  -1.117   0.292   7.330
  671    HB   THR  88           HB       THR  88   0.593   1.052   9.750
  672    HG1  THR  88           HG1      THR  88  -0.085   2.437   7.725
  673   1HG2  THR  88          1HG2      THR  88   1.402  -0.575   7.304
  674   2HG2  THR  88          2HG2      THR  88   1.552  -1.034   9.012
  675   3HG2  THR  88          3HG2      THR  88   2.561   0.262   8.365
  676    H    ILE  89           H        ILE  89  -0.732  -1.961   7.208
  677    HA   ILE  89           HA       ILE  89  -1.069  -3.561   9.693
  678    HB   ILE  89           HB       ILE  89  -2.613  -5.079   8.510
  679   1HG1  ILE  89          1HG1      ILE  89  -2.578  -2.985   6.281
  680   2HG1  ILE  89          2HG1      ILE  89  -2.037  -4.672   6.184
  681   1HG2  ILE  89          1HG2      ILE  89  -3.394  -3.100   9.932
  682   2HG2  ILE  89          2HG2      ILE  89  -4.563  -3.825   8.832
  683   3HG2  ILE  89          3HG2      ILE  89  -3.784  -2.283   8.394
  684   1HD1  ILE  89          1HD1      ILE  89  -4.888  -3.680   6.530
  685   2HD1  ILE  89          2HD1      ILE  89  -4.181  -4.514   5.143
  686   3HD1  ILE  89          3HD1      ILE  89  -4.401  -5.389   6.674
  687    H    ILE  90           H        ILE  90  -0.224  -5.706   9.484
  688    HA   ILE  90           HA       ILE  90   1.993  -5.951   7.543
  689    HB   ILE  90           HB       ILE  90   1.040  -7.812   9.760
  690   1HG1  ILE  90          2HG1      ILE  90   3.308  -5.761   9.652
  691   2HG1  ILE  90          1HG1      ILE  90   1.852  -5.659  10.649
  692   1HG2  ILE  90          1HG2      ILE  90   3.630  -7.809   8.135
  693   2HG2  ILE  90          2HG2      ILE  90   3.191  -8.961   9.414
  694   3HG2  ILE  90          3HG2      ILE  90   2.293  -8.956   7.909
  695   1HD1  ILE  90          1HD1      ILE  90   4.118  -7.648  10.982
  696   2HD1  ILE  90          2HD1      ILE  90   2.556  -7.760  11.833
  697   3HD1  ILE  90          3HD1      ILE  90   3.611  -6.354  12.075
  698    H    GLY  91           H        GLY  91   1.848  -7.492   5.811
  699   1HA   GLY  91          2HA       GLY  91  -0.924  -8.144   5.001
  700   2HA   GLY  91          1HA       GLY  91   0.520  -8.377   4.044
  701    H    ALA  92           H        ALA  92   0.469 -10.618   3.593
  702    HA   ALA  92           HA       ALA  92   0.204 -12.862   3.865
  703   1HB   ALA  92          1HB       ALA  92   2.383 -12.436   4.987
  704   2HB   ALA  92          2HB       ALA  92   1.528 -13.833   5.665
  705   3HB   ALA  92          3HB       ALA  92   1.546 -12.297   6.549
  706    H    VAL  93           H        VAL  93  -2.175 -11.539   4.380
  707    HA   VAL  93           HA       VAL  93  -3.486 -13.382   6.249
  708    HB   VAL  93           HB       VAL  93  -4.979 -11.511   7.001
  709   1HG1  VAL  93          1HG2      VAL  93  -4.377  -9.823   5.270
  710   2HG1  VAL  93          2HG2      VAL  93  -4.204  -9.205   6.918
  711   3HG1  VAL  93          3HG2      VAL  93  -2.766  -9.668   5.996
  712   1HG2  VAL  93          1HG1      VAL  93  -2.076 -11.257   7.875
  713   2HG2  VAL  93          2HG1      VAL  93  -3.507 -10.732   8.777
  714   3HG2  VAL  93          3HG1      VAL  93  -3.240 -12.457   8.468
  715    HA   PRO  94           HA       PRO  94  -6.017 -13.806   2.682
  716   1HB   PRO  94          2HB       PRO  94  -8.443 -13.704   4.456
  717   2HB   PRO  94          1HB       PRO  94  -8.047 -14.901   3.200
  718   1HG   PRO  94          1HG       PRO  94  -7.675 -15.513   5.833
  719   2HG   PRO  94          2HG       PRO  94  -6.443 -15.972   4.620
  720   1HD   PRO  94          1HD       PRO  94  -6.385 -13.635   6.535
  721   2HD   PRO  94          2HD       PRO  94  -5.096 -14.768   6.064
  722    H    LYS  95           HN       LYS  95  -7.288 -12.653   1.252
  723    HA   LYS  95           HA       LYS  95  -7.380  -9.925   1.256
  724   1HB   LYS  95          1HB       LYS  95  -8.958 -10.120  -0.564
  725   2HB   LYS  95          2HB       LYS  95  -7.648 -11.291  -0.724
  726   1HG   LYS  95          2HG       LYS  95  -9.244 -12.721  -1.293
  727   2HG   LYS  95          1HG       LYS  95  -9.509 -12.904   0.419
  728   1HD   LYS  95          2HD       LYS  95 -11.621 -12.609  -0.759
  729   2HD   LYS  95          1HD       LYS  95 -11.383 -11.216   0.289
  730   1HE   LYS  95          2HE       LYS  95 -12.305 -10.676  -1.970
  731   2HE   LYS  95          1HE       LYS  95 -10.840  -9.782  -1.594
  732   1HZ   LYS  95          1HZ       LYS  95 -10.991 -12.196  -3.263
  733   2HZ   LYS  95          2HZ       LYS  95  -9.615 -11.355  -2.918
  734   3HZ   LYS  95          3HZ       LYS  95 -10.805 -10.652  -3.809
  735    H    ALA  96           H        ALA  96  -9.978 -12.113   2.254
  736    HA   ALA  96           HA       ALA  96 -12.031 -10.326   2.829
  737   1HB   ALA  96          1HB       ALA  96 -11.193 -12.758   4.476
  738   2HB   ALA  96          2HB       ALA  96 -12.784 -11.969   4.518
  739   3HB   ALA  96          3HB       ALA  96 -12.237 -12.779   3.036
  740    H    THR  97           H        THR  97  -9.178 -11.081   4.894
  741    HA   THR  97           HA       THR  97  -9.999  -9.573   7.165
  742    HB   THR  97           HB       THR  97  -7.071  -9.870   6.496
  743    HG1  THR  97           HG1      THR  97  -7.590 -11.748   5.695
  744   1HG2  THR  97          1HG2      THR  97  -8.756 -10.707   8.900
  745   2HG2  THR  97          2HG2      THR  97  -6.985 -10.703   8.796
  746   3HG2  THR  97          3HG2      THR  97  -7.874  -9.166   8.754
  747    H    ILE  98           H        ILE  98  -7.959  -8.893   4.331
  748    HA   ILE  98           HA       ILE  98  -7.163  -6.239   5.040
  749    HB   ILE  98           HB       ILE  98  -7.375  -7.637   2.312
  750   1HG1  ILE  98          1HG1      ILE  98  -5.044  -7.287   4.244
  751   2HG1  ILE  98          2HG1      ILE  98  -5.917  -8.788   3.905
  752   1HG2  ILE  98          1HG2      ILE  98  -7.289  -5.101   2.159
  753   2HG2  ILE  98          2HG2      ILE  98  -5.828  -5.125   3.158
  754   3HG2  ILE  98          3HG2      ILE  98  -5.826  -5.854   1.541
  755   1HD1  ILE  98          1HD1      ILE  98  -3.899  -8.874   2.669
  756   2HD1  ILE  98          2HD1      ILE  98  -4.155  -7.275   1.959
  757   3HD1  ILE  98          3HD1      ILE  98  -5.216  -8.631   1.506
  758    H    VAL  99           H        VAL  99  -9.826  -7.427   2.903
  759    HA   VAL  99           HA       VAL  99 -10.978  -4.943   2.264
  760    HB   VAL  99           HB       VAL  99 -12.231  -7.705   2.634
  761   1HG1  VAL  99          1HG2      VAL  99 -14.117  -6.814   1.247
  762   2HG1  VAL  99          2HG2      VAL  99 -14.052  -6.075   2.846
  763   3HG1  VAL  99          3HG2      VAL  99 -13.451  -5.180   1.432
  764   1HG2  VAL  99          1HG1      VAL  99 -10.557  -7.495   0.788
  765   2HG2  VAL  99          2HG1      VAL  99 -12.193  -7.746   0.172
  766   3HG2  VAL  99          3HG1      VAL  99 -11.477  -6.123   0.138
  767    H    GLN 100           H        GLN 100 -11.964  -7.191   4.938
  768    HA   GLN 100           HA       GLN 100 -13.872  -5.517   6.143
  769   1HB   GLN 100          2HB       GLN 100 -11.958  -7.590   7.275
  770   2HB   GLN 100          1HB       GLN 100 -13.168  -6.776   8.280
  771   1HG   GLN 100          1HG       GLN 100 -14.988  -7.543   6.957
  772   2HG   GLN 100          2HG       GLN 100 -13.937  -8.213   5.706
  773   1HE2  GLN 100          1HE2      GLN 100 -12.293  -9.831   6.531
  774   2HE2  GLN 100          2HE2      GLN 100 -12.876 -11.044   7.687
  775    H    THR 101           H        THR 101 -10.338  -5.582   6.647
  776    HA   THR 101           HA       THR 101 -10.301  -3.565   8.671
  777    HB   THR 101           HB       THR 101  -8.159  -4.246   6.599
  778    HG1  THR 101           HG1      THR 101  -8.760  -6.019   7.854
  779   1HG2  THR 101          1HG2      THR 101  -6.628  -3.391   8.343
  780   2HG2  THR 101          2HG2      THR 101  -8.014  -2.804   9.273
  781   3HG2  THR 101          3HG2      THR 101  -7.643  -2.124   7.658
  782    H    VAL 102           H        VAL 102  -9.724  -3.211   5.106
  783    HA   VAL 102           HA       VAL 102  -9.437  -0.411   5.073
  784    HB   VAL 102           HB       VAL 102 -10.509  -2.293   2.973
  785   1HG1  VAL 102          1HG1      VAL 102  -8.263  -2.287   2.074
  786   2HG1  VAL 102          2HG1      VAL 102  -7.746  -1.046   3.241
  787   3HG1  VAL 102          3HG1      VAL 102  -8.116  -2.682   3.791
  788   1HG2  VAL 102          1HG2      VAL 102  -9.562   0.596   2.704
  789   2HG2  VAL 102          2HG2      VAL 102  -9.712  -0.514   1.334
  790   3HG2  VAL 102          3HG2      VAL 102 -11.152  -0.073   2.252
  791    H    GLU 103           HN       GLU 103 -12.402  -2.345   4.720
  792    HA   GLU 103           HA       GLU 103 -14.314  -0.513   4.010
  793   1HB   GLU 103          1HB       GLU 103 -14.399  -2.774   6.047
  794   2HB   GLU 103          2HB       GLU 103 -15.839  -1.937   5.503
  795   1HG   GLU 103          2HG       GLU 103 -14.047  -2.965   3.324
  796   2HG   GLU 103          1HG       GLU 103 -14.845  -4.187   4.326
  797    H    LYS 104           HN       LYS 104 -12.949  -0.901   7.251
  798    HA   LYS 104           HA       LYS 104 -14.744   0.775   8.714
  799   1HB   LYS 104          2HB       LYS 104 -13.111  -0.714   9.774
  800   2HB   LYS 104          1HB       LYS 104 -11.773   0.184   9.023
  801   1HG   LYS 104          2HG       LYS 104 -12.527   2.242  10.336
  802   2HG   LYS 104          1HG       LYS 104 -13.588   1.156  11.237
  803   1HD   LYS 104          1HD       LYS 104 -10.547   1.121  10.974
  804   2HD   LYS 104          2HD       LYS 104 -11.484   1.566  12.392
  805   1HE   LYS 104          1HE       LYS 104 -10.778  -0.580  12.949
  806   2HE   LYS 104          2HE       LYS 104 -12.390  -0.910  12.297
  807   1HZ   LYS 104          1HZ       LYS 104 -10.720  -2.402  11.454
  808   2HZ   LYS 104          2HZ       LYS 104 -11.294  -1.490  10.211
  809   3HZ   LYS 104          3HZ       LYS 104  -9.824  -1.152  10.865
  810    H    TYR 105           H        TYR 105 -11.752   1.424   6.935
  811    HA   TYR 105           HA       TYR 105 -11.595   4.231   7.779
  812   1HB   TYR 105          1HB       TYR 105  -9.897   2.512   5.912
  813   2HB   TYR 105          2HB       TYR 105  -9.453   4.093   6.517
  814    HD1  TYR 105           HD1      TYR 105  -9.339   4.359   9.116
  815    HD2  TYR 105           HD2      TYR 105  -9.300   0.573   7.086
  816    HE1  TYR 105           HE1      TYR 105  -8.045   3.356  11.007
  817    HE2  TYR 105           HE2      TYR 105  -8.244  -0.470   9.063
  818    HH   TYR 105           HH       TYR 105  -6.637   0.156  10.681
  819    H    LEU 106           H        LEU 106 -11.668   2.462   4.689
  820    HA   LEU 106           HA       LEU 106 -12.496   4.888   3.181
  821   1HB   LEU 106          2HB       LEU 106 -11.510   2.110   2.518
  822   2HB   LEU 106          1HB       LEU 106 -12.224   3.124   1.278
  823    HG   LEU 106           HG       LEU 106  -9.689   3.072   1.523
  824   1HD1  LEU 106          1HD2      LEU 106  -9.390   3.440   3.889
  825   2HD1  LEU 106          2HD2      LEU 106  -8.589   4.687   2.930
  826   3HD1  LEU 106          3HD2      LEU 106 -10.105   5.072   3.753
  827   1HD2  LEU 106          1HD1      LEU 106 -10.990   4.656   0.110
  828   2HD2  LEU 106          2HD1      LEU 106  -9.511   5.397   0.743
  829   3HD2  LEU 106          3HD1      LEU 106 -11.081   5.790   1.467
  830    H    ASN 107           H        ASN 107 -14.396   4.675   4.734
  831    HA   ASN 107           HA       ASN 107 -16.395   2.642   3.982
  832   1HB   ASN 107          1HB       ASN 107 -15.893   3.617   6.375
  833   2HB   ASN 107          2HB       ASN 107 -16.849   5.005   5.838
  834   1HD2  ASN 107          1HD2      ASN 107 -16.863   1.424   5.999
  835   2HD2  ASN 107          2HD2      ASN 107 -18.595   1.265   6.329
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1  -1.158  -3.372 -11.374
    2   2H    MET   1          2H        MET   1  -0.343  -2.013 -11.023
    3   3H    MET   1          3H        MET   1   0.365  -3.161 -11.992
    4    HA   MET   1           HA       MET   1  -0.363  -1.201 -13.187
    5   1HB   MET   1          1HB       MET   1  -1.591  -2.273 -14.979
    6   2HB   MET   1          2HB       MET   1  -0.204  -3.225 -14.461
    7   1HG   MET   1          1HG       MET   1  -3.103  -3.848 -13.775
    8   2HG   MET   1          2HG       MET   1  -2.163  -4.581 -15.061
    9   1HE   MET   1          1HE       MET   1  -3.789  -5.787 -12.341
   10   2HE   MET   1          2HE       MET   1  -3.308  -6.802 -13.723
   11   3HE   MET   1          3HE       MET   1  -2.791  -7.233 -12.076
   12    H    GLU   2           HN       GLU   2  -3.161  -2.973 -11.693
   13    HA   GLU   2           HA       GLU   2  -4.978  -0.713 -12.127
   14   1HB   GLU   2          2HB       GLU   2  -5.116  -3.088 -10.216
   15   2HB   GLU   2          1HB       GLU   2  -6.413  -1.933 -10.529
   16   1HG   GLU   2          1HG       GLU   2  -6.584  -2.651 -12.853
   17   2HG   GLU   2          2HG       GLU   2  -5.214  -3.753 -12.660
   18    H    ALA   3           H        ALA   3  -3.006  -2.174  -9.589
   19    HA   ALA   3           HA       ALA   3  -3.096   0.262  -7.895
   20   1HB   ALA   3          1HB       ALA   3  -1.731  -2.444  -7.558
   21   2HB   ALA   3          2HB       ALA   3  -3.201  -1.886  -6.723
   22   3HB   ALA   3          3HB       ALA   3  -1.639  -1.106  -6.392
   23    H    GLY   4           H        GLY   4  -1.213   1.616  -7.797
   24   1HA   GLY   4          1HA       GLY   4   0.491   1.486 -10.189
   25   2HA   GLY   4          2HA       GLY   4   0.515   2.714  -8.921
   26    H    ALA   5           H        ALA   5   2.925   2.017  -9.751
   27    HA   ALA   5           HA       ALA   5   4.063   0.246  -7.634
   28   1HB   ALA   5          1HB       ALA   5   5.924  -0.185  -9.187
   29   2HB   ALA   5          2HB       ALA   5   5.089   0.724 -10.465
   30   3HB   ALA   5          3HB       ALA   5   4.390  -0.790  -9.846
   31    H    VAL   6           H        VAL   6   5.533   1.397  -6.337
   32    HA   VAL   6           HA       VAL   6   6.394   4.078  -7.295
   33    HB   VAL   6           HB       VAL   6   6.009   4.833  -4.831
   34   1HG1  VAL   6          1HG1      VAL   6   4.076   3.887  -3.702
   35   2HG1  VAL   6          2HG1      VAL   6   5.329   2.664  -3.913
   36   3HG1  VAL   6          3HG1      VAL   6   3.897   2.639  -4.949
   37   1HG2  VAL   6          1HG2      VAL   6   3.718   4.541  -6.782
   38   2HG2  VAL   6          2HG2      VAL   6   3.741   5.601  -5.350
   39   3HG2  VAL   6          3HG2      VAL   6   4.886   5.873  -6.672
   40    H    ASN   7           H        ASN   7   7.992   5.038  -5.969
   41    HA   ASN   7           HA       ASN   7   9.840   3.324  -4.501
   42   1HB   ASN   7          1HB       ASN   7  10.734   3.131  -6.762
   43   2HB   ASN   7          2HB       ASN   7  10.506   4.868  -7.065
   44   1HD2  ASN   7          2HD2      ASN   7  12.324   2.490  -5.153
   45   2HD2  ASN   7          1HD2      ASN   7  13.718   3.485  -4.830
   46    H    ASP   8           HN       ASP   8  11.541   4.932  -3.661
   47    HA   ASP   8           HA       ASP   8  10.518   6.916  -2.046
   48   1HB   ASP   8          1HB       ASP   8  12.865   5.976  -2.068
   49   2HB   ASP   8          2HB       ASP   8  13.250   7.024  -3.426
   50    H    ASP   9           HN       ASP   9  12.026   7.453  -5.206
   51    HA   ASP   9           HA       ASP   9  11.652  10.194  -5.510
   52   1HB   ASP   9          1HB       ASP   9  11.687   7.917  -7.536
   53   2HB   ASP   9          2HB       ASP   9  11.633   9.621  -7.993
   54    H    THR  10           H        THR  10   9.317   7.616  -6.589
   55    HA   THR  10           HA       THR  10   7.457   9.636  -7.586
   56    HB   THR  10           HB       THR  10   6.111   7.503  -8.028
   57    HG1  THR  10           HG1      THR  10   7.561   5.638  -7.988
   58   1HG2  THR  10          1HG2      THR  10   8.945   7.669  -9.164
   59   2HG2  THR  10          2HG2      THR  10   7.545   8.595  -9.743
   60   3HG2  THR  10          3HG2      THR  10   7.567   6.831  -9.903
   61    H    PHE  11           H        PHE  11   7.838   7.682  -4.722
   62    HA   PHE  11           HA       PHE  11   5.435   7.529  -3.463
   63   1HB   PHE  11          2HB       PHE  11   7.723   6.815  -2.639
   64   2HB   PHE  11          1HB       PHE  11   8.025   8.464  -2.151
   65    HD1  PHE  11           HD1      PHE  11   7.124   9.356  -0.107
   66    HD2  PHE  11           HD2      PHE  11   5.970   5.450  -1.518
   67    HE1  PHE  11           HE1      PHE  11   6.317   8.765   2.164
   68    HE2  PHE  11           HE2      PHE  11   5.078   4.903   0.739
   69    HZ   PHE  11           HZ       PHE  11   5.277   6.559   2.585
   70    H    LYS  12           HN       LYS  12   7.574  10.251  -3.616
   71    HA   LYS  12           HA       LYS  12   6.306  12.187  -2.021
   72   1HB   LYS  12          1HB       LYS  12   7.843  12.405  -4.647
   73   2HB   LYS  12          2HB       LYS  12   7.327  13.784  -3.680
   74   1HG   LYS  12          2HG       LYS  12   8.666  12.942  -1.755
   75   2HG   LYS  12          1HG       LYS  12   9.025  11.447  -2.632
   76   1HD   LYS  12          2HD       LYS  12  10.223  12.822  -4.388
   77   2HD   LYS  12          1HD       LYS  12   9.981  14.241  -3.352
   78   1HE   LYS  12          2HE       LYS  12  12.184  13.400  -2.866
   79   2HE   LYS  12          1HE       LYS  12  11.168  12.956  -1.485
   80   1HZ   LYS  12          1HZ       LYS  12  11.992  11.218  -3.708
   81   2HZ   LYS  12          2HZ       LYS  12  10.957  10.746  -2.524
   82   3HZ   LYS  12          3HZ       LYS  12  12.509  11.129  -2.148
   83    H    ASN  13           H        ASN  13   5.970  11.982  -5.568
   84    HA   ASN  13           HA       ASN  13   3.742  13.798  -5.783
   85   1HB   ASN  13          2HB       ASN  13   5.135  11.765  -7.546
   86   2HB   ASN  13          1HB       ASN  13   3.559  12.348  -8.032
   87   1HD2  ASN  13          2HD2      ASN  13   5.498  14.756  -6.253
   88   2HD2  ASN  13          1HD2      ASN  13   6.021  15.591  -7.699
   89    H    VAL  14           H        VAL  14   3.995  10.322  -5.570
   90    HA   VAL  14           HA       VAL  14   1.148   9.987  -6.298
   91    HB   VAL  14           HB       VAL  14   3.349   7.989  -5.626
   92   1HG1  VAL  14          1HG1      VAL  14   3.817   9.327  -7.695
   93   2HG1  VAL  14          2HG1      VAL  14   3.426   7.652  -8.085
   94   3HG1  VAL  14          3HG1      VAL  14   2.205   8.920  -8.304
   95   1HG2  VAL  14          1HG2      VAL  14   1.875   6.382  -6.863
   96   2HG2  VAL  14          2HG2      VAL  14   0.587   7.600  -6.848
   97   3HG2  VAL  14          3HG2      VAL  14   1.187   6.909  -5.316
   98    H    VAL  15           H        VAL  15   3.096   9.459  -3.359
   99    HA   VAL  15           HA       VAL  15   0.678   8.536  -1.905
  100    HB   VAL  15           HB       VAL  15   3.594   8.448  -1.025
  101   1HG1  VAL  15          1HG1      VAL  15   2.790   6.827   0.578
  102   2HG1  VAL  15          2HG1      VAL  15   1.958   8.362   0.786
  103   3HG1  VAL  15          3HG1      VAL  15   1.123   7.018  -0.022
  104   1HG2  VAL  15          1HG2      VAL  15   1.910   6.317  -2.401
  105   2HG2  VAL  15          2HG2      VAL  15   3.322   7.116  -3.099
  106   3HG2  VAL  15          3HG2      VAL  15   3.524   6.075  -1.696
  107    H    LEU  16           H        LEU  16   3.445  10.864  -1.461
  108    HA   LEU  16           HA       LEU  16   2.167  11.962   0.916
  109   1HB   LEU  16          1HB       LEU  16   4.338  13.247  -0.777
  110   2HB   LEU  16          2HB       LEU  16   3.837  13.702   0.844
  111    HG   LEU  16           HG       LEU  16   5.156  11.066   0.057
  112   1HD1  LEU  16          1HD1      LEU  16   7.061  11.934   1.321
  113   2HD1  LEU  16          2HD1      LEU  16   6.155  13.406   1.738
  114   3HD1  LEU  16          3HD1      LEU  16   6.628  13.101   0.058
  115   1HD2  LEU  16          1HD2      LEU  16   4.204  12.116   2.758
  116   2HD2  LEU  16          2HD2      LEU  16   3.688  10.613   1.949
  117   3HD2  LEU  16          3HD2      LEU  16   5.333  10.771   2.576
  118    H    GLU  17           HN       GLU  17   2.614  13.344  -2.379
  119    HA   GLU  17           HA       GLU  17   0.756  15.543  -1.837
  120   1HB   GLU  17          1HB       GLU  17   2.101  14.613  -4.397
  121   2HB   GLU  17          2HB       GLU  17   1.307  16.169  -4.161
  122   1HG   GLU  17          1HG       GLU  17   2.989  16.875  -2.558
  123   2HG   GLU  17          2HG       GLU  17   3.744  15.279  -2.529
  124    H    SER  18           H        SER  18  -0.727  13.377  -1.290
  125    HA   SER  18           HA       SER  18  -2.120  12.355  -3.670
  126   1HB   SER  18          1HB       SER  18  -3.270  11.038  -1.756
  127   2HB   SER  18          2HB       SER  18  -1.559  10.717  -2.122
  128    HG   SER  18           HG       SER  18  -1.004  11.465  -0.245
  129    H    SER  19           H        SER  19  -4.376  12.412  -3.928
  130    HA   SER  19           HA       SER  19  -5.816  14.744  -2.792
  131   1HB   SER  19          1HB       SER  19  -7.348  14.111  -4.756
  132   2HB   SER  19          2HB       SER  19  -5.733  14.717  -5.182
  133    HG   SER  19           HG       SER  19  -6.181  12.809  -6.347
  134    H    VAL  20           H        VAL  20  -6.648  11.528  -3.983
  135    HA   VAL  20           HA       VAL  20  -8.569  11.001  -1.797
  136    HB   VAL  20           HB       VAL  20  -8.632   8.689  -2.913
  137   1HG1  VAL  20          1HG1      VAL  20  -7.202  10.036  -5.229
  138   2HG1  VAL  20          2HG1      VAL  20  -7.786   8.370  -5.106
  139   3HG1  VAL  20          3HG1      VAL  20  -6.423   8.896  -4.107
  140   1HG2  VAL  20          1HG2      VAL  20  -9.453  11.109  -4.543
  141   2HG2  VAL  20          2HG2      VAL  20 -10.000   9.444  -4.816
  142   3HG2  VAL  20          3HG2      VAL  20 -10.408  10.259  -3.298
  143    HA   PRO  21           HA       PRO  21  -5.635   8.928   0.832
  144   1HB   PRO  21          1HB       PRO  21  -7.499   6.563   0.871
  145   2HB   PRO  21          2HB       PRO  21  -6.704   7.356   2.256
  146   1HG   PRO  21          1HG       PRO  21  -9.274   7.811   1.714
  147   2HG   PRO  21          2HG       PRO  21  -8.232   9.199   2.144
  148   1HD   PRO  21          1HD       PRO  21  -9.174   8.384  -0.633
  149   2HD   PRO  21          2HD       PRO  21  -9.037  10.004   0.109
  150    H    VAL  22           H        VAL  22  -4.263   6.993   0.869
  151    HA   VAL  22           HA       VAL  22  -4.049   5.531  -1.718
  152    HB   VAL  22           HB       VAL  22  -1.756   7.146  -0.532
  153   1HG1  VAL  22          1HG1      VAL  22  -0.999   5.176  -1.711
  154   2HG1  VAL  22          2HG1      VAL  22  -2.030   5.568  -3.106
  155   3HG1  VAL  22          3HG1      VAL  22  -0.658   6.613  -2.684
  156   1HG2  VAL  22          1HG2      VAL  22  -2.001   8.522  -2.624
  157   2HG2  VAL  22          2HG2      VAL  22  -3.598   7.799  -2.857
  158   3HG2  VAL  22          3HG2      VAL  22  -3.259   8.755  -1.404
  159    H    LEU  23           H        LEU  23  -3.849   3.459  -1.265
  160    HA   LEU  23           HA       LEU  23  -2.675   2.537   1.308
  161   1HB   LEU  23          2HB       LEU  23  -4.557   1.366  -0.723
  162   2HB   LEU  23          1HB       LEU  23  -3.464   0.277   0.135
  163    HG   LEU  23           HG       LEU  23  -4.219   1.100   2.306
  164   1HD1  LEU  23          1HD1      LEU  23  -6.420   0.073   2.247
  165   2HD1  LEU  23          2HD1      LEU  23  -5.311  -0.823   1.195
  166   3HD1  LEU  23          3HD1      LEU  23  -6.503   0.287   0.481
  167   1HD2  LEU  23          1HD2      LEU  23  -6.325   2.527   2.367
  168   2HD2  LEU  23          2HD2      LEU  23  -4.880   3.397   1.847
  169   3HD2  LEU  23          3HD2      LEU  23  -6.063   2.866   0.639
  170    H    VAL  24           H        VAL  24  -0.541   2.271   1.267
  171    HA   VAL  24           HA       VAL  24   0.814   1.544  -1.321
  172    HB   VAL  24           HB       VAL  24   1.964   2.783   1.205
  173   1HG1  VAL  24          1HG1      VAL  24   3.638   1.413   0.013
  174   2HG1  VAL  24          2HG1      VAL  24   3.967   3.125  -0.257
  175   3HG1  VAL  24          3HG1      VAL  24   3.182   2.170  -1.529
  176   1HG2  VAL  24          1HG2      VAL  24   1.380   3.994  -1.530
  177   2HG2  VAL  24          2HG2      VAL  24   2.235   4.778  -0.188
  178   3HG2  VAL  24          3HG2      VAL  24   0.522   4.379  -0.019
  179    H    ASP  25           HN       ASP  25   1.199  -0.628  -1.482
  180    HA   ASP  25           HA       ASP  25   1.552  -2.278   0.954
  181   1HB   ASP  25          1HB       ASP  25   0.145  -3.215  -0.779
  182   2HB   ASP  25          2HB       ASP  25   1.410  -2.952  -1.980
  183    H    PHE  26           H        PHE  26   3.557  -2.291   1.841
  184    HA   PHE  26           HA       PHE  26   5.918  -1.606   0.191
  185   1HB   PHE  26          2HB       PHE  26   5.522  -2.358   3.105
  186   2HB   PHE  26          1HB       PHE  26   7.102  -2.170   2.351
  187    HD1  PHE  26           HD1      PHE  26   8.119  -0.055   2.183
  188    HD2  PHE  26           HD2      PHE  26   3.875  -0.276   2.921
  189    HE1  PHE  26           HE1      PHE  26   8.009   2.416   2.320
  190    HE2  PHE  26           HE2      PHE  26   3.794   2.178   3.168
  191    HZ   PHE  26           HZ       PHE  26   5.870   3.533   2.916
  192    H    TRP  27           H        TRP  27   6.706  -3.159  -1.141
  193    HA   TRP  27           HA       TRP  27   6.423  -6.045  -0.362
  194   1HB   TRP  27          2HB       TRP  27   5.762  -6.590  -2.574
  195   2HB   TRP  27          1HB       TRP  27   4.702  -5.306  -2.047
  196    HD1  TRP  27           HD1      TRP  27   5.448  -2.832  -3.078
  197    HE1  TRP  27           HE1      TRP  27   6.559  -2.173  -5.333
  198    HE3  TRP  27           HE3      TRP  27   7.050  -7.448  -4.564
  199    HZ2  TRP  27           HZ2      TRP  27   8.080  -3.485  -7.372
  200    HZ3  TRP  27           HZ3      TRP  27   8.285  -7.720  -6.685
  201    HH2  TRP  27           HH2      TRP  27   8.823  -5.750  -8.089
  202    H    ALA  28           H        ALA  28   7.675  -7.289  -2.260
  203    HA   ALA  28           HA       ALA  28   9.956  -6.078  -3.418
  204   1HB   ALA  28          1HB       ALA  28  10.828  -6.167  -1.033
  205   2HB   ALA  28          2HB       ALA  28  11.723  -7.261  -2.083
  206   3HB   ALA  28          3HB       ALA  28  10.484  -7.911  -1.006
  207    HA   PRO  29           HA       PRO  29   9.291  -9.766  -5.793
  208   1HB   PRO  29          1HB       PRO  29  11.762 -10.387  -6.835
  209   2HB   PRO  29          2HB       PRO  29  10.773  -9.002  -7.381
  210   1HG   PRO  29          1HG       PRO  29  13.072  -8.974  -5.412
  211   2HG   PRO  29          2HG       PRO  29  12.767  -7.851  -6.765
  212   1HD   PRO  29          1HD       PRO  29  12.071  -7.201  -4.222
  213   2HD   PRO  29          2HD       PRO  29  11.008  -6.772  -5.572
  214    H    TRP  30           H        TRP  30  12.164  -9.918  -3.664
  215    HA   TRP  30           HA       TRP  30  12.178 -12.776  -3.389
  216   1HB   TRP  30          2HB       TRP  30  13.602 -12.244  -1.383
  217   2HB   TRP  30          1HB       TRP  30  14.163 -11.632  -2.930
  218    HD1  TRP  30           HD1      TRP  30  14.720  -9.157  -3.110
  219    HE1  TRP  30           HE1      TRP  30  14.732  -7.160  -1.505
  220    HE3  TRP  30           HE3      TRP  30  11.952 -11.170   0.715
  221    HZ2  TRP  30           HZ2      TRP  30  13.432  -6.425   0.967
  222    HZ3  TRP  30           HZ3      TRP  30  11.244  -9.750   2.607
  223    HH2  TRP  30           HH2      TRP  30  11.844  -7.350   2.673
  224    H    CYS  31           H        CYS  31   9.982 -10.382  -2.134
  225    HA   CYS  31           HA       CYS  31   9.465 -11.818   0.385
  226   1HB   CYS  31          2HB       CYS  31   9.138  -9.513   0.495
  227   2HB   CYS  31          1HB       CYS  31   8.144  -9.481  -0.958
  228    H    GLY  32           H        GLY  32   8.984 -13.848  -0.146
  229   1HA   GLY  32          1HA       GLY  32   7.611 -15.235  -1.868
  230   2HA   GLY  32          2HA       GLY  32   7.358 -15.529  -0.147
  231    HA   PRO  33           HA       PRO  33   3.115 -14.631  -0.617
  232   1HB   PRO  33          1HB       PRO  33   2.287 -12.815   1.257
  233   2HB   PRO  33          2HB       PRO  33   2.774 -14.488   1.655
  234   1HG   PRO  33          2HG       PRO  33   4.490 -12.005   1.746
  235   2HG   PRO  33          1HG       PRO  33   4.228 -13.186   3.049
  236   1HD   PRO  33          1HD       PRO  33   6.415 -13.332   1.400
  237   2HD   PRO  33          2HD       PRO  33   5.557 -14.842   1.817
  238    H    CYS  34           H        CYS  34   4.962 -11.602  -0.271
  239    HA   CYS  34           HA       CYS  34   3.174  -9.748  -1.349
  240   1HB   CYS  34          2HB       CYS  34   6.140  -9.740  -1.993
  241   2HB   CYS  34          1HB       CYS  34   4.967  -8.448  -2.080
  242    H    ARG  35           HN       ARG  35   5.584 -11.753  -3.002
  243    HA   ARG  35           HA       ARG  35   5.319 -11.070  -5.650
  244   1HB   ARG  35          1HB       ARG  35   6.797 -12.792  -4.439
  245   2HB   ARG  35          2HB       ARG  35   5.502 -13.955  -4.677
  246   1HG   ARG  35          2HG       ARG  35   5.624 -13.573  -7.155
  247   2HG   ARG  35          1HG       ARG  35   6.990 -12.470  -6.885
  248   1HD   ARG  35          1HD       ARG  35   6.850 -15.417  -6.150
  249   2HD   ARG  35          2HD       ARG  35   7.808 -14.723  -7.470
  250    HE   ARG  35           HE       ARG  35   8.906 -13.324  -5.567
  251   1HH1  ARG  35          2HH2      ARG  35   8.046 -16.756  -5.208
  252   2HH1  ARG  35          1HH2      ARG  35   9.024 -16.952  -3.780
  253   1HH2  ARG  35          1HH1      ARG  35  10.072 -13.559  -3.818
  254   2HH2  ARG  35          2HH1      ARG  35  10.240 -15.061  -2.930
  255    H    ILE  36           H        ILE  36   3.328 -13.457  -3.885
  256    HA   ILE  36           HA       ILE  36   1.565 -13.799  -6.259
  257    HB   ILE  36           HB       ILE  36   0.588 -15.677  -5.003
  258   1HG1  ILE  36          2HG1      ILE  36   1.960 -16.616  -3.107
  259   2HG1  ILE  36          1HG1      ILE  36   2.693 -15.046  -2.874
  260   1HG2  ILE  36          1HG2      ILE  36   2.505 -15.903  -6.580
  261   2HG2  ILE  36          2HG2      ILE  36   3.630 -15.763  -5.212
  262   3HG2  ILE  36          3HG2      ILE  36   2.511 -17.135  -5.312
  263   1HD1  ILE  36          1HD1      ILE  36   0.775 -15.571  -1.334
  264   2HD1  ILE  36          2HD1      ILE  36   0.436 -14.126  -2.284
  265   3HD1  ILE  36          3HD1      ILE  36  -0.308 -15.673  -2.734
  266    H    ILE  37           H        ILE  37   1.550 -11.909  -3.355
  267    HA   ILE  37           HA       ILE  37  -1.368 -11.688  -3.356
  268    HB   ILE  37           HB       ILE  37   0.512 -11.456  -1.378
  269   1HG1  ILE  37          1HG1      ILE  37  -1.316 -10.327  -0.041
  270   2HG1  ILE  37          2HG1      ILE  37  -2.284 -10.305  -1.521
  271   1HG2  ILE  37          1HG2      ILE  37   0.815  -9.257  -0.628
  272   2HG2  ILE  37          2HG2      ILE  37  -0.364  -8.596  -1.755
  273   3HG2  ILE  37          3HG2      ILE  37   1.212  -9.154  -2.349
  274   1HD1  ILE  37          1HD1      ILE  37  -2.103 -12.814  -1.619
  275   2HD1  ILE  37          2HD1      ILE  37  -2.775 -12.266  -0.076
  276   3HD1  ILE  37          3HD1      ILE  37  -1.078 -12.775  -0.171
  277    H    ALA  38           H        ALA  38   1.350  -9.905  -4.714
  278    HA   ALA  38           HA       ALA  38   0.463  -7.487  -5.349
  279   1HB   ALA  38          1HB       ALA  38   1.770  -9.415  -7.326
  280   2HB   ALA  38          2HB       ALA  38   2.577  -8.390  -6.131
  281   3HB   ALA  38          3HB       ALA  38   1.711  -7.657  -7.490
  282    HA   PRO  39           HA       PRO  39  -2.402  -8.677  -9.060
  283   1HB   PRO  39          2HB       PRO  39  -3.455 -11.368  -8.301
  284   2HB   PRO  39          1HB       PRO  39  -2.949 -10.779  -9.907
  285   1HG   PRO  39          1HG       PRO  39  -1.414 -12.561  -8.511
  286   2HG   PRO  39          2HG       PRO  39  -0.652 -11.220  -9.422
  287   1HD   PRO  39          1HD       PRO  39  -1.401 -11.255  -6.479
  288   2HD   PRO  39          2HD       PRO  39   0.201 -10.923  -7.197
  289    H    VAL  40           H        VAL  40  -2.914  -9.991  -5.814
  290    HA   VAL  40           HA       VAL  40  -5.741  -9.529  -5.614
  291    HB   VAL  40           HB       VAL  40  -3.745  -9.761  -3.329
  292   1HG1  VAL  40          1HG1      VAL  40  -5.664 -10.592  -2.130
  293   2HG1  VAL  40          2HG1      VAL  40  -6.686 -10.347  -3.571
  294   3HG1  VAL  40          3HG1      VAL  40  -5.923  -8.950  -2.758
  295   1HG2  VAL  40          1HG2      VAL  40  -5.198 -11.962  -4.876
  296   2HG2  VAL  40          2HG2      VAL  40  -3.437 -11.748  -4.807
  297   3HG2  VAL  40          3HG2      VAL  40  -4.325 -12.186  -3.346
  298    H    VAL  41           H        VAL  41  -2.753  -7.855  -4.532
  299    HA   VAL  41           HA       VAL  41  -3.867  -5.520  -3.413
  300    HB   VAL  41           HB       VAL  41  -1.285  -5.644  -5.040
  301   1HG1  VAL  41          1HG1      VAL  41  -0.148  -6.034  -2.894
  302   2HG1  VAL  41          2HG1      VAL  41  -1.723  -6.192  -2.078
  303   3HG1  VAL  41          3HG1      VAL  41  -1.220  -7.353  -3.317
  304   1HG2  VAL  41          1HG2      VAL  41  -1.893  -3.349  -4.594
  305   2HG2  VAL  41          2HG2      VAL  41  -2.297  -3.726  -2.900
  306   3HG2  VAL  41          3HG2      VAL  41  -0.622  -3.795  -3.455
  307    H    ASP  42           HN       ASP  42  -3.005  -6.203  -6.822
  308    HA   ASP  42           HA       ASP  42  -3.810  -3.727  -7.939
  309   1HB   ASP  42          1HB       ASP  42  -3.590  -6.543  -8.993
  310   2HB   ASP  42          2HB       ASP  42  -4.396  -5.334  -9.974
  311    H    GLU  43           HN       GLU  43  -5.883  -6.746  -7.838
  312    HA   GLU  43           HA       GLU  43  -8.109  -5.341  -8.853
  313   1HB   GLU  43          1HB       GLU  43  -9.432  -7.247  -8.127
  314   2HB   GLU  43          2HB       GLU  43  -7.959  -7.735  -8.968
  315   1HG   GLU  43          1HG       GLU  43  -6.892  -8.232  -6.844
  316   2HG   GLU  43          2HG       GLU  43  -8.334  -7.765  -5.934
  317    H    ILE  44           H        ILE  44  -7.011  -5.488  -5.433
  318    HA   ILE  44           HA       ILE  44  -9.555  -4.587  -4.454
  319    HB   ILE  44           HB       ILE  44  -7.294  -3.390  -2.955
  320   1HG1  ILE  44          1HG1      ILE  44  -7.474  -6.409  -3.260
  321   2HG1  ILE  44          2HG1      ILE  44  -6.104  -5.295  -3.556
  322   1HG2  ILE  44          1HG2      ILE  44  -9.698  -3.497  -2.243
  323   2HG2  ILE  44          2HG2      ILE  44  -9.594  -5.269  -2.225
  324   3HG2  ILE  44          3HG2      ILE  44  -8.642  -4.304  -1.090
  325   1HD1  ILE  44          1HD1      ILE  44  -7.246  -6.035  -0.856
  326   2HD1  ILE  44          2HD1      ILE  44  -5.654  -6.419  -1.519
  327   3HD1  ILE  44          3HD1      ILE  44  -6.057  -4.734  -1.136
  328    H    ALA  45           H        ALA  45  -7.046  -2.877  -6.271
  329    HA   ALA  45           HA       ALA  45  -7.811  -0.193  -5.683
  330   1HB   ALA  45          1HB       ALA  45  -5.840  -0.984  -7.119
  331   2HB   ALA  45          2HB       ALA  45  -6.783   0.375  -7.769
  332   3HB   ALA  45          3HB       ALA  45  -7.016  -1.255  -8.415
  333    H    GLY  46           H        GLY  46  -9.211  -2.705  -7.790
  334   1HA   GLY  46          1HA       GLY  46 -11.165  -1.046  -9.127
  335   2HA   GLY  46          2HA       GLY  46 -11.139  -2.818  -9.013
  336    H    GLU  47           HN       GLU  47 -11.105  -3.144  -6.196
  337    HA   GLU  47           HA       GLU  47 -13.853  -2.917  -5.514
  338   1HB   GLU  47          1HB       GLU  47 -11.413  -3.256  -3.744
  339   2HB   GLU  47          2HB       GLU  47 -13.055  -3.433  -3.225
  340   1HG   GLU  47          2HG       GLU  47 -11.813  -5.127  -5.460
  341   2HG   GLU  47          1HG       GLU  47 -11.799  -5.581  -3.755
  342    H    TYR  48           H        TYR  48 -11.063  -0.868  -4.757
  343    HA   TYR  48           HA       TYR  48 -12.679   1.066  -3.245
  344   1HB   TYR  48          1HB       TYR  48  -9.969   1.715  -4.427
  345   2HB   TYR  48          2HB       TYR  48 -10.814   2.365  -3.064
  346    HD1  TYR  48           HD1      TYR  48  -7.965   0.880  -3.622
  347    HD2  TYR  48           HD2      TYR  48 -11.539   0.294  -1.357
  348    HE1  TYR  48           HE1      TYR  48  -6.778  -0.828  -2.222
  349    HE2  TYR  48           HE2      TYR  48 -10.413  -1.474   0.017
  350    HH   TYR  48           HH       TYR  48  -8.370  -2.464   0.525
  351    H    LYS  49           HN       LYS  49 -14.115   0.784  -5.328
  352    HA   LYS  49           HA       LYS  49 -13.849   2.783  -7.386
  353   1HB   LYS  49          2HB       LYS  49 -15.343   0.823  -7.563
  354   2HB   LYS  49          1HB       LYS  49 -16.281   1.349  -6.167
  355   1HG   LYS  49          1HG       LYS  49 -16.039   2.974  -8.743
  356   2HG   LYS  49          2HG       LYS  49 -17.260   1.721  -8.476
  357   1HD   LYS  49          1HD       LYS  49 -17.954   3.004  -6.353
  358   2HD   LYS  49          2HD       LYS  49 -17.013   4.365  -6.984
  359   1HE   LYS  49          2HE       LYS  49 -19.336   2.989  -8.400
  360   2HE   LYS  49          1HE       LYS  49 -19.386   4.553  -7.575
  361   1HZ   LYS  49          1HZ       LYS  49 -17.747   3.921  -9.926
  362   2HZ   LYS  49          2HZ       LYS  49 -17.780   5.371  -9.142
  363   3HZ   LYS  49          3HZ       LYS  49 -19.127   4.820  -9.914
  364    H    ASP  50           HN       ASP  50 -15.272   2.485  -4.150
  365    HA   ASP  50           HA       ASP  50 -15.707   5.360  -3.795
  366   1HB   ASP  50          1HB       ASP  50 -15.057   3.365  -1.721
  367   2HB   ASP  50          2HB       ASP  50 -15.819   4.945  -1.507
  368    H    LYS  51           HN       LYS  51 -13.961   5.826  -4.484
  369    HA   LYS  51           HA       LYS  51 -11.701   5.187  -4.960
  370   1HB   LYS  51          2HB       LYS  51 -12.005   8.113  -4.448
  371   2HB   LYS  51          1HB       LYS  51 -10.706   7.212  -5.284
  372   1HG   LYS  51          1HG       LYS  51 -13.519   6.919  -6.326
  373   2HG   LYS  51          2HG       LYS  51 -12.697   8.440  -6.579
  374   1HD   LYS  51          1HD       LYS  51 -12.418   7.022  -8.506
  375   2HD   LYS  51          2HD       LYS  51 -10.860   7.416  -7.768
  376   1HE   LYS  51          1HE       LYS  51 -10.642   5.175  -6.858
  377   2HE   LYS  51          2HE       LYS  51 -12.326   4.786  -7.280
  378   1HZ   LYS  51          1HZ       LYS  51 -10.770   3.859  -8.799
  379   2HZ   LYS  51          2HZ       LYS  51 -11.716   4.967  -9.570
  380   3HZ   LYS  51          3HZ       LYS  51 -10.159   5.344  -9.172
  381    H    LEU  52           H        LEU  52 -10.594   4.235  -3.803
  382    HA   LEU  52           HA       LEU  52  -8.637   5.617  -1.946
  383   1HB   LEU  52          1HB       LEU  52 -10.231   3.290  -1.313
  384   2HB   LEU  52          2HB       LEU  52  -8.560   2.735  -1.594
  385    HG   LEU  52           HG       LEU  52  -7.859   4.467   0.098
  386   1HD1  LEU  52          1HD1      LEU  52 -10.913   4.677   0.325
  387   2HD1  LEU  52          2HD1      LEU  52  -9.764   5.373   1.494
  388   3HD1  LEU  52          3HD1      LEU  52  -9.831   5.982  -0.168
  389   1HD2  LEU  52          1HD2      LEU  52  -8.740   3.146   2.012
  390   2HD2  LEU  52          2HD2      LEU  52  -8.273   2.068   0.680
  391   3HD2  LEU  52          3HD2      LEU  52  -9.979   2.442   0.947
  392    H    LYS  53           HN       LYS  53  -6.611   5.781  -2.894
  393    HA   LYS  53           HA       LYS  53  -6.220   4.358  -5.443
  394   1HB   LYS  53          1HB       LYS  53  -5.529   6.788  -4.684
  395   2HB   LYS  53          2HB       LYS  53  -4.113   5.991  -4.029
  396   1HG   LYS  53          2HG       LYS  53  -4.914   5.437  -6.902
  397   2HG   LYS  53          1HG       LYS  53  -4.203   7.000  -6.503
  398   1HD   LYS  53          2HD       LYS  53  -2.193   6.079  -5.673
  399   2HD   LYS  53          1HD       LYS  53  -2.844   4.437  -5.646
  400   1HE   LYS  53          1HE       LYS  53  -2.484   6.011  -8.225
  401   2HE   LYS  53          2HE       LYS  53  -1.244   4.948  -7.540
  402   1HZ   LYS  53          1HZ       LYS  53  -2.546   3.785  -9.129
  403   2HZ   LYS  53          2HZ       LYS  53  -3.941   4.099  -8.315
  404   3HZ   LYS  53          3HZ       LYS  53  -2.785   3.140  -7.630
  405    H    CYS  54           H        CYS  54  -4.502   2.787  -5.753
  406    HA   CYS  54           HA       CYS  54  -3.489   1.518  -3.243
  407   1HB   CYS  54          1HB       CYS  54  -5.435   0.258  -4.236
  408   2HB   CYS  54          2HB       CYS  54  -4.457   0.053  -5.713
  409    HG   CYS  54           HG       CYS  54  -4.288  -2.139  -4.407
  410    H    VAL  55           H        VAL  55  -1.318   0.906  -3.340
  411    HA   VAL  55           HA       VAL  55   0.078   1.066  -5.904
  412    HB   VAL  55           HB       VAL  55   1.611   2.586  -3.937
  413   1HG1  VAL  55          1HG1      VAL  55  -0.555   3.345  -3.023
  414   2HG1  VAL  55          2HG1      VAL  55   0.369   4.635  -3.814
  415   3HG1  VAL  55          3HG1      VAL  55  -1.010   3.914  -4.644
  416   1HG2  VAL  55          1HG2      VAL  55   1.663   4.241  -5.763
  417   2HG2  VAL  55          2HG2      VAL  55   2.029   2.609  -6.347
  418   3HG2  VAL  55          3HG2      VAL  55   0.423   3.323  -6.636
  419    H    LYS  56           HN       LYS  56   2.308   0.364  -5.717
  420    HA   LYS  56           HA       LYS  56   2.890  -1.331  -3.330
  421   1HB   LYS  56          2HB       LYS  56   2.698  -1.886  -6.245
  422   2HB   LYS  56          1HB       LYS  56   4.020  -2.677  -5.384
  423   1HG   LYS  56          1HG       LYS  56   2.556  -3.664  -3.776
  424   2HG   LYS  56          2HG       LYS  56   1.153  -2.776  -4.413
  425   1HD   LYS  56          1HD       LYS  56   2.773  -4.795  -6.027
  426   2HD   LYS  56          2HD       LYS  56   1.359  -5.222  -5.046
  427   1HE   LYS  56          1HE       LYS  56  -0.033  -3.607  -6.348
  428   2HE   LYS  56          2HE       LYS  56   1.353  -3.273  -7.403
  429   1HZ   LYS  56          1HZ       LYS  56   0.036  -5.872  -7.038
  430   2HZ   LYS  56          2HZ       LYS  56  -0.078  -4.911  -8.356
  431   3HZ   LYS  56          3HZ       LYS  56   1.367  -5.600  -7.978
  432    H    LEU  57           H        LEU  57   4.609  -0.604  -2.305
  433    HA   LEU  57           HA       LEU  57   6.687   0.997  -3.714
  434   1HB   LEU  57          1HB       LEU  57   5.657   2.020  -1.806
  435   2HB   LEU  57          2HB       LEU  57   6.056   0.631  -0.763
  436    HG   LEU  57           HG       LEU  57   7.331   2.638  -0.351
  437   1HD1  LEU  57          1HD1      LEU  57   8.934   3.531  -1.893
  438   2HD1  LEU  57          2HD1      LEU  57   8.628   2.214  -3.050
  439   3HD1  LEU  57          3HD1      LEU  57   7.384   3.447  -2.732
  440   1HD2  LEU  57          1HD2      LEU  57   8.235   0.229  -0.038
  441   2HD2  LEU  57          2HD2      LEU  57   9.253   0.581  -1.417
  442   3HD2  LEU  57          3HD2      LEU  57   9.382   1.581   0.043
  443    H    ASN  58           H        ASN  58   8.405  -0.047  -4.446
  444    HA   ASN  58           HA       ASN  58   9.037  -2.757  -3.507
  445   1HB   ASN  58          1HB       ASN  58   9.377  -2.096  -5.854
  446   2HB   ASN  58          2HB       ASN  58  10.613  -0.944  -5.354
  447   1HD2  ASN  58          2HD2      ASN  58  10.247  -4.031  -6.561
  448   2HD2  ASN  58          1HD2      ASN  58  11.746  -4.718  -5.962
  449    H    THR  59           H        THR  59   9.924  -3.054  -1.624
  450    HA   THR  59           HA       THR  59  11.023  -0.954  -0.006
  451    HB   THR  59           HB       THR  59  11.113  -3.977   0.405
  452    HG1  THR  59           HG1      THR  59   9.010  -3.394   0.040
  453   1HG2  THR  59          1HG2      THR  59  12.466  -2.713   2.062
  454   2HG2  THR  59          2HG2      THR  59  11.071  -1.660   2.383
  455   3HG2  THR  59          3HG2      THR  59  11.000  -3.380   2.805
  456    H    ASP  60           HN       ASP  60  12.449  -3.364  -2.142
  457    HA   ASP  60           HA       ASP  60  15.132  -3.274  -1.035
  458   1HB   ASP  60          1HB       ASP  60  13.883  -5.083  -2.470
  459   2HB   ASP  60          2HB       ASP  60  14.355  -4.110  -3.851
  460    H    GLU  61           HN       GLU  61  13.332  -1.785  -3.634
  461    HA   GLU  61           HA       GLU  61  15.506  -0.177  -4.703
  462   1HB   GLU  61          2HB       GLU  61  13.398  -1.182  -5.887
  463   2HB   GLU  61          1HB       GLU  61  12.536   0.194  -5.173
  464   1HG   GLU  61          1HG       GLU  61  13.106   0.812  -7.379
  465   2HG   GLU  61          2HG       GLU  61  14.237   1.704  -6.361
  466    H    SER  62           H        SER  62  12.904   0.289  -2.363
  467    HA   SER  62           HA       SER  62  13.705   3.137  -1.904
  468   1HB   SER  62          2HB       SER  62  11.514   2.823  -3.014
  469   2HB   SER  62          1HB       SER  62  10.939   1.904  -1.624
  470    HG   SER  62           HG       SER  62  11.361   3.680  -0.324
  471    HA   PRO  63           HA       PRO  63  14.167   0.463   2.003
  472   1HB   PRO  63          1HB       PRO  63  16.837   0.797   2.410
  473   2HB   PRO  63          2HB       PRO  63  16.212  -0.449   1.286
  474   1HG   PRO  63          2HG       PRO  63  17.157   2.357   0.563
  475   2HG   PRO  63          1HG       PRO  63  17.687   0.830  -0.155
  476   1HD   PRO  63          1HD       PRO  63  15.738   2.215  -1.359
  477   2HD   PRO  63          2HD       PRO  63  15.578   0.449  -1.194
  478    H    ASN  64           H        ASN  64  15.395   3.485   0.737
  479    HA   ASN  64           HA       ASN  64  15.922   5.071   2.943
  480   1HB   ASN  64          1HB       ASN  64  14.333   5.874   0.457
  481   2HB   ASN  64          2HB       ASN  64  15.042   7.000   1.624
  482   1HD2  ASN  64          2HD2      ASN  64  15.762   7.460  -0.860
  483   2HD2  ASN  64          1HD2      ASN  64  17.397   6.873  -1.179
  484    H    VAL  65           H        VAL  65  12.707   5.109   1.403
  485    HA   VAL  65           HA       VAL  65  11.337   6.379   3.490
  486    HB   VAL  65           HB       VAL  65  10.312   4.394   1.402
  487   1HG1  VAL  65          1HG2      VAL  65   8.649   4.731   3.212
  488   2HG1  VAL  65          2HG2      VAL  65   8.144   5.482   1.696
  489   3HG1  VAL  65          3HG2      VAL  65   8.796   6.491   3.007
  490   1HG2  VAL  65          1HG1      VAL  65  11.457   6.293   0.344
  491   2HG2  VAL  65          2HG1      VAL  65  10.581   7.434   1.380
  492   3HG2  VAL  65          3HG1      VAL  65   9.709   6.481   0.160
  493    H    ALA  66           H        ALA  66  11.425   2.904   2.725
  494    HA   ALA  66           HA       ALA  66   9.865   1.975   4.843
  495   1HB   ALA  66          1HB       ALA  66  10.554   0.578   3.005
  496   2HB   ALA  66          2HB       ALA  66  12.263   0.670   3.513
  497   3HB   ALA  66          3HB       ALA  66  11.080  -0.179   4.526
  498    H    SER  67           H        SER  67  13.433   2.491   4.921
  499    HA   SER  67           HA       SER  67  13.753   1.525   7.595
  500   1HB   SER  67          1HB       SER  67  15.946   2.637   7.512
  501   2HB   SER  67          2HB       SER  67  15.645   1.663   6.062
  502    HG   SER  67           HG       SER  67  15.077   3.617   4.977
  503    H    GLU  68           HN       GLU  68  13.452   4.825   6.286
  504    HA   GLU  68           HA       GLU  68  13.457   6.281   8.705
  505   1HB   GLU  68          1HB       GLU  68  11.917   6.726   6.113
  506   2HB   GLU  68          2HB       GLU  68  12.004   7.917   7.409
  507   1HG   GLU  68          2HG       GLU  68  14.346   8.247   7.112
  508   2HG   GLU  68          1HG       GLU  68  14.537   6.773   6.161
  509    H    TYR  69           H        TYR  69  10.785   4.627   7.074
  510    HA   TYR  69           HA       TYR  69   8.755   5.366   9.022
  511   1HB   TYR  69          1HB       TYR  69   8.973   3.700   6.521
  512   2HB   TYR  69          2HB       TYR  69   7.677   3.335   7.595
  513    HD1  TYR  69           HD1      TYR  69   9.339   6.370   6.046
  514    HD2  TYR  69           HD2      TYR  69   5.660   4.608   7.432
  515    HE1  TYR  69           HE1      TYR  69   8.102   8.302   5.175
  516    HE2  TYR  69           HE2      TYR  69   4.420   6.600   6.622
  517    HH   TYR  69           HH       TYR  69   6.067   9.349   5.039
  518    H    GLY  70           H        GLY  70  11.016   2.705   8.734
  519   1HA   GLY  70          1HA       GLY  70  11.703   1.367  10.547
  520   2HA   GLY  70          2HA       GLY  70  10.208   1.742  11.423
  521    H    ILE  71           H        ILE  71  10.257   0.719   8.054
  522    HA   ILE  71           HA       ILE  71   8.444  -1.498   8.692
  523    HB   ILE  71           HB       ILE  71   9.518  -0.531   6.023
  524   1HG1  ILE  71          1HG1      ILE  71   7.121   0.278   7.722
  525   2HG1  ILE  71          2HG1      ILE  71   8.448   1.296   7.158
  526   1HG2  ILE  71          1HG2      ILE  71   7.566  -1.704   5.095
  527   2HG2  ILE  71          2HG2      ILE  71   8.548  -2.834   6.011
  528   3HG2  ILE  71          3HG2      ILE  71   7.053  -2.194   6.727
  529   1HD1  ILE  71          1HD1      ILE  71   6.287   0.142   5.394
  530   2HD1  ILE  71          2HD1      ILE  71   6.602   1.842   5.794
  531   3HD1  ILE  71          3HD1      ILE  71   7.784   0.935   4.838
  532    H    ARG  72           HN       ARG  72   9.986  -2.557  10.004
  533    HA   ARG  72           HA       ARG  72  12.367  -3.774   8.918
  534   1HB   ARG  72          1HB       ARG  72  12.334  -5.048  11.041
  535   2HB   ARG  72          2HB       ARG  72  12.154  -3.313  11.303
  536   1HG   ARG  72          1HG       ARG  72   9.949  -3.484  12.009
  537   2HG   ARG  72          2HG       ARG  72   9.610  -4.934  11.057
  538   1HD   ARG  72          1HD       ARG  72  10.955  -6.320  12.582
  539   2HD   ARG  72          2HD       ARG  72  11.392  -4.881  13.512
  540    HE   ARG  72           HE       ARG  72   9.378  -4.903  14.564
  541   1HH1  ARG  72          1HH2      ARG  72   9.041  -7.025  11.679
  542   2HH1  ARG  72          2HH2      ARG  72   7.559  -7.707  12.257
  543   1HH2  ARG  72          1HH1      ARG  72   7.412  -5.785  15.215
  544   2HH2  ARG  72          2HH1      ARG  72   6.593  -6.975  14.243
  545    H    SER  73           H        SER  73   9.144  -4.571   8.178
  546    HA   SER  73           HA       SER  73   9.914  -7.171   7.173
  547   1HB   SER  73          2HB       SER  73   7.588  -7.043   9.132
  548   2HB   SER  73          1HB       SER  73   8.307  -8.478   8.389
  549    HG   SER  73           HG       SER  73  10.319  -7.555   9.564
  550    H    ILE  74           H        ILE  74   8.160  -8.012   5.777
  551    HA   ILE  74           HA       ILE  74   6.025  -6.195   4.991
  552    HB   ILE  74           HB       ILE  74   6.824  -6.371   2.565
  553   1HG1  ILE  74          1HG1      ILE  74   9.565  -6.982   3.659
  554   2HG1  ILE  74          2HG1      ILE  74   8.482  -8.207   2.971
  555   1HG2  ILE  74          1HG2      ILE  74   8.175  -4.395   2.698
  556   2HG2  ILE  74          2HG2      ILE  74   8.730  -4.788   4.331
  557   3HG2  ILE  74          3HG2      ILE  74   7.041  -4.311   4.045
  558   1HD1  ILE  74          1HD1      ILE  74   9.880  -7.445   1.183
  559   2HD1  ILE  74          2HD1      ILE  74   8.266  -6.831   0.892
  560   3HD1  ILE  74          3HD1      ILE  74   9.532  -5.747   1.518
  561    HA   PRO  75           HA       PRO  75   4.669  -6.585   2.714
  562   1HB   PRO  75          1HB       PRO  75   2.109  -7.410   2.417
  563   2HB   PRO  75          2HB       PRO  75   3.434  -7.949   1.401
  564   1HG   PRO  75          1HG       PRO  75   2.280  -9.383   3.840
  565   2HG   PRO  75          2HG       PRO  75   2.647 -10.098   2.240
  566   1HD   PRO  75          1HD       PRO  75   4.285 -10.248   4.452
  567   2HD   PRO  75          2HD       PRO  75   4.952 -10.162   2.808
  568    H    THR  76           H        THR  76   3.465  -4.886   3.266
  569    HA   THR  76           HA       THR  76   1.652  -4.820   5.523
  570    HB   THR  76           HB       THR  76   4.390  -3.502   5.735
  571    HG1  THR  76           HG1      THR  76   3.554  -5.765   6.612
  572   1HG2  THR  76          1HG2      THR  76   3.535  -2.492   7.848
  573   2HG2  THR  76          2HG2      THR  76   1.904  -3.062   7.447
  574   3HG2  THR  76          3HG2      THR  76   2.703  -1.834   6.432
  575    H    ILE  77           H        ILE  77   0.106  -3.537   4.821
  576    HA   ILE  77           HA       ILE  77   0.584  -1.623   2.633
  577    HB   ILE  77           HB       ILE  77  -2.063  -2.620   3.724
  578   1HG1  ILE  77          1HG1      ILE  77  -0.382  -3.769   1.458
  579   2HG1  ILE  77          2HG1      ILE  77  -0.842  -4.585   2.958
  580   1HG2  ILE  77          1HG2      ILE  77  -1.308  -1.390   1.031
  581   2HG2  ILE  77          2HG2      ILE  77  -2.945  -1.744   1.626
  582   3HG2  ILE  77          3HG2      ILE  77  -1.995  -0.471   2.385
  583   1HD1  ILE  77          1HD1      ILE  77  -3.250  -4.388   2.292
  584   2HD1  ILE  77          2HD1      ILE  77  -2.708  -3.798   0.698
  585   3HD1  ILE  77          3HD1      ILE  77  -2.255  -5.419   1.241
  586    H    MET  78           H        MET  78   0.839   0.521   3.282
  587    HA   MET  78           HA       MET  78  -0.337   1.268   5.957
  588   1HB   MET  78          2HB       MET  78   1.653   2.823   4.371
  589   2HB   MET  78          1HB       MET  78   1.045   3.180   5.979
  590   1HG   MET  78          2HG       MET  78   1.918   0.979   6.786
  591   2HG   MET  78          1HG       MET  78   2.755   0.771   5.249
  592   1HE   MET  78          1HE       MET  78   5.258   1.598   8.319
  593   2HE   MET  78          2HE       MET  78   4.703   0.299   7.229
  594   3HE   MET  78          3HE       MET  78   3.630   0.911   8.503
  595    H    VAL  79           H        VAL  79  -1.560   3.084   6.108
  596    HA   VAL  79           HA       VAL  79  -3.177   3.692   3.652
  597    HB   VAL  79           HB       VAL  79  -3.911   3.799   6.604
  598   1HG1  VAL  79          1HG1      VAL  79  -4.929   2.001   4.376
  599   2HG1  VAL  79          2HG1      VAL  79  -3.846   1.501   5.692
  600   3HG1  VAL  79          3HG1      VAL  79  -5.496   2.025   6.056
  601   1HG2  VAL  79          1HG2      VAL  79  -5.057   5.634   5.501
  602   2HG2  VAL  79          2HG2      VAL  79  -6.217   4.327   5.697
  603   3HG2  VAL  79          3HG2      VAL  79  -5.466   4.613   4.113
  604    H    PHE  80           H        PHE  80  -2.323   5.529   2.785
  605    HA   PHE  80           HA       PHE  80  -1.622   7.828   4.536
  606   1HB   PHE  80          1HB       PHE  80  -1.349   7.309   1.587
  607   2HB   PHE  80          2HB       PHE  80  -0.997   8.859   2.343
  608    HD1  PHE  80           HD1      PHE  80   0.034   5.269   2.191
  609    HD2  PHE  80           HD2      PHE  80   1.009   9.208   3.654
  610    HE1  PHE  80           HE1      PHE  80   2.246   4.452   2.952
  611    HE2  PHE  80           HE2      PHE  80   3.139   8.345   4.558
  612    HZ   PHE  80           HZ       PHE  80   3.733   5.937   4.273
  613    H    LYS  81           HN       LYS  81  -3.081   9.291   4.998
  614    HA   LYS  81           HA       LYS  81  -5.719   9.224   3.544
  615   1HB   LYS  81          2HB       LYS  81  -6.798   9.632   5.557
  616   2HB   LYS  81          1HB       LYS  81  -5.561   8.458   5.988
  617   1HG   LYS  81          1HG       LYS  81  -5.661  11.440   6.602
  618   2HG   LYS  81          2HG       LYS  81  -5.684  10.088   7.725
  619   1HD   LYS  81          1HD       LYS  81  -3.287   9.552   6.921
  620   2HD   LYS  81          2HD       LYS  81  -3.337  11.104   6.065
  621   1HE   LYS  81          1HE       LYS  81  -2.256  11.585   8.081
  622   2HE   LYS  81          2HE       LYS  81  -3.899  12.213   8.284
  623   1HZ   LYS  81          1HZ       LYS  81  -2.787   9.700   9.331
  624   2HZ   LYS  81          2HZ       LYS  81  -3.207  11.028  10.203
  625   3HZ   LYS  81          3HZ       LYS  81  -4.380  10.125   9.478
  626    H    GLY  82           H        GLY  82  -2.999  10.966   3.547
  627   1HA   GLY  82          1HA       GLY  82  -3.483  13.096   2.182
  628   2HA   GLY  82          2HA       GLY  82  -4.182  13.677   3.709
  629    H    GLY  83           H        GLY  83  -1.229  13.108   1.953
  630   1HA   GLY  83          2HA       GLY  83   0.915  13.782   2.463
  631   2HA   GLY  83          1HA       GLY  83   0.333  14.465   3.973
  632    H    LYS  84           HN       LYS  84  -0.289  12.748   5.636
  633    HA   LYS  84           HA       LYS  84   2.009  10.818   5.844
  634   1HB   LYS  84          2HB       LYS  84   0.319  12.054   8.049
  635   2HB   LYS  84          1HB       LYS  84   1.768  11.066   8.257
  636   1HG   LYS  84          2HG       LYS  84   1.636  13.854   7.025
  637   2HG   LYS  84          1HG       LYS  84   2.286  13.407   8.604
  638   1HD   LYS  84          1HD       LYS  84   4.018  11.983   7.456
  639   2HD   LYS  84          2HD       LYS  84   3.417  12.570   5.889
  640   1HE   LYS  84          1HE       LYS  84   3.912  14.906   6.565
  641   2HE   LYS  84          2HE       LYS  84   4.560  14.318   8.109
  642   1HZ   LYS  84          1HZ       LYS  84   6.275  14.698   6.509
  643   2HZ   LYS  84          2HZ       LYS  84   6.200  13.095   6.879
  644   3HZ   LYS  84          3HZ       LYS  84   5.594  13.640   5.445
  645    H    LYS  85           HN       LYS  85   1.537   9.002   7.406
  646    HA   LYS  85           HA       LYS  85  -0.645   7.441   6.290
  647   1HB   LYS  85          1HB       LYS  85   0.220   5.613   7.505
  648   2HB   LYS  85          2HB       LYS  85   1.527   6.405   6.628
  649   1HG   LYS  85          2HG       LYS  85   2.365   7.449   8.655
  650   2HG   LYS  85          1HG       LYS  85   0.986   6.880   9.606
  651   1HD   LYS  85          1HD       LYS  85   2.994   5.038   8.235
  652   2HD   LYS  85          2HD       LYS  85   3.084   5.565   9.924
  653   1HE   LYS  85          2HE       LYS  85   0.786   4.561  10.304
  654   2HE   LYS  85          1HE       LYS  85   0.872   3.869   8.672
  655   1HZ   LYS  85          1HZ       LYS  85   1.587   2.322  10.298
  656   2HZ   LYS  85          2HZ       LYS  85   2.756   3.344  10.850
  657   3HZ   LYS  85          3HZ       LYS  85   2.853   2.731   9.323
  658    H    CYS  86           H        CYS  86  -2.156   6.288   7.645
  659    HA   CYS  86           HA       CYS  86  -2.927   7.694  10.190
  660   1HB   CYS  86          2HB       CYS  86  -4.523   8.080   8.300
  661   2HB   CYS  86          1HB       CYS  86  -4.794   6.345   8.182
  662    HG   CYS  86           HG       CYS  86  -6.746   6.910   9.575
  663    H    GLU  87           HN       GLU  87  -3.642   4.646   8.453
  664    HA   GLU  87           HA       GLU  87  -2.743   3.088  10.843
  665   1HB   GLU  87          2HB       GLU  87  -4.986   2.093   9.088
  666   2HB   GLU  87          1HB       GLU  87  -4.546   1.654  10.736
  667   1HG   GLU  87          2HG       GLU  87  -6.423   2.829  11.190
  668   2HG   GLU  87          1HG       GLU  87  -5.266   4.151  11.303
  669    H    THR  88           H        THR  88  -2.989   0.559   9.804
  670    HA   THR  88           HA       THR  88  -1.859   0.343   7.198
  671    HB   THR  88           HB       THR  88   0.169   0.989   8.462
  672    HG1  THR  88           HG1      THR  88   0.179  -0.769   6.861
  673   1HG2  THR  88          1HG2      THR  88  -0.391  -1.441  10.231
  674   2HG2  THR  88          2HG2      THR  88   1.063  -0.431  10.266
  675   3HG2  THR  88          3HG2      THR  88  -0.497   0.259  10.743
  676    H    ILE  89           H        ILE  89  -1.418  -2.088   6.791
  677    HA   ILE  89           HA       ILE  89  -3.059  -3.898   8.462
  678    HB   ILE  89           HB       ILE  89  -3.345  -3.692   5.425
  679   1HG1  ILE  89          2HG1      ILE  89  -5.272  -2.633   7.534
  680   2HG1  ILE  89          1HG1      ILE  89  -4.302  -1.641   6.431
  681   1HG2  ILE  89          1HG2      ILE  89  -5.203  -5.256   5.752
  682   2HG2  ILE  89          2HG2      ILE  89  -5.033  -5.144   7.517
  683   3HG2  ILE  89          3HG2      ILE  89  -3.778  -5.916   6.533
  684   1HD1  ILE  89          1HD1      ILE  89  -6.524  -1.732   5.581
  685   2HD1  ILE  89          2HD1      ILE  89  -6.526  -3.498   5.562
  686   3HD1  ILE  89          3HD1      ILE  89  -5.435  -2.599   4.482
  687    H    ILE  90           H        ILE  90  -1.959  -5.927   8.553
  688    HA   ILE  90           HA       ILE  90   0.671  -6.062   7.220
  689    HB   ILE  90           HB       ILE  90  -0.791  -8.004   9.056
  690   1HG1  ILE  90          2HG1      ILE  90   1.527  -6.071   9.581
  691   2HG1  ILE  90          1HG1      ILE  90  -0.144  -5.807  10.091
  692   1HG2  ILE  90          1HG2      ILE  90   2.101  -8.008   8.058
  693   2HG2  ILE  90          2HG2      ILE  90   0.845  -9.169   7.580
  694   3HG2  ILE  90          3HG2      ILE  90   1.411  -9.142   9.237
  695   1HD1  ILE  90          1HD1      ILE  90   1.037  -6.607  11.985
  696   2HD1  ILE  90          2HD1      ILE  90   1.713  -7.981  11.106
  697   3HD1  ILE  90          3HD1      ILE  90  -0.034  -7.916  11.448
  698    H    GLY  91           H        GLY  91   1.120  -7.523   5.464
  699   1HA   GLY  91          2HA       GLY  91  -1.239  -8.117   3.828
  700   2HA   GLY  91          1HA       GLY  91   0.422  -8.388   3.380
  701    H    ALA  92           H        ALA  92  -0.092 -10.525   2.579
  702    HA   ALA  92           HA       ALA  92  -0.719 -12.713   2.582
  703   1HB   ALA  92          1HB       ALA  92   1.378 -12.795   3.916
  704   2HB   ALA  92          2HB       ALA  92   0.432 -12.652   5.413
  705   3HB   ALA  92          3HB       ALA  92   0.232 -14.070   4.370
  706    H    VAL  93           H        VAL  93  -2.932 -11.367   2.741
  707    HA   VAL  93           HA       VAL  93  -4.642 -12.743   4.723
  708    HB   VAL  93           HB       VAL  93  -5.778 -10.208   4.008
  709   1HG1  VAL  93          1HG1      VAL  93  -3.139  -9.853   5.453
  710   2HG1  VAL  93          2HG1      VAL  93  -4.329  -8.591   5.117
  711   3HG1  VAL  93          3HG1      VAL  93  -3.438  -9.320   3.776
  712   1HG2  VAL  93          1HG2      VAL  93  -6.060  -9.773   6.276
  713   2HG2  VAL  93          2HG2      VAL  93  -6.459 -11.457   5.933
  714   3HG2  VAL  93          3HG2      VAL  93  -4.914 -11.068   6.727
  715    HA   PRO  94           HA       PRO  94  -7.135 -12.994   0.904
  716   1HB   PRO  94          2HB       PRO  94  -9.577 -12.777   2.575
  717   2HB   PRO  94          1HB       PRO  94  -9.152 -14.068   1.446
  718   1HG   PRO  94          2HG       PRO  94  -9.042 -14.480   4.173
  719   2HG   PRO  94          1HG       PRO  94  -7.731 -15.123   3.134
  720   1HD   PRO  94          1HD       PRO  94  -7.805 -12.466   4.582
  721   2HD   PRO  94          2HD       PRO  94  -6.534 -13.698   4.732
  722    H    LYS  95           HN       LYS  95  -8.073 -11.287  -0.310
  723    HA   LYS  95           HA       LYS  95  -7.794  -8.722   0.785
  724   1HB   LYS  95          1HB       LYS  95  -9.348  -8.075  -1.242
  725   2HB   LYS  95          2HB       LYS  95  -7.730  -8.688  -1.581
  726   1HG   LYS  95          2HG       LYS  95  -8.639 -10.882  -2.169
  727   2HG   LYS  95          1HG       LYS  95 -10.266 -10.415  -1.636
  728   1HD   LYS  95          2HD       LYS  95  -8.760  -8.928  -3.826
  729   2HD   LYS  95          1HD       LYS  95  -9.723 -10.378  -4.155
  730   1HE   LYS  95          2HE       LYS  95 -11.752  -9.326  -3.329
  731   2HE   LYS  95          1HE       LYS  95 -10.873  -7.863  -2.853
  732   1HZ   LYS  95          1HZ       LYS  95 -10.390  -7.425  -5.091
  733   2HZ   LYS  95          2HZ       LYS  95 -10.994  -8.868  -5.600
  734   3HZ   LYS  95          3HZ       LYS  95 -12.011  -7.719  -4.985
  735    H    ALA  96           H        ALA  96 -10.559 -10.836   0.773
  736    HA   ALA  96           HA       ALA  96 -12.677  -9.053   1.308
  737   1HB   ALA  96          1HB       ALA  96 -13.660 -10.879   2.671
  738   2HB   ALA  96          2HB       ALA  96 -12.106 -11.739   2.659
  739   3HB   ALA  96          3HB       ALA  96 -12.998 -11.489   1.142
  740    H    THR  97           H        THR  97 -10.427 -10.539   3.721
  741    HA   THR  97           HA       THR  97 -11.226  -9.088   5.964
  742    HB   THR  97           HB       THR  97  -8.415 -10.049   5.281
  743    HG1  THR  97           HG1      THR  97 -10.687 -11.509   6.165
  744   1HG2  THR  97          1HG2      THR  97  -8.345 -10.625   7.693
  745   2HG2  THR  97          2HG2      THR  97  -8.614  -8.888   7.462
  746   3HG2  THR  97          3HG2      THR  97  -9.970  -9.944   7.914
  747    H    ILE  98           H        ILE  98  -8.740  -8.301   3.478
  748    HA   ILE  98           HA       ILE  98  -7.736  -5.941   4.727
  749    HB   ILE  98           HB       ILE  98  -7.911  -6.659   1.755
  750   1HG1  ILE  98          2HG1      ILE  98  -5.686  -6.989   3.819
  751   2HG1  ILE  98          1HG1      ILE  98  -6.654  -8.284   3.106
  752   1HG2  ILE  98          1HG2      ILE  98  -6.152  -4.960   1.440
  753   2HG2  ILE  98          2HG2      ILE  98  -7.579  -4.201   2.117
  754   3HG2  ILE  98          3HG2      ILE  98  -6.197  -4.567   3.170
  755   1HD1  ILE  98          1HD1      ILE  98  -5.759  -7.590   0.827
  756   2HD1  ILE  98          2HD1      ILE  98  -4.599  -6.561   1.696
  757   3HD1  ILE  98          3HD1      ILE  98  -4.594  -8.309   1.948
  758    H    VAL  99           H        VAL  99 -10.422  -6.389   2.376
  759    HA   VAL  99           HA       VAL  99 -11.122  -3.625   2.208
  760    HB   VAL  99           HB       VAL  99 -12.661  -6.178   1.636
  761   1HG1  VAL  99          1HG1      VAL  99 -14.324  -4.429   2.040
  762   2HG1  VAL  99          2HG1      VAL  99 -13.420  -3.283   1.028
  763   3HG1  VAL  99          3HG1      VAL  99 -14.197  -4.708   0.304
  764   1HG2  VAL  99          1HG2      VAL  99 -11.382  -4.107  -0.208
  765   2HG2  VAL  99          2HG2      VAL  99 -12.186  -5.608  -0.705
  766   3HG2  VAL  99          3HG2      VAL  99 -10.657  -5.674   0.182
  767    H    GLN 100           H        GLN 100 -12.384  -6.294   4.330
  768    HA   GLN 100           HA       GLN 100 -14.309  -4.680   5.710
  769   1HB   GLN 100          1HB       GLN 100 -12.752  -7.163   6.479
  770   2HB   GLN 100          2HB       GLN 100 -13.704  -6.288   7.680
  771   1HG   GLN 100          1HG       GLN 100 -15.040  -8.046   6.821
  772   2HG   GLN 100          2HG       GLN 100 -15.747  -6.509   6.298
  773   1HE2  GLN 100          2HE2      GLN 100 -15.125  -5.779   4.000
  774   2HE2  GLN 100          1HE2      GLN 100 -14.451  -6.984   2.919
  775    H    THR 101           H        THR 101 -10.912  -5.205   6.243
  776    HA   THR 101           HA       THR 101 -10.705  -3.589   8.638
  777    HB   THR 101           HB       THR 101  -8.512  -4.099   6.588
  778    HG1  THR 101           HG1      THR 101  -9.439  -6.021   7.365
  779   1HG2  THR 101          1HG2      THR 101  -7.903  -2.357   8.201
  780   2HG2  THR 101          2HG2      THR 101  -7.042  -3.859   8.591
  781   3HG2  THR 101          3HG2      THR 101  -8.450  -3.374   9.553
  782    H    VAL 102           H        VAL 102 -10.226  -2.750   5.159
  783    HA   VAL 102           HA       VAL 102  -9.702   0.013   5.534
  784    HB   VAL 102           HB       VAL 102 -10.929  -1.586   3.256
  785   1HG1  VAL 102          1HG1      VAL 102  -8.484  -1.814   3.712
  786   2HG1  VAL 102          2HG1      VAL 102  -8.323  -0.052   3.569
  787   3HG1  VAL 102          3HG1      VAL 102  -8.805  -1.018   2.160
  788   1HG2  VAL 102          1HG2      VAL 102 -11.963   0.604   3.028
  789   2HG2  VAL 102          2HG2      VAL 102 -10.685   0.419   1.832
  790   3HG2  VAL 102          3HG2      VAL 102 -10.391   1.401   3.287
  791    H    GLU 103           HN       GLU 103 -12.827  -1.680   5.110
  792    HA   GLU 103           HA       GLU 103 -14.480   0.603   5.257
  793   1HB   GLU 103          2HB       GLU 103 -14.971  -2.288   6.105
  794   2HB   GLU 103          1HB       GLU 103 -16.213  -1.035   6.031
  795   1HG   GLU 103          1HG       GLU 103 -15.949  -0.726   3.681
  796   2HG   GLU 103          2HG       GLU 103 -14.515  -1.747   3.601
  797    H    LYS 104           HN       LYS 104 -13.309  -1.544   7.855
  798    HA   LYS 104           HA       LYS 104 -14.485  -0.198  10.023
  799   1HB   LYS 104          1HB       LYS 104 -13.479  -1.895  11.082
  800   2HB   LYS 104          2HB       LYS 104 -12.566  -2.265   9.656
  801   1HG   LYS 104          1HG       LYS 104 -11.107  -2.173  11.466
  802   2HG   LYS 104          2HG       LYS 104 -10.700  -0.870  10.371
  803   1HD   LYS 104          1HD       LYS 104 -10.497  -0.409  12.823
  804   2HD   LYS 104          2HD       LYS 104 -11.419   0.802  11.971
  805   1HE   LYS 104          2HE       LYS 104 -12.716  -1.490  13.523
  806   2HE   LYS 104          1HE       LYS 104 -12.291   0.078  14.227
  807   1HZ   LYS 104          1HZ       LYS 104 -14.501   0.208  13.608
  808   2HZ   LYS 104          2HZ       LYS 104 -14.234  -0.378  12.097
  809   3HZ   LYS 104          3HZ       LYS 104 -13.668   1.108  12.498
  810    H    TYR 105           H        TYR 105 -11.408   0.581   8.342
  811    HA   TYR 105           HA       TYR 105 -10.844   2.867  10.056
  812   1HB   TYR 105          1HB       TYR 105  -9.864   2.206   7.252
  813   2HB   TYR 105          2HB       TYR 105  -9.188   3.427   8.316
  814    HD1  TYR 105           HD1      TYR 105  -7.683   1.164   6.959
  815    HD2  TYR 105           HD2      TYR 105  -9.357   1.554  10.919
  816    HE1  TYR 105           HE1      TYR 105  -5.918  -0.308   7.869
  817    HE2  TYR 105           HE2      TYR 105  -7.690  -0.027  11.780
  818    HH   TYR 105           HH       TYR 105  -4.988  -1.285   9.818
  819    H    LEU 106           H        LEU 106 -12.586   2.514   6.961
  820    HA   LEU 106           HA       LEU 106 -12.960   5.453   6.764
  821   1HB   LEU 106          2HB       LEU 106 -13.803   3.167   4.940
  822   2HB   LEU 106          1HB       LEU 106 -14.031   4.892   4.612
  823    HG   LEU 106           HG       LEU 106 -11.361   3.442   4.908
  824   1HD1  LEU 106          1HD2      LEU 106 -11.962   6.353   4.230
  825   2HD1  LEU 106          2HD2      LEU 106 -11.054   5.748   5.637
  826   3HD1  LEU 106          3HD2      LEU 106 -10.385   5.566   4.015
  827   1HD2  LEU 106          1HD1      LEU 106 -11.137   3.745   2.531
  828   2HD2  LEU 106          2HD1      LEU 106 -12.654   4.654   2.425
  829   3HD2  LEU 106          3HD1      LEU 106 -12.671   2.924   2.821
  830    H    ASN 107           H        ASN 107 -15.376   2.893   6.135
  831    HA   ASN 107           HA       ASN 107 -17.108   3.466   8.243
  832   1HB   ASN 107          1HB       ASN 107 -17.410   5.561   6.711
  833   2HB   ASN 107          2HB       ASN 107 -18.096   4.448   5.525
  834   1HD2  ASN 107          2HD2      ASN 107 -19.570   2.744   7.426
  835   2HD2  ASN 107          1HD2      ASN 107 -20.868   3.761   8.067
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1   0.608  -2.840 -11.860
    2   2H    MET   1          2H        MET   1  -0.802  -3.313 -11.085
    3   3H    MET   1          3H        MET   1  -0.367  -1.753 -11.041
    4    HA   MET   1           HA       MET   1  -0.809  -1.395 -13.284
    5   1HB   MET   1          2HB       MET   1  -1.759  -3.200 -14.680
    6   2HB   MET   1          1HB       MET   1  -0.078  -3.509 -14.234
    7   1HG   MET   1          2HG       MET   1  -0.798  -5.128 -12.528
    8   2HG   MET   1          1HG       MET   1  -2.502  -4.790 -12.903
    9   1HE   MET   1          1HE       MET   1  -2.133  -8.413 -14.146
   10   2HE   MET   1          2HE       MET   1  -1.323  -7.703 -12.730
   11   3HE   MET   1          3HE       MET   1  -3.018  -7.286 -13.091
   12    H    GLU   2           HN       GLU   2  -2.963  -0.585 -13.617
   13    HA   GLU   2           HA       GLU   2  -5.047   0.059 -12.969
   14   1HB   GLU   2          1HB       GLU   2  -5.321  -2.433 -11.227
   15   2HB   GLU   2          2HB       GLU   2  -6.584  -1.358 -11.797
   16   1HG   GLU   2          1HG       GLU   2  -6.319  -2.121 -14.077
   17   2HG   GLU   2          2HG       GLU   2  -4.867  -3.048 -13.671
   18    H    ALA   3           H        ALA   3  -3.730  -1.643 -10.150
   19    HA   ALA   3           HA       ALA   3  -3.633   0.739  -8.434
   20   1HB   ALA   3          1HB       ALA   3  -2.400  -0.771  -6.920
   21   2HB   ALA   3          2HB       ALA   3  -2.273  -1.986  -8.194
   22   3HB   ALA   3          3HB       ALA   3  -3.869  -1.585  -7.511
   23    H    GLY   4           H        GLY   4  -1.632   1.936  -8.084
   24   1HA   GLY   4          1HA       GLY   4   0.147   1.899 -10.432
   25   2HA   GLY   4          2HA       GLY   4   0.214   2.991  -9.046
   26    H    ALA   5           H        ALA   5   2.572   2.444  -9.555
   27    HA   ALA   5           HA       ALA   5   3.515   0.462  -7.593
   28   1HB   ALA   5          1HB       ALA   5   4.684   0.882 -10.388
   29   2HB   ALA   5          2HB       ALA   5   5.432  -0.058  -9.078
   30   3HB   ALA   5          3HB       ALA   5   3.901  -0.602  -9.797
   31    H    VAL   6           H        VAL   6   5.154   1.516  -6.340
   32    HA   VAL   6           HA       VAL   6   5.888   4.280  -7.188
   33    HB   VAL   6           HB       VAL   6   5.536   5.115  -4.930
   34   1HG1  VAL   6          1HG2      VAL   6   4.333   3.867  -3.217
   35   2HG1  VAL   6          2HG2      VAL   6   5.809   3.007  -3.684
   36   3HG1  VAL   6          3HG2      VAL   6   4.227   2.442  -4.267
   37   1HG2  VAL   6          1HG1      VAL   6   3.087   5.147  -4.859
   38   2HG2  VAL   6          2HG1      VAL   6   3.656   5.306  -6.540
   39   3HG2  VAL   6          3HG1      VAL   6   3.040   3.750  -5.945
   40    H    ASN   7           H        ASN   7   7.627   5.120  -5.818
   41    HA   ASN   7           HA       ASN   7   9.522   3.135  -4.763
   42   1HB   ASN   7          1HB       ASN   7   9.998   5.070  -7.088
   43   2HB   ASN   7          2HB       ASN   7  11.334   4.471  -6.122
   44   1HD2  ASN   7          1HD2      ASN   7  11.394   2.031  -5.793
   45   2HD2  ASN   7          2HD2      ASN   7  11.146   1.083  -7.281
   46    H    ASP   8           HN       ASP   8  11.431   4.601  -3.893
   47    HA   ASP   8           HA       ASP   8  10.433   6.071  -1.751
   48   1HB   ASP   8          1HB       ASP   8  12.699   6.834  -1.389
   49   2HB   ASP   8          2HB       ASP   8  12.733   5.167  -2.005
   50    H    ASP   9           HN       ASP   9  11.688   7.357  -4.730
   51    HA   ASP   9           HA       ASP   9  11.116  10.111  -4.318
   52   1HB   ASP   9          1HB       ASP   9  12.506   9.377  -6.161
   53   2HB   ASP   9          2HB       ASP   9  11.193   8.474  -6.901
   54    H    THR  10           H        THR  10   9.212   8.053  -6.533
   55    HA   THR  10           HA       THR  10   7.062   9.789  -6.838
   56    HB   THR  10           HB       THR  10   5.846   7.650  -7.585
   57    HG1  THR  10           HG1      THR  10   7.433   5.907  -7.841
   58   1HG2  THR  10          1HG2      THR  10   8.632   8.219  -8.718
   59   2HG2  THR  10          2HG2      THR  10   7.152   9.111  -9.118
   60   3HG2  THR  10          3HG2      THR  10   7.302   7.403  -9.564
   61    H    PHE  11           H        PHE  11   7.533   7.405  -4.274
   62    HA   PHE  11           HA       PHE  11   5.123   7.130  -3.021
   63   1HB   PHE  11          1HB       PHE  11   7.292   6.307  -2.166
   64   2HB   PHE  11          2HB       PHE  11   7.773   7.927  -1.752
   65    HD1  PHE  11           HD1      PHE  11   5.226   5.302  -0.951
   66    HD2  PHE  11           HD2      PHE  11   7.247   8.877   0.362
   67    HE1  PHE  11           HE1      PHE  11   4.433   4.902   1.360
   68    HE2  PHE  11           HE2      PHE  11   6.409   8.499   2.657
   69    HZ   PHE  11           HZ       PHE  11   5.045   6.484   3.170
   70    H    LYS  12           HN       LYS  12   7.301   9.873  -2.862
   71    HA   LYS  12           HA       LYS  12   5.799  11.504  -1.061
   72   1HB   LYS  12          1HB       LYS  12   7.601  12.393  -3.366
   73   2HB   LYS  12          2HB       LYS  12   6.908  13.396  -2.105
   74   1HG   LYS  12          2HG       LYS  12   8.083  11.529  -0.497
   75   2HG   LYS  12          1HG       LYS  12   9.025  11.215  -1.952
   76   1HD   LYS  12          1HD       LYS  12  10.325  12.765  -0.748
   77   2HD   LYS  12          2HD       LYS  12   9.526  13.756  -1.982
   78   1HE   LYS  12          1HE       LYS  12   7.769  14.368  -0.239
   79   2HE   LYS  12          2HE       LYS  12   8.672  13.416   0.947
   80   1HZ   LYS  12          1HZ       LYS  12   9.688  15.763  -0.494
   81   2HZ   LYS  12          2HZ       LYS  12  10.529  14.878   0.615
   82   3HZ   LYS  12          3HZ       LYS  12   9.194  15.725   1.077
   83    H    ASN  13           H        ASN  13   5.839  11.724  -4.647
   84    HA   ASN  13           HA       ASN  13   3.766  13.689  -4.807
   85   1HB   ASN  13          1HB       ASN  13   4.622  11.643  -6.880
   86   2HB   ASN  13          2HB       ASN  13   3.790  13.171  -7.171
   87   1HD2  ASN  13          2HD2      ASN  13   5.568  14.702  -5.152
   88   2HD2  ASN  13          1HD2      ASN  13   7.060  14.864  -6.058
   89    H    VAL  14           H        VAL  14   3.720  10.224  -4.665
   90    HA   VAL  14           HA       VAL  14   0.904  10.085  -5.656
   91    HB   VAL  14           HB       VAL  14   2.990   7.948  -5.058
   92   1HG1  VAL  14          1HG1      VAL  14   3.095   7.748  -7.519
   93   2HG1  VAL  14          2HG1      VAL  14   3.504   9.398  -7.050
   94   3HG1  VAL  14          3HG1      VAL  14   1.895   9.042  -7.694
   95   1HG2  VAL  14          1HG2      VAL  14   0.808   6.900  -4.821
   96   2HG2  VAL  14          2HG2      VAL  14   0.220   7.703  -6.300
   97   3HG2  VAL  14          3HG2      VAL  14   1.482   6.468  -6.400
   98    H    VAL  15           H        VAL  15   2.755   9.129  -2.757
   99    HA   VAL  15           HA       VAL  15   0.286   8.303  -1.375
  100    HB   VAL  15           HB       VAL  15   3.167   8.043  -0.425
  101   1HG1  VAL  15          1HG1      VAL  15   1.425   7.858   1.299
  102   2HG1  VAL  15          2HG1      VAL  15   0.654   6.553   0.366
  103   3HG1  VAL  15          3HG1      VAL  15   2.294   6.356   1.023
  104   1HG2  VAL  15          1HG2      VAL  15   2.980   5.686  -1.251
  105   2HG2  VAL  15          2HG2      VAL  15   1.476   6.121  -2.081
  106   3HG2  VAL  15          3HG2      VAL  15   3.005   6.863  -2.567
  107    H    LEU  16           H        LEU  16   3.130  10.494  -0.766
  108    HA   LEU  16           HA       LEU  16   1.861  11.474   1.669
  109   1HB   LEU  16          1HB       LEU  16   4.108  12.773   0.079
  110   2HB   LEU  16          2HB       LEU  16   3.583  13.195   1.700
  111    HG   LEU  16           HG       LEU  16   4.808  10.521   0.889
  112   1HD1  LEU  16          1HD2      LEU  16   5.899  12.781   2.625
  113   2HD1  LEU  16          2HD2      LEU  16   6.743  11.287   2.163
  114   3HD1  LEU  16          3HD2      LEU  16   6.357  12.509   0.936
  115   1HD2  LEU  16          1HD1      LEU  16   3.294  10.122   2.754
  116   2HD2  LEU  16          2HD1      LEU  16   4.940  10.185   3.391
  117   3HD2  LEU  16          3HD1      LEU  16   3.874  11.585   3.591
  118    H    GLU  17           HN       GLU  17   2.394  13.071  -1.523
  119    HA   GLU  17           HA       GLU  17   0.592  15.262  -0.862
  120   1HB   GLU  17          2HB       GLU  17   1.945  14.425  -3.459
  121   2HB   GLU  17          1HB       GLU  17   1.189  15.984  -3.143
  122   1HG   GLU  17          2HG       GLU  17   2.853  16.510  -1.422
  123   2HG   GLU  17          1HG       GLU  17   3.609  14.923  -1.596
  124    H    SER  18           H        SER  18  -0.952  13.078  -0.473
  125    HA   SER  18           HA       SER  18  -2.377  12.311  -2.929
  126   1HB   SER  18          1HB       SER  18  -3.536  10.819  -1.208
  127   2HB   SER  18          2HB       SER  18  -1.817  10.537  -1.529
  128    HG   SER  18           HG       SER  18  -1.330  11.089   0.427
  129    H    SER  19           H        SER  19  -4.523  12.713  -3.331
  130    HA   SER  19           HA       SER  19  -5.903  14.858  -1.841
  131   1HB   SER  19          1HB       SER  19  -7.456  14.518  -3.876
  132   2HB   SER  19          2HB       SER  19  -5.827  15.142  -4.213
  133    HG   SER  19           HG       SER  19  -6.307  13.406  -5.615
  134    H    VAL  20           H        VAL  20  -6.702  11.807  -3.395
  135    HA   VAL  20           HA       VAL  20  -8.788  11.064  -1.472
  136    HB   VAL  20           HB       VAL  20  -8.640   8.840  -2.794
  137   1HG1  VAL  20          1HG1      VAL  20  -7.023  10.445  -4.803
  138   2HG1  VAL  20          2HG1      VAL  20  -7.520   8.750  -4.876
  139   3HG1  VAL  20          3HG1      VAL  20  -6.305   9.254  -3.696
  140   1HG2  VAL  20          1HG2      VAL  20 -10.443  10.263  -3.275
  141   2HG2  VAL  20          2HG2      VAL  20  -9.709   9.830  -4.828
  142   3HG2  VAL  20          3HG2      VAL  20  -9.408  11.431  -4.147
  143    HA   PRO  21           HA       PRO  21  -6.229   8.541   1.226
  144   1HB   PRO  21          2HB       PRO  21  -8.255   6.388   0.575
  145   2HB   PRO  21          1HB       PRO  21  -7.481   6.719   2.149
  146   1HG   PRO  21          1HG       PRO  21  -9.943   7.602   1.635
  147   2HG   PRO  21          2HG       PRO  21  -8.793   8.800   2.309
  148   1HD   PRO  21          1HD       PRO  21  -9.603   8.417  -0.603
  149   2HD   PRO  21          2HD       PRO  21  -9.444   9.935   0.334
  150    H    VAL  22           H        VAL  22  -4.923   6.610   1.145
  151    HA   VAL  22           HA       VAL  22  -4.421   5.430  -1.528
  152    HB   VAL  22           HB       VAL  22  -2.328   6.556   0.372
  153   1HG1  VAL  22          1HG2      VAL  22  -1.563   4.752  -1.119
  154   2HG1  VAL  22          2HG2      VAL  22  -2.154   5.652  -2.516
  155   3HG1  VAL  22          3HG2      VAL  22  -0.847   6.316  -1.556
  156   1HG2  VAL  22          1HG1      VAL  22  -3.470   8.506  -0.388
  157   2HG2  VAL  22          2HG1      VAL  22  -2.009   8.344  -1.365
  158   3HG2  VAL  22          3HG1      VAL  22  -3.577   7.899  -2.054
  159    H    LEU  23           H        LEU  23  -3.556   3.369  -1.470
  160    HA   LEU  23           HA       LEU  23  -3.048   2.023   1.149
  161   1HB   LEU  23          2HB       LEU  23  -5.228   1.411   0.161
  162   2HB   LEU  23          1HB       LEU  23  -4.465   0.854  -1.303
  163    HG   LEU  23           HG       LEU  23  -3.729  -0.299   1.425
  164   1HD1  LEU  23          1HD2      LEU  23  -3.242  -2.348  -0.011
  165   2HD1  LEU  23          2HD2      LEU  23  -2.161  -0.998  -0.327
  166   3HD1  LEU  23          3HD2      LEU  23  -3.500  -1.342  -1.443
  167   1HD2  LEU  23          1HD1      LEU  23  -5.362  -2.108   0.928
  168   2HD2  LEU  23          2HD1      LEU  23  -6.135  -0.546   1.203
  169   3HD2  LEU  23          3HD1      LEU  23  -5.959  -1.171  -0.457
  170    H    VAL  24           H        VAL  24  -0.779   1.965   1.004
  171    HA   VAL  24           HA       VAL  24   0.463   1.241  -1.653
  172    HB   VAL  24           HB       VAL  24   1.304   3.279  -1.297
  173   1HG1  VAL  24          1HG2      VAL  24   0.329   3.958   0.724
  174   2HG1  VAL  24          2HG2      VAL  24   2.082   4.133   0.926
  175   3HG1  VAL  24          3HG2      VAL  24   1.243   2.753   1.662
  176   1HG2  VAL  24          1HG1      VAL  24   3.605   3.085  -0.631
  177   2HG2  VAL  24          2HG1      VAL  24   3.287   1.613   0.295
  178   3HG2  VAL  24          3HG1      VAL  24   3.129   1.601  -1.477
  179    H    ASP  25           HN       ASP  25   1.018  -0.837  -1.702
  180    HA   ASP  25           HA       ASP  25   1.445  -2.360   0.802
  181   1HB   ASP  25          1HB       ASP  25   0.045  -3.406  -0.891
  182   2HB   ASP  25          2HB       ASP  25   1.311  -3.194  -2.098
  183    H    PHE  26           H        PHE  26   3.497  -2.382   1.673
  184    HA   PHE  26           HA       PHE  26   5.810  -1.759  -0.059
  185   1HB   PHE  26          1HB       PHE  26   5.509  -2.442   2.869
  186   2HB   PHE  26          2HB       PHE  26   7.059  -2.358   2.060
  187    HD1  PHE  26           HD1      PHE  26   8.207  -0.328   1.879
  188    HD2  PHE  26           HD2      PHE  26   3.943  -0.236   2.571
  189    HE1  PHE  26           HE1      PHE  26   8.300   2.121   2.178
  190    HE2  PHE  26           HE2      PHE  26   4.044   2.218   2.784
  191    HZ   PHE  26           HZ       PHE  26   6.220   3.399   2.692
  192    H    TRP  27           H        TRP  27   6.401  -3.351  -1.431
  193    HA   TRP  27           HA       TRP  27   6.079  -6.217  -0.619
  194   1HB   TRP  27          2HB       TRP  27   5.386  -6.749  -2.835
  195   2HB   TRP  27          1HB       TRP  27   4.394  -5.409  -2.307
  196    HD1  TRP  27           HD1      TRP  27   5.278  -2.946  -3.283
  197    HE1  TRP  27           HE1      TRP  27   6.396  -2.309  -5.540
  198    HE3  TRP  27           HE3      TRP  27   6.636  -7.633  -4.914
  199    HZ2  TRP  27           HZ2      TRP  27   7.652  -3.637  -7.699
  200    HZ3  TRP  27           HZ3      TRP  27   7.695  -7.888  -7.116
  201    HH2  TRP  27           HH2      TRP  27   8.247  -5.916  -8.505
  202    H    ALA  28           H        ALA  28   7.285  -7.451  -2.667
  203    HA   ALA  28           HA       ALA  28   9.547  -6.270  -3.812
  204   1HB   ALA  28          1HB       ALA  28  10.572  -6.475  -1.515
  205   2HB   ALA  28          2HB       ALA  28  10.183  -8.213  -1.538
  206   3HB   ALA  28          3HB       ALA  28  11.339  -7.535  -2.701
  207    HA   PRO  29           HA       PRO  29   8.494  -9.810  -6.268
  208   1HB   PRO  29          1HB       PRO  29  11.349 -10.359  -6.937
  209   2HB   PRO  29          2HB       PRO  29   9.954  -9.963  -7.996
  210   1HG   PRO  29          2HG       PRO  29  11.968  -8.136  -7.449
  211   2HG   PRO  29          1HG       PRO  29  10.271  -7.680  -7.758
  212   1HD   PRO  29          1HD       PRO  29  11.666  -7.872  -5.084
  213   2HD   PRO  29          2HD       PRO  29  10.456  -6.722  -5.673
  214    H    TRP  30           H        TRP  30  11.355 -10.267  -4.178
  215    HA   TRP  30           HA       TRP  30  11.080 -13.114  -3.920
  216   1HB   TRP  30          1HB       TRP  30  12.571 -12.746  -1.930
  217   2HB   TRP  30          2HB       TRP  30  13.173 -12.189  -3.481
  218    HD1  TRP  30           HD1      TRP  30  13.948  -9.760  -3.681
  219    HE1  TRP  30           HE1      TRP  30  14.214  -7.790  -2.055
  220    HE3  TRP  30           HE3      TRP  30  11.174 -11.569   0.233
  221    HZ2  TRP  30           HZ2      TRP  30  13.148  -7.005   0.508
  222    HZ3  TRP  30           HZ3      TRP  30  10.767 -10.159   2.221
  223    HH2  TRP  30           HH2      TRP  30  11.602  -7.832   2.300
  224    H    CYS  31           H        CYS  31   9.108 -10.544  -2.646
  225    HA   CYS  31           HA       CYS  31   8.454 -11.869  -0.125
  226   1HB   CYS  31          1HB       CYS  31   8.292  -9.400  -0.454
  227   2HB   CYS  31          2HB       CYS  31   7.023  -9.667  -1.619
  228    H    GLY  32           H        GLY  32   7.952 -13.993  -1.031
  229   1HA   GLY  32          1HA       GLY  32   6.125 -14.905  -2.744
  230   2HA   GLY  32          2HA       GLY  32   6.210 -15.584  -1.118
  231    HA   PRO  33           HA       PRO  33   2.180 -14.184   0.088
  232   1HB   PRO  33          2HB       PRO  33   3.295 -11.879   1.660
  233   2HB   PRO  33          1HB       PRO  33   2.020 -13.028   2.123
  234   1HG   PRO  33          2HG       PRO  33   4.581 -13.296   3.052
  235   2HG   PRO  33          1HG       PRO  33   3.648 -14.729   2.551
  236   1HD   PRO  33          1HD       PRO  33   5.792 -13.216   1.042
  237   2HD   PRO  33          2HD       PRO  33   5.506 -14.978   1.099
  238    H    CYS  34           H        CYS  34   4.253 -11.340  -0.489
  239    HA   CYS  34           HA       CYS  34   2.236  -9.470  -1.219
  240   1HB   CYS  34          1HB       CYS  34   4.965  -9.398  -2.358
  241   2HB   CYS  34          2HB       CYS  34   3.813  -8.136  -2.044
  242    H    ARG  35           HN       ARG  35   4.366 -11.700  -3.019
  243    HA   ARG  35           HA       ARG  35   3.719 -11.004  -5.661
  244   1HB   ARG  35          2HB       ARG  35   5.536 -12.581  -4.654
  245   2HB   ARG  35          1HB       ARG  35   4.317 -13.848  -4.774
  246   1HG   ARG  35          1HG       ARG  35   4.073 -13.268  -7.242
  247   2HG   ARG  35          2HG       ARG  35   5.477 -12.199  -7.050
  248   1HD   ARG  35          1HD       ARG  35   5.343 -15.193  -6.554
  249   2HD   ARG  35          2HD       ARG  35   6.207 -14.393  -7.875
  250    HE   ARG  35           HE       ARG  35   7.537 -13.229  -5.978
  251   1HH1  ARG  35          1HH2      ARG  35   6.513 -16.635  -5.817
  252   2HH1  ARG  35          2HH2      ARG  35   7.661 -17.022  -4.567
  253   1HH2  ARG  35          1HH1      ARG  35   8.950 -13.720  -4.455
  254   2HH2  ARG  35          2HH1      ARG  35   9.100 -15.312  -3.733
  255    H    ILE  36           H        ILE  36   2.295 -13.552  -3.562
  256    HA   ILE  36           HA       ILE  36   0.368 -14.281  -5.602
  257    HB   ILE  36           HB       ILE  36  -0.737 -15.626  -3.910
  258   1HG1  ILE  36          1HG1      ILE  36   1.325 -14.652  -1.917
  259   2HG1  ILE  36          2HG1      ILE  36  -0.337 -14.023  -1.961
  260   1HG2  ILE  36          1HG2      ILE  36   1.311 -16.380  -5.145
  261   2HG2  ILE  36          2HG2      ILE  36   2.317 -15.838  -3.792
  262   3HG2  ILE  36          3HG2      ILE  36   1.155 -17.157  -3.566
  263   1HD1  ILE  36          1HD1      ILE  36  -1.227 -16.266  -1.603
  264   2HD1  ILE  36          2HD1      ILE  36  -0.200 -15.681  -0.276
  265   3HD1  ILE  36          3HD1      ILE  36   0.439 -16.885  -1.416
  266    H    ILE  37           H        ILE  37   0.068 -12.021  -2.777
  267    HA   ILE  37           HA       ILE  37  -2.716 -11.518  -3.516
  268    HB   ILE  37           HB       ILE  37  -2.751  -9.739  -1.933
  269   1HG1  ILE  37          1HG1      ILE  37   0.235 -10.109  -1.657
  270   2HG1  ILE  37          2HG1      ILE  37  -0.560  -8.699  -2.351
  271   1HG2  ILE  37          1HG2      ILE  37  -2.852 -12.165  -1.228
  272   2HG2  ILE  37          2HG2      ILE  37  -2.367 -11.050   0.050
  273   3HG2  ILE  37          3HG2      ILE  37  -1.146 -12.050  -0.756
  274   1HD1  ILE  37          1HD1      ILE  37  -1.680  -8.295  -0.141
  275   2HD1  ILE  37          2HD1      ILE  37   0.088  -8.140  -0.121
  276   3HD1  ILE  37          3HD1      ILE  37  -0.671  -9.589   0.552
  277    H    ALA  38           H        ALA  38   0.338 -10.039  -4.589
  278    HA   ALA  38           HA       ALA  38  -0.245  -7.634  -5.473
  279   1HB   ALA  38          1HB       ALA  38   1.234  -7.964  -7.405
  280   2HB   ALA  38          2HB       ALA  38   1.878  -8.738  -5.954
  281   3HB   ALA  38          3HB       ALA  38   1.128  -9.717  -7.229
  282    HA   PRO  39           HA       PRO  39  -2.650  -8.798  -9.511
  283   1HB   PRO  39          2HB       PRO  39  -4.059 -11.320  -8.758
  284   2HB   PRO  39          1HB       PRO  39  -3.291 -10.888 -10.308
  285   1HG   PRO  39          1HG       PRO  39  -2.134 -12.702  -8.621
  286   2HG   PRO  39          2HG       PRO  39  -1.130 -11.494  -9.484
  287   1HD   PRO  39          1HD       PRO  39  -2.269 -11.271  -6.677
  288   2HD   PRO  39          2HD       PRO  39  -0.563 -11.125  -7.179
  289    H    VAL  40           H        VAL  40  -3.756  -9.839  -6.320
  290    HA   VAL  40           HA       VAL  40  -6.522  -9.067  -6.589
  291    HB   VAL  40           HB       VAL  40  -5.018  -9.402  -3.977
  292   1HG1  VAL  40          1HG1      VAL  40  -7.186 -10.111  -3.195
  293   2HG1  VAL  40          2HG1      VAL  40  -7.861 -10.040  -4.836
  294   3HG1  VAL  40          3HG1      VAL  40  -7.360  -8.542  -4.025
  295   1HG2  VAL  40          1HG2      VAL  40  -6.159 -11.591  -5.782
  296   2HG2  VAL  40          2HG2      VAL  40  -4.463 -11.440  -5.281
  297   3HG2  VAL  40          3HG2      VAL  40  -5.700 -11.811  -4.082
  298    H    VAL  41           H        VAL  41  -3.520  -7.713  -5.166
  299    HA   VAL  41           HA       VAL  41  -4.556  -5.214  -4.272
  300    HB   VAL  41           HB       VAL  41  -1.761  -5.767  -5.373
  301   1HG1  VAL  41          1HG1      VAL  41  -2.331  -7.328  -3.487
  302   2HG1  VAL  41          2HG1      VAL  41  -1.069  -6.178  -3.069
  303   3HG1  VAL  41          3HG1      VAL  41  -2.728  -5.930  -2.485
  304   1HG2  VAL  41          1HG2      VAL  41  -2.193  -3.356  -5.140
  305   2HG2  VAL  41          2HG2      VAL  41  -1.073  -3.902  -3.892
  306   3HG2  VAL  41          3HG2      VAL  41  -2.765  -3.610  -3.474
  307    H    ASP  42           HN       ASP  42  -3.286  -6.227  -7.485
  308    HA   ASP  42           HA       ASP  42  -3.537  -3.717  -8.783
  309   1HB   ASP  42          1HB       ASP  42  -3.813  -6.534  -9.919
  310   2HB   ASP  42          2HB       ASP  42  -3.801  -5.080 -10.881
  311    H    GLU  43           HN       GLU  43  -5.943  -6.450  -9.034
  312    HA   GLU  43           HA       GLU  43  -7.856  -4.828 -10.324
  313   1HB   GLU  43          1HB       GLU  43  -9.427  -6.582  -9.863
  314   2HB   GLU  43          2HB       GLU  43  -7.876  -7.265 -10.372
  315   1HG   GLU  43          1HG       GLU  43  -7.332  -7.726  -8.017
  316   2HG   GLU  43          2HG       GLU  43  -8.873  -7.065  -7.464
  317    H    ILE  44           H        ILE  44  -7.274  -5.207  -6.809
  318    HA   ILE  44           HA       ILE  44  -9.649  -4.132  -5.841
  319    HB   ILE  44           HB       ILE  44  -6.781  -4.085  -4.955
  320   1HG1  ILE  44          1HG1      ILE  44  -8.457  -6.028  -4.671
  321   2HG1  ILE  44          2HG1      ILE  44  -7.526  -5.459  -3.280
  322   1HG2  ILE  44          1HG2      ILE  44  -7.428  -1.892  -4.230
  323   2HG2  ILE  44          2HG2      ILE  44  -8.991  -2.516  -3.640
  324   3HG2  ILE  44          3HG2      ILE  44  -7.470  -2.982  -2.834
  325   1HD1  ILE  44          1HD1      ILE  44  -9.431  -4.402  -2.287
  326   2HD1  ILE  44          2HD1      ILE  44  -9.934  -6.016  -2.798
  327   3HD1  ILE  44          3HD1      ILE  44 -10.401  -4.603  -3.758
  328    H    ALA  45           H        ALA  45  -7.038  -2.388  -7.587
  329    HA   ALA  45           HA       ALA  45  -7.925   0.258  -6.949
  330   1HB   ALA  45          1HB       ALA  45  -6.722  -0.800  -9.536
  331   2HB   ALA  45          2HB       ALA  45  -5.802  -0.304  -8.104
  332   3HB   ALA  45          3HB       ALA  45  -6.752   0.896  -9.006
  333    H    GLY  46           H        GLY  46  -9.167  -2.191  -9.222
  334   1HA   GLY  46          2HA       GLY  46 -10.895  -0.371 -10.719
  335   2HA   GLY  46          1HA       GLY  46 -10.823  -2.143 -10.808
  336    H    GLU  47           HN       GLU  47 -10.972  -2.295  -7.755
  337    HA   GLU  47           HA       GLU  47 -13.890  -2.257  -7.514
  338   1HB   GLU  47          2HB       GLU  47 -11.813  -2.725  -5.332
  339   2HB   GLU  47          1HB       GLU  47 -13.547  -3.024  -5.296
  340   1HG   GLU  47          2HG       GLU  47 -13.195  -4.627  -7.274
  341   2HG   GLU  47          1HG       GLU  47 -11.476  -4.436  -7.047
  342    H    TYR  48           H        TYR  48 -11.158  -0.541  -6.001
  343    HA   TYR  48           HA       TYR  48 -12.974   1.360  -4.721
  344   1HB   TYR  48          1HB       TYR  48  -9.921   1.172  -4.660
  345   2HB   TYR  48          2HB       TYR  48 -10.853   2.427  -3.898
  346    HD1  TYR  48           HD1      TYR  48 -12.935   1.667  -2.402
  347    HD2  TYR  48           HD2      TYR  48  -9.210  -0.306  -3.011
  348    HE1  TYR  48           HE1      TYR  48 -13.574   0.005  -0.665
  349    HE2  TYR  48           HE2      TYR  48  -9.798  -2.000  -1.232
  350    HH   TYR  48           HH       TYR  48 -13.005  -2.014   0.343
  351    H    LYS  49           HN       LYS  49 -13.737   1.686  -6.952
  352    HA   LYS  49           HA       LYS  49 -12.706   3.987  -8.436
  353   1HB   LYS  49          1HB       LYS  49 -15.482   2.748  -8.164
  354   2HB   LYS  49          2HB       LYS  49 -15.082   4.064  -9.285
  355   1HG   LYS  49          1HG       LYS  49 -13.495   2.668 -10.481
  356   2HG   LYS  49          2HG       LYS  49 -13.663   1.366  -9.316
  357   1HD   LYS  49          2HD       LYS  49 -15.831   2.372 -11.215
  358   2HD   LYS  49          1HD       LYS  49 -14.892   0.881 -11.373
  359   1HE   LYS  49          2HE       LYS  49 -17.003   1.502  -9.258
  360   2HE   LYS  49          1HE       LYS  49 -17.047   0.284 -10.534
  361   1HZ   LYS  49          1HZ       LYS  49 -15.294   0.287  -8.178
  362   2HZ   LYS  49          2HZ       LYS  49 -16.503  -0.768  -8.532
  363   3HZ   LYS  49          3HZ       LYS  49 -15.118  -0.750  -9.435
  364    H    ASP  50           HN       ASP  50 -14.822   3.079  -5.760
  365    HA   ASP  50           HA       ASP  50 -15.312   5.736  -4.694
  366   1HB   ASP  50          1HB       ASP  50 -15.024   3.301  -3.065
  367   2HB   ASP  50          2HB       ASP  50 -16.051   4.711  -2.792
  368    H    LYS  51           HN       LYS  51 -13.462   6.298  -4.771
  369    HA   LYS  51           HA       LYS  51 -11.234   5.531  -5.126
  370   1HB   LYS  51          1HB       LYS  51 -11.575   7.949  -3.543
  371   2HB   LYS  51          2HB       LYS  51 -10.021   7.586  -4.306
  372   1HG   LYS  51          1HG       LYS  51 -12.580   7.744  -6.003
  373   2HG   LYS  51          2HG       LYS  51 -11.766   9.211  -5.540
  374   1HD   LYS  51          1HD       LYS  51 -11.113   8.512  -7.771
  375   2HD   LYS  51          2HD       LYS  51  -9.713   8.555  -6.696
  376   1HE   LYS  51          1HE       LYS  51  -9.663   6.128  -6.545
  377   2HE   LYS  51          2HE       LYS  51 -11.206   5.998  -7.425
  378   1HZ   LYS  51          1HZ       LYS  51  -8.696   7.059  -8.500
  379   2HZ   LYS  51          2HZ       LYS  51 -10.121   6.931  -9.320
  380   3HZ   LYS  51          3HZ       LYS  51  -9.340   5.574  -8.808
  381    H    LEU  52           H        LEU  52 -10.138   4.351  -4.317
  382    HA   LEU  52           HA       LEU  52  -8.423   5.116  -1.985
  383   1HB   LEU  52          1HB       LEU  52  -9.832   3.017  -1.511
  384   2HB   LEU  52          2HB       LEU  52  -8.868   2.187  -2.761
  385    HG   LEU  52           HG       LEU  52  -6.834   2.454  -1.463
  386   1HD1  LEU  52          1HD1      LEU  52  -7.162   3.500   0.897
  387   2HD1  LEU  52          2HD1      LEU  52  -7.062   4.582  -0.490
  388   3HD1  LEU  52          3HD1      LEU  52  -8.658   4.190   0.209
  389   1HD2  LEU  52          1HD2      LEU  52  -7.527   1.203   0.615
  390   2HD2  LEU  52          2HD2      LEU  52  -8.175   0.512  -0.874
  391   3HD2  LEU  52          3HD2      LEU  52  -9.221   1.485   0.188
  392    H    LYS  53           HN       LYS  53  -6.195   5.562  -2.617
  393    HA   LYS  53           HA       LYS  53  -5.676   4.944  -5.442
  394   1HB   LYS  53          2HB       LYS  53  -5.186   7.132  -3.933
  395   2HB   LYS  53          1HB       LYS  53  -3.684   6.302  -3.681
  396   1HG   LYS  53          2HG       LYS  53  -4.840   6.934  -6.414
  397   2HG   LYS  53          1HG       LYS  53  -3.569   7.839  -5.578
  398   1HD   LYS  53          2HD       LYS  53  -2.108   5.834  -5.567
  399   2HD   LYS  53          1HD       LYS  53  -3.345   4.911  -6.447
  400   1HE   LYS  53          1HE       LYS  53  -3.220   6.504  -8.335
  401   2HE   LYS  53          2HE       LYS  53  -1.991   7.446  -7.470
  402   1HZ   LYS  53          1HZ       LYS  53  -1.720   4.647  -8.315
  403   2HZ   LYS  53          2HZ       LYS  53  -1.025   5.950  -9.046
  404   3HZ   LYS  53          3HZ       LYS  53  -0.575   5.527  -7.519
  405    H    CYS  54           H        CYS  54  -5.477   2.701  -5.435
  406    HA   CYS  54           HA       CYS  54  -3.867   1.337  -3.457
  407   1HB   CYS  54          1HB       CYS  54  -5.839   0.340  -4.609
  408   2HB   CYS  54          2HB       CYS  54  -4.881   0.290  -6.112
  409    HG   CYS  54           HG       CYS  54  -4.799  -2.050  -5.154
  410    H    VAL  55           H        VAL  55  -1.686   0.881  -3.498
  411    HA   VAL  55           HA       VAL  55  -0.190   0.954  -6.017
  412    HB   VAL  55           HB       VAL  55   1.448   2.553  -4.398
  413   1HG1  VAL  55          1HG1      VAL  55   0.273   4.455  -3.653
  414   2HG1  VAL  55          2HG1      VAL  55  -1.274   3.849  -4.257
  415   3HG1  VAL  55          3HG1      VAL  55  -0.488   3.068  -2.864
  416   1HG2  VAL  55          1HG2      VAL  55  -0.469   3.283  -6.631
  417   2HG2  VAL  55          2HG2      VAL  55   1.221   2.751  -6.756
  418   3HG2  VAL  55          3HG2      VAL  55   0.836   4.323  -6.040
  419    H    LYS  56           HN       LYS  56   2.209   0.642  -5.559
  420    HA   LYS  56           HA       LYS  56   2.673  -1.314  -3.384
  421   1HB   LYS  56          1HB       LYS  56   2.312  -1.727  -6.292
  422   2HB   LYS  56          2HB       LYS  56   3.796  -2.446  -5.685
  423   1HG   LYS  56          2HG       LYS  56   2.581  -3.657  -3.940
  424   2HG   LYS  56          1HG       LYS  56   1.055  -2.892  -4.428
  425   1HD   LYS  56          2HD       LYS  56   2.725  -4.758  -6.176
  426   2HD   LYS  56          1HD       LYS  56   1.328  -5.240  -5.197
  427   1HE   LYS  56          2HE       LYS  56  -0.073  -3.544  -6.483
  428   2HE   LYS  56          1HE       LYS  56   1.310  -3.321  -7.569
  429   1HZ   LYS  56          1HZ       LYS  56   1.199  -5.682  -8.037
  430   2HZ   LYS  56          2HZ       LYS  56  -0.186  -4.891  -8.447
  431   3HZ   LYS  56          3HZ       LYS  56  -0.152  -5.826  -7.098
  432    H    LEU  57           H        LEU  57   4.513  -0.665  -2.344
  433    HA   LEU  57           HA       LEU  57   6.591   0.820  -3.910
  434   1HB   LEU  57          1HB       LEU  57   5.636   1.863  -1.789
  435   2HB   LEU  57          2HB       LEU  57   6.558   0.649  -0.892
  436    HG   LEU  57           HG       LEU  57   8.091   2.235  -2.898
  437   1HD1  LEU  57          1HD2      LEU  57   8.575   0.992  -0.148
  438   2HD1  LEU  57          2HD2      LEU  57   9.673   2.143  -0.865
  439   3HD1  LEU  57          3HD2      LEU  57   9.363   0.598  -1.677
  440   1HD2  LEU  57          1HD1      LEU  57   6.769   3.959  -1.830
  441   2HD2  LEU  57          2HD1      LEU  57   7.148   3.316  -0.215
  442   3HD2  LEU  57          3HD1      LEU  57   8.424   4.032  -1.227
  443    H    ASN  58           H        ASN  58   8.361  -0.274  -4.556
  444    HA   ASN  58           HA       ASN  58   8.941  -2.872  -3.804
  445   1HB   ASN  58          2HB       ASN  58   9.415  -1.531  -5.939
  446   2HB   ASN  58          1HB       ASN  58  10.753  -0.759  -5.081
  447   1HD2  ASN  58          1HD2      ASN  58   9.580  -3.525  -6.709
  448   2HD2  ASN  58          2HD2      ASN  58  10.817  -4.650  -6.248
  449    H    THR  59           H        THR  59   9.641  -3.418  -1.771
  450    HA   THR  59           HA       THR  59  11.312  -1.646  -0.166
  451    HB   THR  59           HB       THR  59  10.549  -4.502   0.491
  452    HG1  THR  59           HG1      THR  59   8.650  -3.616  -0.173
  453   1HG2  THR  59          1HG2      THR  59  10.372  -3.592   2.778
  454   2HG2  THR  59          2HG2      THR  59  10.733  -1.967   2.172
  455   3HG2  THR  59          3HG2      THR  59  11.978  -3.234   2.121
  456    H    ASP  60           HN       ASP  60  12.684  -2.273  -2.523
  457    HA   ASP  60           HA       ASP  60  15.099  -3.542  -1.405
  458   1HB   ASP  60          1HB       ASP  60  13.579  -5.308  -2.538
  459   2HB   ASP  60          2HB       ASP  60  13.993  -4.542  -4.067
  460    H    GLU  61           HN       GLU  61  13.501  -2.280  -4.293
  461    HA   GLU  61           HA       GLU  61  15.733  -0.637  -5.210
  462   1HB   GLU  61          2HB       GLU  61  14.159  -1.766  -6.737
  463   2HB   GLU  61          1HB       GLU  61  12.805  -0.886  -6.016
  464   1HG   GLU  61          2HG       GLU  61  13.674   1.248  -6.872
  465   2HG   GLU  61          1HG       GLU  61  15.091   0.407  -7.523
  466    H    SER  62           H        SER  62  13.052  -0.276  -2.966
  467    HA   SER  62           HA       SER  62  13.750   2.558  -2.543
  468   1HB   SER  62          2HB       SER  62  11.057   1.340  -3.265
  469   2HB   SER  62          1HB       SER  62  11.091   2.816  -2.343
  470    HG   SER  62           HG       SER  62  12.921   2.694  -4.465
  471    HA   PRO  63           HA       PRO  63  13.597   0.177   1.398
  472   1HB   PRO  63          1HB       PRO  63  16.233   0.302   2.041
  473   2HB   PRO  63          2HB       PRO  63  15.589  -0.958   0.939
  474   1HG   PRO  63          1HG       PRO  63  16.958   1.655   0.217
  475   2HG   PRO  63          2HG       PRO  63  17.276   0.026  -0.449
  476   1HD   PRO  63          2HD       PRO  63  15.653   1.775  -1.770
  477   2HD   PRO  63          1HD       PRO  63  15.256   0.064  -1.696
  478    H    ASN  64           H        ASN  64  15.059   3.126   0.217
  479    HA   ASN  64           HA       ASN  64  15.751   4.585   2.479
  480   1HB   ASN  64          1HB       ASN  64  14.303   5.573  -0.014
  481   2HB   ASN  64          2HB       ASN  64  15.071   6.623   1.187
  482   1HD2  ASN  64          2HD2      ASN  64  15.765   6.468  -1.702
  483   2HD2  ASN  64          1HD2      ASN  64  17.428   5.918  -1.705
  484    H    VAL  65           H        VAL  65  12.555   4.984   0.981
  485    HA   VAL  65           HA       VAL  65  11.354   6.224   3.217
  486    HB   VAL  65           HB       VAL  65  10.332   4.747   0.765
  487   1HG1  VAL  65          1HG2      VAL  65   8.597   4.430   2.498
  488   2HG1  VAL  65          2HG2      VAL  65   8.614   6.180   2.819
  489   3HG1  VAL  65          3HG2      VAL  65   8.092   5.550   1.237
  490   1HG2  VAL  65          1HG1      VAL  65  11.454   6.954   0.513
  491   2HG2  VAL  65          2HG1      VAL  65   9.719   7.093   0.151
  492   3HG2  VAL  65          3HG1      VAL  65  10.358   7.660   1.705
  493    H    ALA  66           H        ALA  66  11.485   2.813   2.241
  494    HA   ALA  66           HA       ALA  66   9.780   1.814   4.228
  495   1HB   ALA  66          1HB       ALA  66  10.853  -0.340   3.862
  496   2HB   ALA  66          2HB       ALA  66  10.775   0.506   2.304
  497   3HB   ALA  66          3HB       ALA  66  12.301   0.425   3.219
  498    H    SER  67           H        SER  67  13.241   2.631   4.463
  499    HA   SER  67           HA       SER  67  13.588   1.646   7.156
  500   1HB   SER  67          1HB       SER  67  15.223   3.713   5.611
  501   2HB   SER  67          2HB       SER  67  15.715   2.835   7.070
  502    HG   SER  67           HG       SER  67  15.087   1.701   4.535
  503    H    GLU  68           HN       GLU  68  12.965   4.832   5.695
  504    HA   GLU  68           HA       GLU  68  13.011   6.412   8.049
  505   1HB   GLU  68          2HB       GLU  68  11.332   6.684   5.523
  506   2HB   GLU  68          1HB       GLU  68  11.454   7.928   6.763
  507   1HG   GLU  68          1HG       GLU  68  13.761   8.317   6.349
  508   2HG   GLU  68          2HG       GLU  68  13.955   6.835   5.415
  509    H    TYR  69           H        TYR  69  10.262   4.637   6.558
  510    HA   TYR  69           HA       TYR  69   8.451   5.379   8.744
  511   1HB   TYR  69          2HB       TYR  69   8.273   3.697   6.239
  512   2HB   TYR  69          1HB       TYR  69   7.087   3.491   7.514
  513    HD1  TYR  69           HD1      TYR  69   8.570   6.012   5.192
  514    HD2  TYR  69           HD2      TYR  69   5.446   5.210   8.045
  515    HE1  TYR  69           HE1      TYR  69   7.587   8.238   4.742
  516    HE2  TYR  69           HE2      TYR  69   4.476   7.439   7.611
  517    HH   TYR  69           HH       TYR  69   4.758   9.480   6.513
  518    H    GLY  70           H        GLY  70  10.494   2.570   7.997
  519   1HA   GLY  70          1HA       GLY  70  11.376   1.155   9.667
  520   2HA   GLY  70          2HA       GLY  70  10.109   1.653  10.796
  521    H    ILE  71           H        ILE  71  10.188   0.328   7.491
  522    HA   ILE  71           HA       ILE  71   7.847  -1.322   7.867
  523    HB   ILE  71           HB       ILE  71  10.016  -1.222   5.744
  524   1HG1  ILE  71          1HG1      ILE  71   8.629   0.861   6.038
  525   2HG1  ILE  71          2HG1      ILE  71   8.467   0.069   4.464
  526   1HG2  ILE  71          1HG2      ILE  71   9.044  -3.370   5.473
  527   2HG2  ILE  71          2HG2      ILE  71   7.409  -2.770   5.816
  528   3HG2  ILE  71          3HG2      ILE  71   8.229  -2.343   4.295
  529   1HD1  ILE  71          1HD1      ILE  71   6.283  -0.839   5.123
  530   2HD1  ILE  71          2HD1      ILE  71   6.451  -0.074   6.725
  531   3HD1  ILE  71          3HD1      ILE  71   6.337   0.921   5.271
  532    H    ARG  72           HN       ARG  72   8.191  -2.549   9.683
  533    HA   ARG  72           HA       ARG  72  10.450  -4.327   9.964
  534   1HB   ARG  72          1HB       ARG  72   9.214  -3.400  11.859
  535   2HB   ARG  72          2HB       ARG  72   7.748  -4.274  11.379
  536   1HG   ARG  72          1HG       ARG  72   8.808  -6.423  11.810
  537   2HG   ARG  72          2HG       ARG  72  10.391  -5.657  12.028
  538   1HD   ARG  72          2HD       ARG  72   9.529  -4.467  14.028
  539   2HD   ARG  72          1HD       ARG  72   7.933  -5.221  13.780
  540    HE   ARG  72           HE       ARG  72   9.875  -7.276  13.900
  541   1HH1  ARG  72          1HH1      ARG  72   8.416  -4.856  16.011
  542   2HH1  ARG  72          2HH1      ARG  72   8.629  -5.782  17.472
  543   1HH2  ARG  72          2HH2      ARG  72  10.166  -8.509  15.795
  544   2HH2  ARG  72          1HH2      ARG  72   9.645  -7.903  17.343
  545    H    SER  73           H        SER  73  10.322  -5.176   7.827
  546    HA   SER  73           HA       SER  73  10.241  -7.047   6.514
  547   1HB   SER  73          2HB       SER  73   9.882  -8.456   8.569
  548   2HB   SER  73          1HB       SER  73   8.130  -8.260   8.364
  549    HG   SER  73           HG       SER  73   8.921 -10.160   7.348
  550    H    ILE  74           H        ILE  74   8.161  -8.399   5.473
  551    HA   ILE  74           HA       ILE  74   6.051  -6.514   4.756
  552    HB   ILE  74           HB       ILE  74   6.597  -6.800   2.268
  553   1HG1  ILE  74          1HG1      ILE  74   9.372  -7.552   3.192
  554   2HG1  ILE  74          2HG1      ILE  74   8.183  -8.694   2.538
  555   1HG2  ILE  74          1HG2      ILE  74   7.029  -4.718   3.670
  556   2HG2  ILE  74          2HG2      ILE  74   8.009  -4.880   2.219
  557   3HG2  ILE  74          3HG2      ILE  74   8.720  -5.257   3.796
  558   1HD1  ILE  74          1HD1      ILE  74   7.955  -7.218   0.505
  559   2HD1  ILE  74          2HD1      ILE  74   9.340  -6.278   1.102
  560   3HD1  ILE  74          3HD1      ILE  74   9.530  -7.977   0.688
  561    HA   PRO  75           HA       PRO  75   4.456  -6.885   2.550
  562   1HB   PRO  75          1HB       PRO  75   1.771  -7.400   2.886
  563   2HB   PRO  75          2HB       PRO  75   2.793  -8.025   1.586
  564   1HG   PRO  75          1HG       PRO  75   1.952  -9.340   4.166
  565   2HG   PRO  75          2HG       PRO  75   2.034 -10.098   2.555
  566   1HD   PRO  75          2HD       PRO  75   3.977 -10.415   4.501
  567   2HD   PRO  75          1HD       PRO  75   4.414 -10.389   2.778
  568    H    THR  76           H        THR  76   3.882  -5.019   3.232
  569    HA   THR  76           HA       THR  76   2.699  -4.552   5.907
  570    HB   THR  76           HB       THR  76   5.317  -3.360   4.956
  571    HG1  THR  76           HG1      THR  76   6.066  -4.688   6.424
  572   1HG2  THR  76          1HG2      THR  76   3.391  -2.470   7.150
  573   2HG2  THR  76          2HG2      THR  76   4.065  -1.498   5.832
  574   3HG2  THR  76          3HG2      THR  76   5.116  -2.056   7.150
  575    H    ILE  77           H        ILE  77   0.831  -3.970   5.059
  576    HA   ILE  77           HA       ILE  77   0.694  -2.149   2.726
  577    HB   ILE  77           HB       ILE  77  -1.353  -3.808   4.234
  578   1HG1  ILE  77          1HG1      ILE  77  -0.347  -3.879   1.356
  579   2HG1  ILE  77          2HG1      ILE  77   0.285  -4.918   2.638
  580   1HG2  ILE  77          1HG2      ILE  77  -2.425  -1.693   3.555
  581   2HG2  ILE  77          2HG2      ILE  77  -1.728  -1.846   1.931
  582   3HG2  ILE  77          3HG2      ILE  77  -2.972  -2.987   2.497
  583   1HD1  ILE  77          1HD1      ILE  77  -2.531  -4.964   1.528
  584   2HD1  ILE  77          2HD1      ILE  77  -1.967  -5.893   2.951
  585   3HD1  ILE  77          3HD1      ILE  77  -1.261  -6.181   1.350
  586    H    MET  78           H        MET  78   0.933  -0.088   3.140
  587    HA   MET  78           HA       MET  78   0.096   0.999   5.795
  588   1HB   MET  78          1HB       MET  78   1.898   2.050   3.600
  589   2HB   MET  78          2HB       MET  78   1.318   3.015   4.979
  590   1HG   MET  78          1HG       MET  78   3.007   0.514   5.262
  591   2HG   MET  78          2HG       MET  78   3.605   2.176   5.223
  592   1HE   MET  78          1HE       MET  78   4.215   1.641   8.943
  593   2HE   MET  78          2HE       MET  78   4.411   0.381   7.709
  594   3HE   MET  78          3HE       MET  78   4.903   2.061   7.357
  595    H    VAL  79           H        VAL  79  -1.388   2.649   5.832
  596    HA   VAL  79           HA       VAL  79  -2.815   3.246   3.266
  597    HB   VAL  79           HB       VAL  79  -3.979   3.153   6.057
  598   1HG1  VAL  79          1HG1      VAL  79  -4.472   1.305   3.685
  599   2HG1  VAL  79          2HG1      VAL  79  -3.571   0.872   5.153
  600   3HG1  VAL  79          3HG1      VAL  79  -5.291   1.237   5.259
  601   1HG2  VAL  79          1HG2      VAL  79  -6.134   3.593   4.976
  602   2HG2  VAL  79          2HG2      VAL  79  -5.019   4.907   4.604
  603   3HG2  VAL  79          3HG2      VAL  79  -5.355   3.666   3.388
  604    H    PHE  80           H        PHE  80  -2.937   5.451   2.820
  605    HA   PHE  80           HA       PHE  80  -2.083   7.390   4.920
  606   1HB   PHE  80          1HB       PHE  80  -0.986   7.229   2.088
  607   2HB   PHE  80          2HB       PHE  80  -0.855   8.646   3.107
  608    HD1  PHE  80           HD1      PHE  80   0.875   8.881   4.720
  609    HD2  PHE  80           HD2      PHE  80   0.186   5.078   2.812
  610    HE1  PHE  80           HE1      PHE  80   2.999   8.041   5.633
  611    HE2  PHE  80           HE2      PHE  80   2.454   4.340   3.517
  612    HZ   PHE  80           HZ       PHE  80   3.762   5.705   5.104
  613    H    LYS  81           HN       LYS  81  -2.789   9.577   4.417
  614    HA   LYS  81           HA       LYS  81  -4.779   9.978   2.320
  615   1HB   LYS  81          1HB       LYS  81  -6.721  10.173   3.686
  616   2HB   LYS  81          2HB       LYS  81  -6.034   8.588   3.968
  617   1HG   LYS  81          2HG       LYS  81  -6.339  10.900   5.837
  618   2HG   LYS  81          1HG       LYS  81  -6.707   9.196   6.064
  619   1HD   LYS  81          1HD       LYS  81  -4.185   8.775   6.135
  620   2HD   LYS  81          2HD       LYS  81  -3.956  10.524   6.177
  621   1HE   LYS  81          2HE       LYS  81  -5.549   8.919   8.229
  622   2HE   LYS  81          1HE       LYS  81  -3.899   9.529   8.439
  623   1HZ   LYS  81          1HZ       LYS  81  -4.754  11.747   8.160
  624   2HZ   LYS  81          2HZ       LYS  81  -5.478  10.982   9.429
  625   3HZ   LYS  81          3HZ       LYS  81  -6.291  11.172   8.009
  626    H    GLY  82           H        GLY  82  -3.113  11.656   1.898
  627   1HA   GLY  82          2HA       GLY  82  -2.853  13.994   1.937
  628   2HA   GLY  82          1HA       GLY  82  -3.890  14.043   3.388
  629    H    GLY  83           H        GLY  83  -0.629  12.919   2.378
  630   1HA   GLY  83          2HA       GLY  83   1.399  13.162   3.396
  631   2HA   GLY  83          1HA       GLY  83   0.669  14.277   4.541
  632    H    LYS  84           HN       LYS  84  -1.054  12.874   5.941
  633    HA   LYS  84           HA       LYS  84   0.721  11.328   7.639
  634   1HB   LYS  84          2HB       LYS  84  -2.249  11.832   7.985
  635   2HB   LYS  84          1HB       LYS  84  -1.083  11.424   9.243
  636   1HG   LYS  84          2HG       LYS  84  -1.176  14.031   7.644
  637   2HG   LYS  84          1HG       LYS  84  -1.666  13.797   9.326
  638   1HD   LYS  84          2HD       LYS  84   0.694  13.104   9.882
  639   2HD   LYS  84          1HD       LYS  84   1.177  13.513   8.227
  640   1HE   LYS  84          1HE       LYS  84  -0.044  15.449  10.250
  641   2HE   LYS  84          2HE       LYS  84   1.668  15.344   9.812
  642   1HZ   LYS  84          1HZ       LYS  84   1.071  15.916   7.568
  643   2HZ   LYS  84          2HZ       LYS  84   0.588  17.083   8.627
  644   3HZ   LYS  84          3HZ       LYS  84  -0.518  16.046   7.984
  645    H    LYS  85           HN       LYS  85   0.239   9.380   8.563
  646    HA   LYS  85           HA       LYS  85  -0.618   7.276   6.685
  647   1HB   LYS  85          2HB       LYS  85   1.624   7.213   7.800
  648   2HB   LYS  85          1HB       LYS  85   0.818   7.192   9.360
  649   1HG   LYS  85          1HG       LYS  85  -0.395   5.016   8.059
  650   2HG   LYS  85          2HG       LYS  85   1.192   5.060   7.318
  651   1HD   LYS  85          1HD       LYS  85   1.560   3.674   9.118
  652   2HD   LYS  85          2HD       LYS  85   2.090   5.204   9.806
  653   1HE   LYS  85          1HE       LYS  85  -0.665   3.892  10.177
  654   2HE   LYS  85          2HE       LYS  85   0.660   3.837  11.345
  655   1HZ   LYS  85          1HZ       LYS  85   0.500   6.211  11.544
  656   2HZ   LYS  85          2HZ       LYS  85  -0.927   5.479  11.921
  657   3HZ   LYS  85          3HZ       LYS  85  -0.762   6.261  10.487
  658    H    CYS  86           H        CYS  86  -2.493   6.194   7.043
  659    HA   CYS  86           HA       CYS  86  -4.227   6.889   9.342
  660   1HB   CYS  86          2HB       CYS  86  -5.096   6.822   6.958
  661   2HB   CYS  86          1HB       CYS  86  -4.792   5.090   6.944
  662    HG   CYS  86           HG       CYS  86  -7.105   4.858   7.501
  663    H    GLU  87           HN       GLU  87  -3.031   3.980   7.652
  664    HA   GLU  87           HA       GLU  87  -3.086   2.400  10.198
  665   1HB   GLU  87          2HB       GLU  87  -4.170   1.495   7.508
  666   2HB   GLU  87          1HB       GLU  87  -4.096   0.501   8.946
  667   1HG   GLU  87          2HG       GLU  87  -5.911   1.445   9.918
  668   2HG   GLU  87          1HG       GLU  87  -5.668   3.041   9.226
  669    H    THR  88           H        THR  88  -2.015   0.314   9.968
  670    HA   THR  88           HA       THR  88  -0.035  -0.070   7.857
  671    HB   THR  88           HB       THR  88   1.162   1.205   9.612
  672    HG1  THR  88           HG1      THR  88   2.207  -0.501   8.472
  673   1HG2  THR  88          1HG2      THR  88  -0.187   0.518  11.611
  674   2HG2  THR  88          2HG2      THR  88   1.564   0.361  11.822
  675   3HG2  THR  88          3HG2      THR  88   0.589  -1.082  11.535
  676    H    ILE  89           H        ILE  89  -0.340  -2.188   7.248
  677    HA   ILE  89           HA       ILE  89  -1.410  -4.137   9.263
  678    HB   ILE  89           HB       ILE  89  -2.169  -3.871   6.326
  679   1HG1  ILE  89          2HG1      ILE  89  -3.792  -3.283   8.847
  680   2HG1  ILE  89          1HG1      ILE  89  -3.153  -2.068   7.731
  681   1HG2  ILE  89          1HG2      ILE  89  -2.119  -6.221   7.190
  682   2HG2  ILE  89          2HG2      ILE  89  -3.760  -5.691   6.848
  683   3HG2  ILE  89          3HG2      ILE  89  -3.185  -5.738   8.525
  684   1HD1  ILE  89          1HD1      ILE  89  -4.503  -3.025   5.889
  685   2HD1  ILE  89          2HD1      ILE  89  -5.300  -4.092   7.078
  686   3HD1  ILE  89          3HD1      ILE  89  -5.443  -2.335   7.225
  687    H    ILE  90           H        ILE  90   0.360  -5.284   9.721
  688    HA   ILE  90           HA       ILE  90   2.351  -5.947   7.629
  689    HB   ILE  90           HB       ILE  90   2.501  -6.137  10.666
  690   1HG1  ILE  90          1HG1      ILE  90   3.570  -4.040   8.735
  691   2HG1  ILE  90          2HG1      ILE  90   2.306  -3.791   9.946
  692   1HG2  ILE  90          1HG2      ILE  90   4.020  -7.724   9.474
  693   2HG2  ILE  90          2HG2      ILE  90   4.927  -6.462  10.280
  694   3HG2  ILE  90          3HG2      ILE  90   4.673  -6.375   8.525
  695   1HD1  ILE  90          1HD1      ILE  90   5.254  -4.270  10.468
  696   2HD1  ILE  90          2HD1      ILE  90   3.999  -4.339  11.735
  697   3HD1  ILE  90          3HD1      ILE  90   4.280  -2.839  10.827
  698    H    GLY  91           H        GLY  91   2.649  -8.035   6.994
  699   1HA   GLY  91          2HA       GLY  91   2.902 -10.356   7.561
  700   2HA   GLY  91          1HA       GLY  91   1.506 -10.279   8.639
  701    H    ALA  92           H        ALA  92   1.891 -12.193   6.569
  702    HA   ALA  92           HA       ALA  92   0.459 -11.587   4.177
  703   1HB   ALA  92          1HB       ALA  92   2.213 -13.338   4.456
  704   2HB   ALA  92          2HB       ALA  92   1.125 -14.248   5.518
  705   3HB   ALA  92          3HB       ALA  92   0.698 -14.012   3.813
  706    H    VAL  93           H        VAL  93  -1.360 -10.616   5.938
  707    HA   VAL  93           HA       VAL  93  -3.382 -12.692   6.531
  708    HB   VAL  93           HB       VAL  93  -4.731 -10.878   7.381
  709   1HG1  VAL  93          1HG2      VAL  93  -2.479  -8.978   6.581
  710   2HG1  VAL  93          2HG2      VAL  93  -4.093  -9.085   5.847
  711   3HG1  VAL  93          3HG2      VAL  93  -3.921  -8.573   7.531
  712   1HG2  VAL  93          1HG1      VAL  93  -3.344 -10.254   9.286
  713   2HG2  VAL  93          2HG1      VAL  93  -3.027 -11.940   8.840
  714   3HG2  VAL  93          3HG1      VAL  93  -1.864 -10.670   8.401
  715    HA   PRO  94           HA       PRO  94  -5.024 -12.425   2.496
  716   1HB   PRO  94          1HB       PRO  94  -7.704 -13.049   2.787
  717   2HB   PRO  94          2HB       PRO  94  -6.358 -14.207   2.918
  718   1HG   PRO  94          1HG       PRO  94  -7.874 -12.828   5.136
  719   2HG   PRO  94          2HG       PRO  94  -7.348 -14.527   5.064
  720   1HD   PRO  94          1HD       PRO  94  -5.976 -12.581   6.459
  721   2HD   PRO  94          2HD       PRO  94  -5.159 -13.964   5.733
  722    H    LYS  95           HN       LYS  95  -6.243 -11.198   1.034
  723    HA   LYS  95           HA       LYS  95  -6.346  -8.505   1.393
  724   1HB   LYS  95          1HB       LYS  95  -6.564  -9.790  -0.779
  725   2HB   LYS  95          2HB       LYS  95  -8.227 -10.134  -0.389
  726   1HG   LYS  95          2HG       LYS  95  -8.078  -8.229  -1.944
  727   2HG   LYS  95          1HG       LYS  95  -8.876  -7.833  -0.451
  728   1HD   LYS  95          1HD       LYS  95  -7.525  -6.000  -1.107
  729   2HD   LYS  95          2HD       LYS  95  -6.837  -6.629   0.358
  730   1HE   LYS  95          2HE       LYS  95  -5.773  -7.353  -2.423
  731   2HE   LYS  95          1HE       LYS  95  -5.232  -5.935  -1.517
  732   1HZ   LYS  95          1HZ       LYS  95  -4.500  -7.354   0.233
  733   2HZ   LYS  95          2HZ       LYS  95  -4.964  -8.700  -0.595
  734   3HZ   LYS  95          3HZ       LYS  95  -3.768  -7.742  -1.190
  735    H    ALA  96           H        ALA  96  -9.043 -10.736   1.692
  736    HA   ALA  96           HA       ALA  96 -11.209  -9.163   2.330
  737   1HB   ALA  96          1HB       ALA  96 -11.272 -11.630   2.317
  738   2HB   ALA  96          2HB       ALA  96 -10.360 -11.675   3.844
  739   3HB   ALA  96          3HB       ALA  96 -11.997 -10.987   3.804
  740    H    THR  97           H        THR  97  -8.495  -9.900   4.564
  741    HA   THR  97           HA       THR  97  -9.595  -8.659   6.888
  742    HB   THR  97           HB       THR  97  -6.612  -8.838   6.333
  743    HG1  THR  97           HG1      THR  97  -7.120 -10.732   5.571
  744   1HG2  THR  97          1HG2      THR  97  -6.554  -9.663   8.632
  745   2HG2  THR  97          2HG2      THR  97  -7.429  -8.117   8.583
  746   3HG2  THR  97          3HG2      THR  97  -8.324  -9.655   8.719
  747    H    ILE  98           H        ILE  98  -7.380  -7.587   4.302
  748    HA   ILE  98           HA       ILE  98  -6.822  -4.951   5.274
  749    HB   ILE  98           HB       ILE  98  -6.589  -6.392   2.610
  750   1HG1  ILE  98          1HG1      ILE  98  -4.271  -5.739   2.802
  751   2HG1  ILE  98          2HG1      ILE  98  -4.577  -4.881   4.319
  752   1HG2  ILE  98          1HG2      ILE  98  -6.197  -3.395   3.005
  753   2HG2  ILE  98          2HG2      ILE  98  -5.620  -4.336   1.612
  754   3HG2  ILE  98          3HG2      ILE  98  -7.347  -4.167   1.885
  755   1HD1  ILE  98          1HD1      ILE  98  -3.561  -7.134   4.601
  756   2HD1  ILE  98          2HD1      ILE  98  -4.989  -7.869   3.843
  757   3HD1  ILE  98          3HD1      ILE  98  -5.137  -7.015   5.403
  758    H    VAL  99           H        VAL  99  -9.199  -6.174   2.898
  759    HA   VAL  99           HA       VAL  99 -10.490  -3.764   2.263
  760    HB   VAL  99           HB       VAL  99 -11.428  -6.654   2.392
  761   1HG1  VAL  99          1HG1      VAL  99 -12.920  -4.292   1.197
  762   2HG1  VAL  99          2HG1      VAL  99 -13.477  -5.299   2.552
  763   3HG1  VAL  99          3HG1      VAL  99 -13.326  -5.996   0.936
  764   1HG2  VAL  99          1HG2      VAL  99  -9.641  -5.993   0.729
  765   2HG2  VAL  99          2HG2      VAL  99 -11.139  -6.553  -0.037
  766   3HG2  VAL  99          3HG2      VAL  99 -10.771  -4.818   0.041
  767    H    GLN 100           H        GLN 100 -11.522  -6.196   4.748
  768    HA   GLN 100           HA       GLN 100 -13.644  -4.656   5.799
  769   1HB   GLN 100          2HB       GLN 100 -11.789  -6.723   7.040
  770   2HB   GLN 100          1HB       GLN 100 -13.151  -6.020   7.928
  771   1HG   GLN 100          1HG       GLN 100 -14.765  -6.829   6.376
  772   2HG   GLN 100          2HG       GLN 100 -13.539  -7.331   5.206
  773   1HE2  GLN 100          1HE2      GLN 100 -11.905  -8.932   6.030
  774   2HE2  GLN 100          2HE2      GLN 100 -12.508 -10.245   7.056
  775    H    THR 101           H        THR 101 -10.214  -4.754   6.872
  776    HA   THR 101           HA       THR 101 -10.560  -2.915   9.015
  777    HB   THR 101           HB       THR 101  -8.033  -3.389   7.373
  778    HG1  THR 101           HG1      THR 101  -8.816  -5.340   8.125
  779   1HG2  THR 101          1HG2      THR 101  -6.895  -2.874   9.512
  780   2HG2  THR 101          2HG2      THR 101  -8.460  -2.537  10.278
  781   3HG2  THR 101          3HG2      THR 101  -7.859  -1.489   8.977
  782    H    VAL 102           H        VAL 102  -9.337  -2.249   5.650
  783    HA   VAL 102           HA       VAL 102  -9.031   0.518   6.150
  784    HB   VAL 102           HB       VAL 102  -8.204  -1.059   4.207
  785   1HG1  VAL 102          1HG2      VAL 102  -7.558   0.953   2.949
  786   2HG1  VAL 102          2HG2      VAL 102  -7.475   1.282   4.684
  787   3HG1  VAL 102          3HG2      VAL 102  -8.846   1.886   3.742
  788   1HG2  VAL 102          1HG1      VAL 102 -10.366  -1.464   3.133
  789   2HG2  VAL 102          2HG1      VAL 102  -9.224  -0.655   2.056
  790   3HG2  VAL 102          3HG1      VAL 102 -10.537   0.278   2.796
  791    H    GLU 103           HN       GLU 103 -11.774  -1.325   4.855
  792    HA   GLU 103           HA       GLU 103 -13.422   0.951   4.369
  793   1HB   GLU 103          1HB       GLU 103 -14.076  -1.963   4.966
  794   2HB   GLU 103          2HB       GLU 103 -15.294  -0.741   4.567
  795   1HG   GLU 103          2HG       GLU 103 -14.245  -0.219   2.450
  796   2HG   GLU 103          1HG       GLU 103 -12.897  -1.311   2.772
  797    H    LYS 104           HN       LYS 104 -13.105  -1.093   7.280
  798    HA   LYS 104           HA       LYS 104 -15.001   0.244   8.908
  799   1HB   LYS 104          2HB       LYS 104 -14.078  -1.758   9.699
  800   2HB   LYS 104          1HB       LYS 104 -12.412  -1.240   9.511
  801   1HG   LYS 104          1HG       LYS 104 -14.144   0.288  11.440
  802   2HG   LYS 104          2HG       LYS 104 -13.592  -1.341  11.871
  803   1HD   LYS 104          2HD       LYS 104 -11.248  -0.717  11.553
  804   2HD   LYS 104          1HD       LYS 104 -11.711   0.927  11.092
  805   1HE   LYS 104          1HE       LYS 104 -12.785   1.263  13.301
  806   2HE   LYS 104          2HE       LYS 104 -12.260  -0.360  13.793
  807   1HZ   LYS 104          1HZ       LYS 104 -10.494   1.852  13.001
  808   2HZ   LYS 104          2HZ       LYS 104 -10.765   1.336  14.543
  809   3HZ   LYS 104          3HZ       LYS 104 -10.001   0.350  13.466
  810    H    TYR 105           H        TYR 105 -11.601   1.053   8.210
  811    HA   TYR 105           HA       TYR 105 -11.556   3.387   9.935
  812   1HB   TYR 105          2HB       TYR 105  -9.790   2.042   7.948
  813   2HB   TYR 105          1HB       TYR 105  -9.497   3.761   8.200
  814    HD1  TYR 105           HD1      TYR 105  -8.699   4.623  10.317
  815    HD2  TYR 105           HD2      TYR 105  -9.312   0.406   9.737
  816    HE1  TYR 105           HE1      TYR 105  -7.284   4.136  12.304
  817    HE2  TYR 105           HE2      TYR 105  -7.952  -0.083  11.731
  818    HH   TYR 105           HH       TYR 105  -6.643   0.803  13.422
  819    H    LEU 106           H        LEU 106 -12.109   2.965   6.426
  820    HA   LEU 106           HA       LEU 106 -12.530   5.893   6.071
  821   1HB   LEU 106          2HB       LEU 106 -12.267   3.611   4.064
  822   2HB   LEU 106          1HB       LEU 106 -12.513   5.316   3.663
  823    HG   LEU 106           HG       LEU 106 -10.086   4.096   5.057
  824   1HD1  LEU 106          1HD2      LEU 106  -9.032   6.327   4.619
  825   2HD1  LEU 106          2HD2      LEU 106 -10.622   6.957   4.139
  826   3HD1  LEU 106          3HD2      LEU 106 -10.337   6.409   5.807
  827   1HD2  LEU 106          1HD1      LEU 106 -10.456   5.195   2.231
  828   2HD2  LEU 106          2HD1      LEU 106  -8.950   4.551   2.916
  829   3HD2  LEU 106          3HD1      LEU 106 -10.338   3.481   2.659
  830    H    ASN 107           H        ASN 107 -14.127   3.278   4.278
  831    HA   ASN 107           HA       ASN 107 -16.636   3.314   5.511
  832   1HB   ASN 107          1HB       ASN 107 -17.851   4.288   3.509
  833   2HB   ASN 107          2HB       ASN 107 -17.076   5.461   4.571
  834   1HD2  ASN 107          1HD2      ASN 107 -15.222   3.583   2.100
  835   2HD2  ASN 107          2HD2      ASN 107 -14.932   4.994   1.077
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1  -9.923   3.684  -7.253
    2   2H    MET   1          2H        MET   1  -9.512   2.082  -7.434
    3   3H    MET   1          3H        MET   1  -8.452   3.116  -6.778
    4    HA   MET   1           HA       MET   1  -9.371   3.238  -9.551
    5   1HB   MET   1          2HB       MET   1  -8.566   5.410  -8.281
    6   2HB   MET   1          1HB       MET   1  -6.972   4.662  -8.335
    7   1HG   MET   1          1HG       MET   1  -7.161   6.133 -10.252
    8   2HG   MET   1          2HG       MET   1  -7.201   4.504 -10.838
    9   1HE   MET   1          1HE       MET   1 -10.741   7.454 -10.830
   10   2HE   MET   1          2HE       MET   1  -9.049   7.853 -10.462
   11   3HE   MET   1          3HE       MET   1 -10.024   6.930  -9.293
   12    H    GLU   2           HN       GLU   2  -7.789   2.412 -11.097
   13    HA   GLU   2           HA       GLU   2  -6.580   0.004 -10.604
   14   1HB   GLU   2          2HB       GLU   2  -5.013   0.696 -12.518
   15   2HB   GLU   2          1HB       GLU   2  -6.740   0.666 -12.854
   16   1HG   GLU   2          1HG       GLU   2  -5.584   3.318 -11.961
   17   2HG   GLU   2          2HG       GLU   2  -5.122   2.727 -13.545
   18    H    ALA   3           H        ALA   3  -4.696  -0.758  -9.732
   19    HA   ALA   3           HA       ALA   3  -3.302   1.003  -7.939
   20   1HB   ALA   3          1HB       ALA   3  -2.698  -1.871  -8.738
   21   2HB   ALA   3          2HB       ALA   3  -3.783  -1.393  -7.415
   22   3HB   ALA   3          3HB       ALA   3  -2.049  -1.035  -7.313
   23    H    GLY   4           H        GLY   4  -0.990   1.313  -7.882
   24   1HA   GLY   4          1HA       GLY   4   0.423   1.175 -10.543
   25   2HA   GLY   4          2HA       GLY   4   0.535   2.542  -9.423
   26    H    ALA   5           H        ALA   5   2.898   1.961  -9.708
   27    HA   ALA   5           HA       ALA   5   3.785   0.180  -7.526
   28   1HB   ALA   5          1HB       ALA   5   5.683  -0.568  -8.920
   29   2HB   ALA   5          2HB       ALA   5   4.996   0.273 -10.327
   30   3HB   ALA   5          3HB       ALA   5   4.138  -1.109  -9.608
   31    H    VAL   6           H        VAL   6   5.682   1.113  -6.501
   32    HA   VAL   6           HA       VAL   6   6.510   3.792  -7.503
   33    HB   VAL   6           HB       VAL   6   6.361   4.473  -4.946
   34   1HG1  VAL   6          1HG1      VAL   6   4.053   2.499  -5.058
   35   2HG1  VAL   6          2HG1      VAL   6   5.573   2.227  -4.209
   36   3HG1  VAL   6          3HG1      VAL   6   4.517   3.562  -3.717
   37   1HG2  VAL   6          1HG2      VAL   6   3.998   4.454  -6.830
   38   2HG2  VAL   6          2HG2      VAL   6   4.096   5.386  -5.317
   39   3HG2  VAL   6          3HG2      VAL   6   5.233   5.709  -6.634
   40    H    ASN   7           H        ASN   7   8.216   4.705  -6.221
   41    HA   ASN   7           HA       ASN   7  10.183   2.861  -5.029
   42   1HB   ASN   7          2HB       ASN   7  10.915   3.024  -7.349
   43   2HB   ASN   7          1HB       ASN   7  10.540   4.760  -7.400
   44   1HD2  ASN   7          1HD2      ASN   7  12.833   2.343  -6.229
   45   2HD2  ASN   7          2HD2      ASN   7  14.103   3.494  -5.809
   46    H    ASP   8           HN       ASP   8  11.885   4.341  -4.117
   47    HA   ASP   8           HA       ASP   8  11.017   6.003  -2.093
   48   1HB   ASP   8          2HB       ASP   8  13.351   5.095  -2.536
   49   2HB   ASP   8          1HB       ASP   8  13.591   6.366  -3.724
   50    H    ASP   9           HN       ASP   9  12.098   6.995  -5.299
   51    HA   ASP   9           HA       ASP   9  11.619   9.800  -5.033
   52   1HB   ASP   9          1HB       ASP   9  12.962   8.914  -6.847
   53   2HB   ASP   9          2HB       ASP   9  11.621   7.983  -7.494
   54    H    THR  10           H        THR  10   9.643   7.617  -7.062
   55    HA   THR  10           HA       THR  10   7.518   9.387  -7.442
   56    HB   THR  10           HB       THR  10   6.266   7.238  -8.057
   57    HG1  THR  10           HG1      THR  10   7.771   5.436  -8.216
   58   1HG2  THR  10          1HG2      THR  10   7.684   6.841 -10.029
   59   2HG2  THR  10          2HG2      THR  10   7.580   8.574  -9.679
   60   3HG2  THR  10          3HG2      THR  10   9.045   7.673  -9.251
   61    H    PHE  11           H        PHE  11   7.943   7.087  -4.784
   62    HA   PHE  11           HA       PHE  11   5.542   6.923  -3.507
   63   1HB   PHE  11          1HB       PHE  11   7.711   6.055  -2.690
   64   2HB   PHE  11          2HB       PHE  11   8.217   7.663  -2.268
   65    HD1  PHE  11           HD1      PHE  11   5.851   4.931  -1.407
   66    HD2  PHE  11           HD2      PHE  11   7.583   8.683  -0.176
   67    HE1  PHE  11           HE1      PHE  11   5.013   4.565   0.901
   68    HE2  PHE  11           HE2      PHE  11   6.729   8.318   2.121
   69    HZ   PHE  11           HZ       PHE  11   5.438   6.269   2.661
   70    H    LYS  12           HN       LYS  12   7.761   9.609  -3.425
   71    HA   LYS  12           HA       LYS  12   6.504  11.403  -1.643
   72   1HB   LYS  12          1HB       LYS  12   7.992  11.979  -4.245
   73   2HB   LYS  12          2HB       LYS  12   7.456  13.193  -3.105
   74   1HG   LYS  12          2HG       LYS  12   8.900  12.215  -1.333
   75   2HG   LYS  12          1HG       LYS  12   9.272  10.828  -2.369
   76   1HD   LYS  12          2HD       LYS  12  11.159  12.313  -2.381
   77   2HD   LYS  12          1HD       LYS  12  10.420  12.277  -3.989
   78   1HE   LYS  12          1HE       LYS  12   9.309  14.451  -3.548
   79   2HE   LYS  12          2HE       LYS  12   9.948  14.458  -1.891
   80   1HZ   LYS  12          1HZ       LYS  12  11.243  15.800  -3.369
   81   2HZ   LYS  12          2HZ       LYS  12  12.147  14.535  -2.822
   82   3HZ   LYS  12          3HZ       LYS  12  11.545  14.515  -4.356
   83    H    ASN  13           H        ASN  13   6.092  11.409  -5.214
   84    HA   ASN  13           HA       ASN  13   3.980  13.404  -5.139
   85   1HB   ASN  13          1HB       ASN  13   4.988  11.520  -7.311
   86   2HB   ASN  13          2HB       ASN  13   3.855  12.837  -7.564
   87   1HD2  ASN  13          1HD2      ASN  13   5.648  14.466  -5.392
   88   2HD2  ASN  13          2HD2      ASN  13   6.858  15.079  -6.484
   89    H    VAL  14           H        VAL  14   4.183   9.946  -5.430
   90    HA   VAL  14           HA       VAL  14   1.377   9.678  -6.293
   91    HB   VAL  14           HB       VAL  14   3.580   7.647  -5.751
   92   1HG1  VAL  14          1HG1      VAL  14   3.688   7.512  -8.227
   93   2HG1  VAL  14          2HG1      VAL  14   4.047   9.155  -7.691
   94   3HG1  VAL  14          3HG1      VAL  14   2.449   8.774  -8.357
   95   1HG2  VAL  14          1HG2      VAL  14   0.829   7.298  -7.003
   96   2HG2  VAL  14          2HG2      VAL  14   1.450   6.499  -5.536
   97   3HG2  VAL  14          3HG2      VAL  14   2.144   6.110  -7.117
   98    H    VAL  15           H        VAL  15   3.212   8.960  -3.312
   99    HA   VAL  15           HA       VAL  15   0.746   7.855  -2.056
  100    HB   VAL  15           HB       VAL  15   3.619   7.749  -1.048
  101   1HG1  VAL  15          1HG1      VAL  15   1.888   7.539   0.693
  102   2HG1  VAL  15          2HG1      VAL  15   2.790   6.053   0.437
  103   3HG1  VAL  15          3HG1      VAL  15   1.143   6.205  -0.220
  104   1HG2  VAL  15          1HG2      VAL  15   3.432   6.520  -3.190
  105   2HG2  VAL  15          2HG2      VAL  15   3.594   5.410  -1.825
  106   3HG2  VAL  15          3HG2      VAL  15   2.008   5.676  -2.569
  107    H    LEU  16           H        LEU  16   3.496  10.025  -1.199
  108    HA   LEU  16           HA       LEU  16   2.094  11.004   1.134
  109   1HB   LEU  16          2HB       LEU  16   4.460  12.189  -0.382
  110   2HB   LEU  16          1HB       LEU  16   3.828  12.791   1.123
  111    HG   LEU  16           HG       LEU  16   5.071  10.048   0.588
  112   1HD1  LEU  16          1HD1      LEU  16   6.882  10.874   2.038
  113   2HD1  LEU  16          2HD1      LEU  16   6.022  12.411   2.265
  114   3HD1  LEU  16          3HD1      LEU  16   6.649  11.969   0.665
  115   1HD2  LEU  16          1HD2      LEU  16   3.888  11.179   3.164
  116   2HD2  LEU  16          2HD2      LEU  16   3.425   9.683   2.312
  117   3HD2  LEU  16          3HD2      LEU  16   4.994   9.792   3.108
  118    H    GLU  17           HN       GLU  17   2.991  12.872  -1.758
  119    HA   GLU  17           HA       GLU  17   1.126  14.973  -1.087
  120   1HB   GLU  17          1HB       GLU  17   2.729  14.475  -3.631
  121   2HB   GLU  17          2HB       GLU  17   2.000  16.009  -3.154
  122   1HG   GLU  17          2HG       GLU  17   3.496  16.240  -1.269
  123   2HG   GLU  17          1HG       GLU  17   4.155  14.615  -1.486
  124    H    SER  18           H        SER  18  -0.344  12.524  -1.472
  125    HA   SER  18           HA       SER  18  -1.790  12.859  -4.047
  126   1HB   SER  18          2HB       SER  18  -1.091  10.600  -3.344
  127   2HB   SER  18          1HB       SER  18  -2.085  10.753  -1.877
  128    HG   SER  18           HG       SER  18  -3.837  10.454  -3.081
  129    H    SER  19           H        SER  19  -3.977  13.482  -4.064
  130    HA   SER  19           HA       SER  19  -4.965  15.046  -1.806
  131   1HB   SER  19          2HB       SER  19  -6.884  15.288  -3.535
  132   2HB   SER  19          1HB       SER  19  -5.295  15.943  -3.988
  133    HG   SER  19           HG       SER  19  -6.149  14.634  -5.671
  134    H    VAL  20           H        VAL  20  -6.211  12.401  -3.833
  135    HA   VAL  20           HA       VAL  20  -8.119  11.522  -1.793
  136    HB   VAL  20           HB       VAL  20  -8.791   9.864  -3.362
  137   1HG1  VAL  20          1HG2      VAL  20  -6.361  10.563  -5.062
  138   2HG1  VAL  20          2HG2      VAL  20  -7.712   9.521  -5.556
  139   3HG1  VAL  20          3HG2      VAL  20  -6.664   9.022  -4.228
  140   1HG2  VAL  20          1HG1      VAL  20  -9.483  11.220  -5.231
  141   2HG2  VAL  20          2HG1      VAL  20  -9.525  12.198  -3.754
  142   3HG2  VAL  20          3HG1      VAL  20  -8.202  12.405  -4.923
  143    HA   PRO  21           HA       PRO  21  -5.558   8.779   0.429
  144   1HB   PRO  21          2HB       PRO  21  -7.697   6.706  -0.120
  145   2HB   PRO  21          1HB       PRO  21  -6.820   6.952   1.418
  146   1HG   PRO  21          1HG       PRO  21  -9.268   7.939   1.089
  147   2HG   PRO  21          2HG       PRO  21  -8.032   9.092   1.687
  148   1HD   PRO  21          2HD       PRO  21  -9.019   8.757  -1.180
  149   2HD   PRO  21          1HD       PRO  21  -8.826  10.230  -0.238
  150    H    VAL  22           H        VAL  22  -4.310   6.863   0.413
  151    HA   VAL  22           HA       VAL  22  -3.981   5.462  -2.186
  152    HB   VAL  22           HB       VAL  22  -1.700   6.852  -0.702
  153   1HG1  VAL  22          1HG1      VAL  22  -0.882   4.978  -1.897
  154   2HG1  VAL  22          2HG1      VAL  22  -0.558   6.355  -2.959
  155   3HG1  VAL  22          3HG1      VAL  22  -1.928   5.298  -3.301
  156   1HG2  VAL  22          1HG2      VAL  22  -3.060   8.611  -1.607
  157   2HG2  VAL  22          2HG2      VAL  22  -1.626   8.405  -2.611
  158   3HG2  VAL  22          3HG2      VAL  22  -3.189   7.804  -3.181
  159    H    LEU  23           H        LEU  23  -3.949   3.392  -1.822
  160    HA   LEU  23           HA       LEU  23  -3.112   2.266   0.793
  161   1HB   LEU  23          2HB       LEU  23  -5.233   1.710  -0.492
  162   2HB   LEU  23          1HB       LEU  23  -4.289   0.822  -1.637
  163    HG   LEU  23           HG       LEU  23  -3.731   0.121   1.218
  164   1HD1  LEU  23          1HD2      LEU  23  -2.785  -1.207  -0.657
  165   2HD1  LEU  23          2HD2      LEU  23  -3.900  -2.185   0.301
  166   3HD1  LEU  23          3HD2      LEU  23  -4.426  -1.532  -1.256
  167   1HD2  LEU  23          1HD1      LEU  23  -5.790  -1.184   1.489
  168   2HD2  LEU  23          2HD1      LEU  23  -6.145   0.547   1.357
  169   3HD2  LEU  23          3HD1      LEU  23  -6.425  -0.523  -0.036
  170    H    VAL  24           H        VAL  24  -0.778   2.408   0.726
  171    HA   VAL  24           HA       VAL  24   0.542   1.226  -1.704
  172    HB   VAL  24           HB       VAL  24   1.441   3.329  -1.284
  173   1HG1  VAL  24          1HG2      VAL  24   0.745   3.859   0.917
  174   2HG1  VAL  24          2HG2      VAL  24   2.517   3.913   0.904
  175   3HG1  VAL  24          3HG2      VAL  24   1.693   2.526   1.624
  176   1HG2  VAL  24          1HG1      VAL  24   3.393   1.350  -0.034
  177   2HG2  VAL  24          2HG1      VAL  24   3.057   1.475  -1.777
  178   3HG2  VAL  24          3HG1      VAL  24   3.770   2.844  -0.905
  179    H    ASP  25           HN       ASP  25   1.448  -0.754  -1.614
  180    HA   ASP  25           HA       ASP  25   1.653  -2.124   1.033
  181   1HB   ASP  25          1HB       ASP  25   0.187  -3.271  -0.548
  182   2HB   ASP  25          2HB       ASP  25   1.454  -3.230  -1.779
  183    H    PHE  26           H        PHE  26   3.680  -2.329   1.820
  184    HA   PHE  26           HA       PHE  26   6.047  -1.787   0.110
  185   1HB   PHE  26          2HB       PHE  26   5.697  -2.526   3.035
  186   2HB   PHE  26          1HB       PHE  26   7.253  -2.367   2.239
  187    HD1  PHE  26           HD1      PHE  26   4.105  -0.398   2.978
  188    HD2  PHE  26           HD2      PHE  26   8.318  -0.259   2.043
  189    HE1  PHE  26           HE1      PHE  26   4.149   1.994   3.537
  190    HE2  PHE  26           HE2      PHE  26   8.381   2.106   2.738
  191    HZ   PHE  26           HZ       PHE  26   6.295   3.253   3.493
  192    H    TRP  27           H        TRP  27   6.609  -3.451  -1.237
  193    HA   TRP  27           HA       TRP  27   6.232  -6.271  -0.276
  194   1HB   TRP  27          2HB       TRP  27   5.522  -6.934  -2.466
  195   2HB   TRP  27          1HB       TRP  27   4.518  -5.572  -2.007
  196    HD1  TRP  27           HD1      TRP  27   5.431  -3.178  -3.060
  197    HE1  TRP  27           HE1      TRP  27   6.594  -2.604  -5.311
  198    HE3  TRP  27           HE3      TRP  27   6.670  -7.959  -4.653
  199    HZ2  TRP  27           HZ2      TRP  27   8.019  -3.989  -7.336
  200    HZ3  TRP  27           HZ3      TRP  27   7.818  -8.230  -6.737
  201    HH2  TRP  27           HH2      TRP  27   8.613  -6.308  -8.067
  202    H    ALA  28           H        ALA  28   7.382  -7.659  -2.116
  203    HA   ALA  28           HA       ALA  28   9.698  -6.617  -3.370
  204   1HB   ALA  28          1HB       ALA  28  10.172  -8.578  -1.075
  205   2HB   ALA  28          2HB       ALA  28  10.611  -6.847  -1.014
  206   3HB   ALA  28          3HB       ALA  28  11.395  -7.925  -2.177
  207    HA   PRO  29           HA       PRO  29   8.200 -10.110  -5.602
  208   1HB   PRO  29          2HB       PRO  29  10.169 -10.997  -7.111
  209   2HB   PRO  29          1HB       PRO  29   9.568  -9.364  -7.199
  210   1HG   PRO  29          1HG       PRO  29  12.116 -10.051  -5.788
  211   2HG   PRO  29          2HG       PRO  29  11.833  -8.806  -7.029
  212   1HD   PRO  29          1HD       PRO  29  11.642  -8.216  -4.365
  213   2HD   PRO  29          2HD       PRO  29  10.574  -7.448  -5.571
  214    H    TRP  30           H        TRP  30  11.299 -10.811  -4.215
  215    HA   TRP  30           HA       TRP  30  11.018 -13.606  -3.763
  216   1HB   TRP  30          1HB       TRP  30  12.678 -13.307  -1.935
  217   2HB   TRP  30          2HB       TRP  30  13.148 -12.631  -3.484
  218    HD1  TRP  30           HD1      TRP  30  14.101 -10.300  -3.453
  219    HE1  TRP  30           HE1      TRP  30  14.381  -8.405  -1.727
  220    HE3  TRP  30           HE3      TRP  30  11.259 -12.224   0.362
  221    HZ2  TRP  30           HZ2      TRP  30  13.304  -7.713   0.839
  222    HZ3  TRP  30           HZ3      TRP  30  10.837 -10.883   2.389
  223    HH2  TRP  30           HH2      TRP  30  11.704  -8.571   2.570
  224    H    CYS  31           H        CYS  31   9.235 -10.999  -2.306
  225    HA   CYS  31           HA       CYS  31   8.687 -12.472   0.215
  226   1HB   CYS  31          2HB       CYS  31   8.774 -10.125   0.451
  227   2HB   CYS  31          1HB       CYS  31   7.641  -9.859  -0.869
  228    H    GLY  32           H        GLY  32   8.002 -14.395  -0.857
  229   1HA   GLY  32          1HA       GLY  32   5.964 -15.007  -2.501
  230   2HA   GLY  32          2HA       GLY  32   6.175 -15.858  -0.965
  231    HA   PRO  33           HA       PRO  33   2.381 -14.332   0.657
  232   1HB   PRO  33          2HB       PRO  33   2.847 -12.579   2.785
  233   2HB   PRO  33          1HB       PRO  33   2.843 -14.363   2.850
  234   1HG   PRO  33          2HG       PRO  33   5.206 -12.520   2.591
  235   2HG   PRO  33          1HG       PRO  33   5.053 -13.977   3.606
  236   1HD   PRO  33          1HD       PRO  33   6.371 -14.060   1.277
  237   2HD   PRO  33          2HD       PRO  33   5.308 -15.416   1.720
  238    H    CYS  34           H        CYS  34   4.636 -11.794  -0.301
  239    HA   CYS  34           HA       CYS  34   2.582  -9.687  -0.498
  240   1HB   CYS  34          2HB       CYS  34   5.334  -9.708  -1.765
  241   2HB   CYS  34          1HB       CYS  34   4.201  -8.390  -1.518
  242    H    ARG  35           HN       ARG  35   4.541 -11.772  -2.578
  243    HA   ARG  35           HA       ARG  35   3.671 -11.109  -5.122
  244   1HB   ARG  35          1HB       ARG  35   5.488 -12.739  -4.252
  245   2HB   ARG  35          2HB       ARG  35   4.224 -13.966  -4.239
  246   1HG   ARG  35          1HG       ARG  35   3.810 -13.439  -6.703
  247   2HG   ARG  35          2HG       ARG  35   5.262 -12.419  -6.643
  248   1HD   ARG  35          1HD       ARG  35   5.053 -15.396  -6.061
  249   2HD   ARG  35          2HD       ARG  35   5.871 -14.655  -7.451
  250    HE   ARG  35           HE       ARG  35   7.244 -13.489  -5.466
  251   1HH1  ARG  35          1HH2      ARG  35   6.448 -16.923  -5.862
  252   2HH1  ARG  35          2HH2      ARG  35   7.670 -17.451  -4.737
  253   1HH2  ARG  35          1HH1      ARG  35   8.746 -14.128  -4.076
  254   2HH2  ARG  35          2HH1      ARG  35   9.048 -15.809  -3.669
  255    H    ILE  36           H        ILE  36   2.297 -13.631  -2.983
  256    HA   ILE  36           HA       ILE  36   0.273 -14.392  -4.860
  257    HB   ILE  36           HB       ILE  36  -0.790 -15.597  -3.020
  258   1HG1  ILE  36          1HG1      ILE  36   1.192 -14.115  -1.251
  259   2HG1  ILE  36          2HG1      ILE  36  -0.571 -13.970  -1.216
  260   1HG2  ILE  36          1HG2      ILE  36   1.250 -16.430  -4.233
  261   2HG2  ILE  36          2HG2      ILE  36   2.257 -15.822  -2.913
  262   3HG2  ILE  36          3HG2      ILE  36   1.071 -17.103  -2.610
  263   1HD1  ILE  36          1HD1      ILE  36   1.032 -16.398  -0.415
  264   2HD1  ILE  36          2HD1      ILE  36   0.060 -15.322   0.609
  265   3HD1  ILE  36          3HD1      ILE  36  -0.747 -16.359  -0.588
  266    H    ILE  37           H        ILE  37   0.064 -11.944  -2.199
  267    HA   ILE  37           HA       ILE  37  -2.765 -11.518  -2.803
  268    HB   ILE  37           HB       ILE  37  -2.669  -9.620  -1.309
  269   1HG1  ILE  37          1HG1      ILE  37   0.293 -10.167  -0.945
  270   2HG1  ILE  37          2HG1      ILE  37  -0.366  -8.800  -1.848
  271   1HG2  ILE  37          1HG2      ILE  37  -1.161 -11.970  -0.083
  272   2HG2  ILE  37          2HG2      ILE  37  -2.885 -12.016  -0.503
  273   3HG2  ILE  37          3HG2      ILE  37  -2.308 -10.876   0.711
  274   1HD1  ILE  37          1HD1      ILE  37   0.228  -8.037   0.339
  275   2HD1  ILE  37          2HD1      ILE  37  -0.698  -9.322   1.126
  276   3HD1  ILE  37          3HD1      ILE  37  -1.543  -8.039   0.224
  277    H    ALA  38           H        ALA  38   0.236 -10.146  -4.033
  278    HA   ALA  38           HA       ALA  38  -0.324  -7.705  -4.906
  279   1HB   ALA  38          1HB       ALA  38   0.994  -9.787  -6.703
  280   2HB   ALA  38          2HB       ALA  38   1.765  -8.928  -5.356
  281   3HB   ALA  38          3HB       ALA  38   1.190  -8.037  -6.771
  282    HA   PRO  39           HA       PRO  39  -2.767  -8.872  -8.899
  283   1HB   PRO  39          2HB       PRO  39  -4.169 -11.400  -8.110
  284   2HB   PRO  39          1HB       PRO  39  -3.461 -10.959  -9.688
  285   1HG   PRO  39          2HG       PRO  39  -2.218 -12.769  -8.069
  286   2HG   PRO  39          1HG       PRO  39  -1.254 -11.523  -8.925
  287   1HD   PRO  39          2HD       PRO  39  -2.348 -11.390  -6.102
  288   2HD   PRO  39          1HD       PRO  39  -0.665 -11.190  -6.601
  289    H    VAL  40           H        VAL  40  -3.901  -9.892  -5.679
  290    HA   VAL  40           HA       VAL  40  -6.609  -8.936  -6.138
  291    HB   VAL  40           HB       VAL  40  -5.462  -9.304  -3.364
  292   1HG1  VAL  40          1HG2      VAL  40  -8.206  -9.858  -4.627
  293   2HG1  VAL  40          2HG2      VAL  40  -7.821  -9.945  -2.906
  294   3HG1  VAL  40          3HG2      VAL  40  -7.808  -8.380  -3.738
  295   1HG2  VAL  40          1HG1      VAL  40  -4.796 -11.306  -4.476
  296   2HG2  VAL  40          2HG1      VAL  40  -6.409 -11.446  -5.252
  297   3HG2  VAL  40          3HG1      VAL  40  -6.233 -11.629  -3.476
  298    H    VAL  41           H        VAL  41  -3.583  -7.806  -4.639
  299    HA   VAL  41           HA       VAL  41  -4.568  -5.485  -3.483
  300    HB   VAL  41           HB       VAL  41  -1.848  -5.928  -4.819
  301   1HG1  VAL  41          1HG1      VAL  41  -0.989  -6.369  -2.617
  302   2HG1  VAL  41          2HG1      VAL  41  -2.414  -7.396  -2.807
  303   3HG1  VAL  41          3HG1      VAL  41  -2.517  -5.917  -1.850
  304   1HG2  VAL  41          1HG2      VAL  41  -2.131  -3.544  -4.675
  305   2HG2  VAL  41          2HG2      VAL  41  -2.681  -3.670  -2.981
  306   3HG2  VAL  41          3HG2      VAL  41  -1.008  -4.057  -3.418
  307    H    ASP  42           HN       ASP  42  -3.601  -6.176  -6.841
  308    HA   ASP  42           HA       ASP  42  -4.193  -3.579  -7.918
  309   1HB   ASP  42          1HB       ASP  42  -4.302  -6.276  -9.324
  310   2HB   ASP  42          2HB       ASP  42  -4.232  -4.695 -10.095
  311    H    GLU  43           HN       GLU  43  -6.163  -6.644  -8.054
  312    HA   GLU  43           HA       GLU  43  -8.287  -5.416  -9.404
  313   1HB   GLU  43          1HB       GLU  43  -9.433  -7.335  -9.194
  314   2HB   GLU  43          2HB       GLU  43  -7.796  -7.937  -8.927
  315   1HG   GLU  43          1HG       GLU  43  -8.357  -7.786  -6.397
  316   2HG   GLU  43          2HG       GLU  43 -10.019  -7.467  -6.868
  317    H    ILE  44           H        ILE  44  -7.940  -5.863  -5.853
  318    HA   ILE  44           HA       ILE  44 -10.460  -4.700  -5.203
  319    HB   ILE  44           HB       ILE  44  -7.859  -5.155  -3.744
  320   1HG1  ILE  44          2HG1      ILE  44  -9.809  -6.799  -4.100
  321   2HG1  ILE  44          1HG1      ILE  44  -9.174  -6.637  -2.457
  322   1HG2  ILE  44          1HG2      ILE  44 -10.054  -3.391  -2.670
  323   2HG2  ILE  44          2HG2      ILE  44  -8.334  -2.985  -2.858
  324   3HG2  ILE  44          3HG2      ILE  44  -8.827  -4.190  -1.661
  325   1HD1  ILE  44          1HD1      ILE  44 -11.664  -6.760  -2.576
  326   2HD1  ILE  44          2HD1      ILE  44 -11.110  -5.266  -1.810
  327   3HD1  ILE  44          3HD1      ILE  44 -11.701  -5.238  -3.473
  328    H    ALA  45           H        ALA  45  -7.337  -3.142  -5.971
  329    HA   ALA  45           HA       ALA  45  -8.164  -0.488  -5.275
  330   1HB   ALA  45          1HB       ALA  45  -5.828  -1.419  -5.872
  331   2HB   ALA  45          2HB       ALA  45  -6.288  -1.155  -7.568
  332   3HB   ALA  45          3HB       ALA  45  -6.279   0.204  -6.431
  333    H    GLY  46           H        GLY  46  -8.404  -2.481  -8.237
  334   1HA   GLY  46          2HA       GLY  46  -9.612  -0.627  -9.999
  335   2HA   GLY  46          1HA       GLY  46  -9.825  -2.389 -10.026
  336    H    GLU  47           HN       GLU  47 -11.131  -2.983  -7.696
  337    HA   GLU  47           HA       GLU  47 -13.831  -2.362  -8.139
  338   1HB   GLU  47          1HB       GLU  47 -12.415  -3.167  -5.556
  339   2HB   GLU  47          2HB       GLU  47 -14.150  -3.061  -5.777
  340   1HG   GLU  47          1HG       GLU  47 -14.112  -4.760  -7.509
  341   2HG   GLU  47          2HG       GLU  47 -12.344  -4.894  -7.408
  342    H    TYR  48           H        TYR  48 -11.618  -0.943  -5.737
  343    HA   TYR  48           HA       TYR  48 -13.583   1.152  -5.060
  344   1HB   TYR  48          2HB       TYR  48 -10.726   0.646  -4.152
  345   2HB   TYR  48          1HB       TYR  48 -11.823   1.835  -3.458
  346    HD1  TYR  48           HD1      TYR  48 -10.397  -1.059  -2.526
  347    HD2  TYR  48           HD2      TYR  48 -14.411   0.377  -3.220
  348    HE1  TYR  48           HE1      TYR  48 -11.282  -2.600  -0.796
  349    HE2  TYR  48           HE2      TYR  48 -15.254  -1.116  -1.476
  350    HH   TYR  48           HH       TYR  48 -14.529  -2.217   0.520
  351    H    LYS  49           HN       LYS  49 -13.293   1.371  -7.569
  352    HA   LYS  49           HA       LYS  49 -11.430   2.721  -8.936
  353   1HB   LYS  49          2HB       LYS  49 -13.517   1.795  -9.766
  354   2HB   LYS  49          1HB       LYS  49 -14.443   3.137  -9.140
  355   1HG   LYS  49          2HG       LYS  49 -12.161   3.359 -11.176
  356   2HG   LYS  49          1HG       LYS  49 -13.839   3.103 -11.628
  357   1HD   LYS  49          1HD       LYS  49 -12.781   5.612 -10.243
  358   2HD   LYS  49          2HD       LYS  49 -13.154   5.419 -11.942
  359   1HE   LYS  49          2HE       LYS  49 -15.518   5.007 -11.478
  360   2HE   LYS  49          1HE       LYS  49 -15.242   5.121  -9.736
  361   1HZ   LYS  49          1HZ       LYS  49 -16.080   7.142 -10.645
  362   2HZ   LYS  49          2HZ       LYS  49 -14.782   7.290 -11.646
  363   3HZ   LYS  49          3HZ       LYS  49 -14.585   7.379 -10.011
  364    H    ASP  50           HN       ASP  50 -14.189   4.540  -7.684
  365    HA   ASP  50           HA       ASP  50 -13.188   7.052  -8.238
  366   1HB   ASP  50          2HB       ASP  50 -15.574   6.315  -7.664
  367   2HB   ASP  50          1HB       ASP  50 -15.138   6.453  -5.968
  368    H    LYS  51           HN       LYS  51 -13.310   5.640  -4.980
  369    HA   LYS  51           HA       LYS  51 -12.243   7.993  -3.814
  370   1HB   LYS  51          1HB       LYS  51 -11.970   6.526  -1.774
  371   2HB   LYS  51          2HB       LYS  51 -13.593   6.667  -2.352
  372   1HG   LYS  51          1HG       LYS  51 -13.701   4.492  -3.261
  373   2HG   LYS  51          2HG       LYS  51 -11.973   4.215  -3.005
  374   1HD   LYS  51          1HD       LYS  51 -12.296   4.547  -0.556
  375   2HD   LYS  51          2HD       LYS  51 -14.029   4.809  -0.828
  376   1HE   LYS  51          1HE       LYS  51 -14.185   2.472  -1.748
  377   2HE   LYS  51          2HE       LYS  51 -12.468   2.240  -1.337
  378   1HZ   LYS  51          1HZ       LYS  51 -13.861   1.397   0.390
  379   2HZ   LYS  51          2HZ       LYS  51 -14.609   2.851   0.560
  380   3HZ   LYS  51          3HZ       LYS  51 -13.013   2.691   0.933
  381    H    LEU  52           H        LEU  52 -10.576   4.931  -4.589
  382    HA   LEU  52           HA       LEU  52  -8.325   5.949  -2.824
  383   1HB   LEU  52          1HB       LEU  52  -9.993   4.572  -1.821
  384   2HB   LEU  52          2HB       LEU  52  -9.830   3.364  -3.113
  385    HG   LEU  52           HG       LEU  52  -7.671   2.694  -2.283
  386   1HD1  LEU  52          1HD2      LEU  52  -6.878   4.804  -1.229
  387   2HD1  LEU  52          2HD2      LEU  52  -8.141   4.612   0.028
  388   3HD1  LEU  52          3HD2      LEU  52  -6.828   3.436  -0.108
  389   1HD2  LEU  52          1HD1      LEU  52  -9.970   3.032  -0.232
  390   2HD2  LEU  52          2HD1      LEU  52  -9.933   1.806  -1.496
  391   3HD2  LEU  52          3HD1      LEU  52  -8.763   1.736  -0.155
  392    H    LYS  53           HN       LYS  53  -6.301   5.807  -3.486
  393    HA   LYS  53           HA       LYS  53  -5.707   4.442  -6.075
  394   1HB   LYS  53          1HB       LYS  53  -4.836   6.734  -5.603
  395   2HB   LYS  53          2HB       LYS  53  -3.969   6.096  -4.240
  396   1HG   LYS  53          2HG       LYS  53  -2.486   6.414  -6.149
  397   2HG   LYS  53          1HG       LYS  53  -2.517   4.760  -5.605
  398   1HD   LYS  53          1HD       LYS  53  -2.479   4.757  -7.996
  399   2HD   LYS  53          2HD       LYS  53  -4.036   4.130  -7.510
  400   1HE   LYS  53          1HE       LYS  53  -4.322   5.653  -9.372
  401   2HE   LYS  53          2HE       LYS  53  -5.097   6.345  -7.938
  402   1HZ   LYS  53          1HZ       LYS  53  -2.437   7.070  -8.959
  403   2HZ   LYS  53          2HZ       LYS  53  -3.184   7.741  -7.652
  404   3HZ   LYS  53          3HZ       LYS  53  -3.815   7.951  -9.157
  405    H    CYS  54           H        CYS  54  -3.765   2.945  -6.018
  406    HA   CYS  54           HA       CYS  54  -3.227   1.759  -3.437
  407   1HB   CYS  54          1HB       CYS  54  -5.147   0.406  -4.309
  408   2HB   CYS  54          2HB       CYS  54  -4.193   0.168  -5.812
  409    HG   CYS  54           HG       CYS  54  -4.012  -2.026  -4.605
  410    H    VAL  55           H        VAL  55  -1.158   0.730  -3.457
  411    HA   VAL  55           HA       VAL  55   0.330   0.852  -5.981
  412    HB   VAL  55           HB       VAL  55   1.911   2.339  -4.052
  413   1HG1  VAL  55          1HG1      VAL  55  -0.683   3.770  -4.713
  414   2HG1  VAL  55          2HG1      VAL  55   0.723   4.415  -3.882
  415   3HG1  VAL  55          3HG1      VAL  55  -0.242   3.152  -3.103
  416   1HG2  VAL  55          1HG2      VAL  55   1.988   3.969  -5.900
  417   2HG2  VAL  55          2HG2      VAL  55   2.246   2.318  -6.497
  418   3HG2  VAL  55          3HG2      VAL  55   0.676   3.116  -6.733
  419    H    LYS  56           HN       LYS  56   2.602   0.223  -5.703
  420    HA   LYS  56           HA       LYS  56   3.053  -1.597  -3.408
  421   1HB   LYS  56          2HB       LYS  56   2.688  -2.203  -6.296
  422   2HB   LYS  56          1HB       LYS  56   4.021  -3.041  -5.506
  423   1HG   LYS  56          2HG       LYS  56   2.584  -3.892  -3.751
  424   2HG   LYS  56          1HG       LYS  56   1.192  -2.992  -4.374
  425   1HD   LYS  56          2HD       LYS  56   2.667  -5.167  -5.925
  426   2HD   LYS  56          1HD       LYS  56   1.238  -5.443  -4.909
  427   1HE   LYS  56          1HE       LYS  56  -0.045  -3.776  -6.303
  428   2HE   LYS  56          2HE       LYS  56   1.347  -3.664  -7.392
  429   1HZ   LYS  56          1HZ       LYS  56  -0.216  -6.083  -6.821
  430   2HZ   LYS  56          2HZ       LYS  56  -0.251  -5.177  -8.187
  431   3HZ   LYS  56          3HZ       LYS  56   1.116  -6.014  -7.802
  432    H    LEU  57           H        LEU  57   4.850  -0.929  -2.454
  433    HA   LEU  57           HA       LEU  57   6.953   0.491  -4.031
  434   1HB   LEU  57          1HB       LEU  57   6.107   1.760  -2.152
  435   2HB   LEU  57          2HB       LEU  57   6.376   0.398  -1.046
  436    HG   LEU  57           HG       LEU  57   8.804   0.661  -1.316
  437   1HD1  LEU  57          1HD1      LEU  57   9.040   2.724  -0.151
  438   2HD1  LEU  57          2HD1      LEU  57   7.613   3.426  -0.933
  439   3HD1  LEU  57          3HD1      LEU  57   7.412   2.138   0.259
  440   1HD2  LEU  57          1HD2      LEU  57   7.965   2.766  -3.361
  441   2HD2  LEU  57          2HD2      LEU  57   9.551   2.789  -2.599
  442   3HD2  LEU  57          3HD2      LEU  57   9.089   1.397  -3.588
  443    H    ASN  58           H        ASN  58   8.709  -0.627  -4.608
  444    HA   ASN  58           HA       ASN  58   9.159  -3.303  -3.521
  445   1HB   ASN  58          1HB       ASN  58   9.639  -2.747  -5.872
  446   2HB   ASN  58          2HB       ASN  58  10.920  -1.652  -5.357
  447   1HD2  ASN  58          2HD2      ASN  58  10.378  -4.763  -6.450
  448   2HD2  ASN  58          1HD2      ASN  58  11.798  -5.531  -5.757
  449    H    THR  59           H        THR  59   9.913  -3.567  -1.587
  450    HA   THR  59           HA       THR  59  11.055  -1.473   0.011
  451    HB   THR  59           HB       THR  59  10.928  -4.475   0.545
  452    HG1  THR  59           HG1      THR  59   8.891  -3.757   0.006
  453   1HG2  THR  59          1HG2      THR  59  12.250  -3.151   2.223
  454   2HG2  THR  59          2HG2      THR  59  10.748  -3.807   2.899
  455   3HG2  THR  59          3HG2      THR  59  10.832  -2.099   2.444
  456    H    ASP  60           HN       ASP  60  12.420  -4.127  -1.869
  457    HA   ASP  60           HA       ASP  60  15.042  -4.176  -0.663
  458   1HB   ASP  60          1HB       ASP  60  13.721  -5.912  -2.129
  459   2HB   ASP  60          2HB       ASP  60  14.349  -5.015  -3.505
  460    H    GLU  61           HN       GLU  61  13.509  -2.632  -3.405
  461    HA   GLU  61           HA       GLU  61  15.831  -1.215  -4.405
  462   1HB   GLU  61          2HB       GLU  61  13.779  -2.052  -5.703
  463   2HB   GLU  61          1HB       GLU  61  12.889  -0.710  -4.946
  464   1HG   GLU  61          2HG       GLU  61  14.621   0.863  -5.975
  465   2HG   GLU  61          1HG       GLU  61  15.272  -0.545  -6.816
  466    H    SER  62           H        SER  62  13.125  -0.438  -2.243
  467    HA   SER  62           HA       SER  62  14.095   2.370  -1.880
  468   1HB   SER  62          2HB       SER  62  11.973   2.127  -3.076
  469   2HB   SER  62          1HB       SER  62  11.278   1.268  -1.684
  470    HG   SER  62           HG       SER  62  11.704   3.073  -0.416
  471    HA   PRO  63           HA       PRO  63  14.185  -0.139   2.181
  472   1HB   PRO  63          1HB       PRO  63  16.849   0.191   2.759
  473   2HB   PRO  63          2HB       PRO  63  16.209  -1.182   1.799
  474   1HG   PRO  63          1HG       PRO  63  17.427   1.406   0.785
  475   2HG   PRO  63          2HG       PRO  63  17.798  -0.264   0.259
  476   1HD   PRO  63          1HD       PRO  63  16.070   1.268  -1.146
  477   2HD   PRO  63          2HD       PRO  63  15.708  -0.458  -0.867
  478    H    ASN  64           H        ASN  64  15.401   2.877   0.936
  479    HA   ASN  64           HA       ASN  64  15.995   4.347   3.276
  480   1HB   ASN  64          1HB       ASN  64  14.719   5.295   0.671
  481   2HB   ASN  64          2HB       ASN  64  15.353   6.367   1.929
  482   1HD2  ASN  64          2HD2      ASN  64  16.265   6.442  -0.741
  483   2HD2  ASN  64          1HD2      ASN  64  17.948   5.909  -0.734
  484    H    VAL  65           H        VAL  65  12.938   4.602   1.483
  485    HA   VAL  65           HA       VAL  65  11.422   5.910   3.438
  486    HB   VAL  65           HB       VAL  65  10.554   3.915   1.292
  487   1HG1  VAL  65          1HG2      VAL  65   8.936   6.077   2.684
  488   2HG1  VAL  65          2HG2      VAL  65   8.760   4.334   2.971
  489   3HG1  VAL  65          3HG2      VAL  65   8.383   4.997   1.379
  490   1HG2  VAL  65          1HG1      VAL  65  11.797   5.732   0.282
  491   2HG2  VAL  65          2HG1      VAL  65  10.945   6.938   1.266
  492   3HG2  VAL  65          3HG1      VAL  65  10.076   6.036   0.007
  493    H    ALA  66           H        ALA  66  11.635   2.465   2.689
  494    HA   ALA  66           HA       ALA  66   9.991   1.377   4.613
  495   1HB   ALA  66          1HB       ALA  66  12.697   0.233   3.813
  496   2HB   ALA  66          2HB       ALA  66  11.234   0.144   2.810
  497   3HB   ALA  66          3HB       ALA  66  11.301  -0.671   4.387
  498    H    SER  67           H        SER  67  13.457   2.260   5.075
  499    HA   SER  67           HA       SER  67  13.558   1.449   7.828
  500   1HB   SER  67          2HB       SER  67  15.293   3.459   6.317
  501   2HB   SER  67          1HB       SER  67  15.659   2.715   7.884
  502    HG   SER  67           HG       SER  67  15.356   1.402   5.383
  503    H    GLU  68           HN       GLU  68  13.020   4.585   6.226
  504    HA   GLU  68           HA       GLU  68  12.908   6.223   8.543
  505   1HB   GLU  68          2HB       GLU  68  11.466   6.446   5.867
  506   2HB   GLU  68          1HB       GLU  68  11.459   7.713   7.094
  507   1HG   GLU  68          1HG       GLU  68  13.814   8.068   6.927
  508   2HG   GLU  68          2HG       GLU  68  14.070   6.599   5.986
  509    H    TYR  69           H        TYR  69  10.275   4.421   6.898
  510    HA   TYR  69           HA       TYR  69   8.302   5.249   8.905
  511   1HB   TYR  69          2HB       TYR  69   8.308   3.474   6.454
  512   2HB   TYR  69          1HB       TYR  69   7.009   3.361   7.624
  513    HD1  TYR  69           HD1      TYR  69   5.513   5.295   8.095
  514    HD2  TYR  69           HD2      TYR  69   8.612   5.561   5.116
  515    HE1  TYR  69           HE1      TYR  69   4.729   7.560   7.478
  516    HE2  TYR  69           HE2      TYR  69   7.805   7.815   4.479
  517    HH   TYR  69           HH       TYR  69   5.249   9.493   6.293
  518    H    GLY  70           H        GLY  70  10.358   2.406   8.402
  519   1HA   GLY  70          2HA       GLY  70  11.132   1.106  10.220
  520   2HA   GLY  70          1HA       GLY  70   9.718   1.536  11.185
  521    H    ILE  71           H        ILE  71  10.018   0.283   7.846
  522    HA   ILE  71           HA       ILE  71   7.936  -1.720   8.259
  523    HB   ILE  71           HB       ILE  71   9.897  -1.328   5.971
  524   1HG1  ILE  71          1HG1      ILE  71   8.567   0.741   6.362
  525   2HG1  ILE  71          2HG1      ILE  71   8.228  -0.066   4.844
  526   1HG2  ILE  71          1HG2      ILE  71   7.264  -2.859   6.179
  527   2HG2  ILE  71          2HG2      ILE  71   8.107  -2.502   4.654
  528   3HG2  ILE  71          3HG2      ILE  71   8.875  -3.526   5.873
  529   1HD1  ILE  71          1HD1      ILE  71   6.116  -0.910   5.690
  530   2HD1  ILE  71          2HD1      ILE  71   6.465  -0.248   7.313
  531   3HD1  ILE  71          3HD1      ILE  71   6.217   0.836   5.935
  532    H    ARG  72           HN       ARG  72   8.760  -2.871  10.016
  533    HA   ARG  72           HA       ARG  72  11.360  -4.056  10.050
  534   1HB   ARG  72          2HB       ARG  72   9.956  -3.444  12.015
  535   2HB   ARG  72          1HB       ARG  72   8.862  -4.789  11.642
  536   1HG   ARG  72          2HG       ARG  72  10.675  -6.407  12.044
  537   2HG   ARG  72          1HG       ARG  72  11.836  -5.085  12.263
  538   1HD   ARG  72          2HD       ARG  72  10.502  -4.306  14.259
  539   2HD   ARG  72          1HD       ARG  72   9.370  -5.627  13.978
  540    HE   ARG  72           HE       ARG  72  10.796  -7.122  14.928
  541   1HH1  ARG  72          2HH2      ARG  72  12.629  -4.196  14.197
  542   2HH1  ARG  72          1HH2      ARG  72  14.046  -4.684  15.089
  543   1HH2  ARG  72          2HH1      ARG  72  12.636  -7.787  16.079
  544   2HH2  ARG  72          1HH1      ARG  72  14.050  -6.774  16.168
  545    H    SER  73           H        SER  73   8.395  -5.129   8.505
  546    HA   SER  73           HA       SER  73   9.732  -7.425   7.395
  547   1HB   SER  73          1HB       SER  73   7.218  -7.872   9.077
  548   2HB   SER  73          2HB       SER  73   8.075  -9.089   8.120
  549    HG   SER  73           HG       SER  73   9.898  -8.060   9.686
  550    H    ILE  74           H        ILE  74   8.132  -8.410   5.719
  551    HA   ILE  74           HA       ILE  74   6.136  -6.424   4.849
  552    HB   ILE  74           HB       ILE  74   6.887  -6.814   2.484
  553   1HG1  ILE  74          1HG1      ILE  74   9.514  -7.756   3.636
  554   2HG1  ILE  74          2HG1      ILE  74   8.292  -8.821   2.914
  555   1HG2  ILE  74          1HG2      ILE  74   7.328  -4.755   3.876
  556   2HG2  ILE  74          2HG2      ILE  74   8.922  -5.431   4.281
  557   3HG2  ILE  74          3HG2      ILE  74   8.510  -5.024   2.604
  558   1HD1  ILE  74          1HD1      ILE  74   9.772  -8.252   1.136
  559   2HD1  ILE  74          2HD1      ILE  74   8.313  -7.328   0.850
  560   3HD1  ILE  74          3HD1      ILE  74   9.755  -6.535   1.531
  561    HA   PRO  75           HA       PRO  75   4.678  -6.658   2.650
  562   1HB   PRO  75          2HB       PRO  75   1.974  -6.919   2.667
  563   2HB   PRO  75          1HB       PRO  75   3.008  -7.880   1.589
  564   1HG   PRO  75          1HG       PRO  75   1.932  -8.651   4.304
  565   2HG   PRO  75          2HG       PRO  75   1.795  -9.599   2.787
  566   1HD   PRO  75          1HD       PRO  75   3.766 -10.126   4.596
  567   2HD   PRO  75          2HD       PRO  75   4.121 -10.158   2.850
  568    H    THR  76           H        THR  76   3.353  -4.773   3.181
  569    HA   THR  76           HA       THR  76   2.262  -4.477   5.802
  570    HB   THR  76           HB       THR  76   4.924  -3.156   5.162
  571    HG1  THR  76           HG1      THR  76   4.683  -5.143   6.448
  572   1HG2  THR  76          1HG2      THR  76   4.512  -1.777   7.254
  573   2HG2  THR  76          2HG2      THR  76   2.802  -2.217   7.142
  574   3HG2  THR  76          3HG2      THR  76   3.566  -1.278   5.841
  575    H    ILE  77           H        ILE  77   0.486  -3.362   5.322
  576    HA   ILE  77           HA       ILE  77   0.388  -1.786   2.785
  577    HB   ILE  77           HB       ILE  77  -1.818  -3.186   4.364
  578   1HG1  ILE  77          2HG1      ILE  77  -2.127  -4.328   2.088
  579   2HG1  ILE  77          1HG1      ILE  77  -0.526  -3.734   1.655
  580   1HG2  ILE  77          1HG2      ILE  77  -2.635  -1.053   3.421
  581   2HG2  ILE  77          2HG2      ILE  77  -1.952  -1.495   1.841
  582   3HG2  ILE  77          3HG2      ILE  77  -3.298  -2.425   2.546
  583   1HD1  ILE  77          1HD1      ILE  77  -0.655  -6.121   2.479
  584   2HD1  ILE  77          2HD1      ILE  77   0.490  -5.137   3.381
  585   3HD1  ILE  77          3HD1      ILE  77  -1.104  -5.500   4.081
  586    H    MET  78           H        MET  78   0.502   0.355   3.123
  587    HA   MET  78           HA       MET  78  -0.559   1.476   5.690
  588   1HB   MET  78          1HB       MET  78   1.698   2.426   3.917
  589   2HB   MET  78          2HB       MET  78   0.958   3.391   5.219
  590   1HG   MET  78          2HG       MET  78   1.530   1.557   6.820
  591   2HG   MET  78          1HG       MET  78   2.444   0.775   5.528
  592   1HE   MET  78          1HE       MET  78   4.134   0.810   7.688
  593   2HE   MET  78          2HE       MET  78   3.283   2.050   8.644
  594   3HE   MET  78          3HE       MET  78   4.992   2.273   8.225
  595    H    VAL  79           H        VAL  79  -2.061   3.018   5.522
  596    HA   VAL  79           HA       VAL  79  -3.014   3.707   2.762
  597    HB   VAL  79           HB       VAL  79  -4.565   3.838   5.357
  598   1HG1  VAL  79          1HG1      VAL  79  -5.863   1.939   4.423
  599   2HG1  VAL  79          2HG1      VAL  79  -4.175   1.466   4.652
  600   3HG1  VAL  79          3HG1      VAL  79  -4.766   1.865   3.030
  601   1HG2  VAL  79          1HG2      VAL  79  -5.271   5.531   3.717
  602   2HG2  VAL  79          2HG2      VAL  79  -5.369   4.290   2.452
  603   3HG2  VAL  79          3HG2      VAL  79  -6.483   4.249   3.835
  604    H    PHE  80           H        PHE  80  -2.299   5.683   2.179
  605    HA   PHE  80           HA       PHE  80  -1.731   7.764   4.268
  606   1HB   PHE  80          1HB       PHE  80  -0.520   7.170   1.548
  607   2HB   PHE  80          2HB       PHE  80  -0.336   8.732   2.318
  608    HD1  PHE  80           HD1      PHE  80   1.372   9.160   3.869
  609    HD2  PHE  80           HD2      PHE  80   0.402   5.095   2.833
  610    HE1  PHE  80           HE1      PHE  80   3.510   8.406   4.844
  611    HE2  PHE  80           HE2      PHE  80   2.658   4.377   3.631
  612    HZ   PHE  80           HZ       PHE  80   4.146   5.988   4.752
  613    H    LYS  81           HN       LYS  81  -2.180   9.968   3.600
  614    HA   LYS  81           HA       LYS  81  -3.580  10.549   1.147
  615   1HB   LYS  81          2HB       LYS  81  -5.700  11.123   1.915
  616   2HB   LYS  81          1HB       LYS  81  -5.427   9.547   2.645
  617   1HG   LYS  81          1HG       LYS  81  -5.331  12.267   4.011
  618   2HG   LYS  81          2HG       LYS  81  -6.536  10.992   4.192
  619   1HD   LYS  81          1HD       LYS  81  -4.670   9.491   5.072
  620   2HD   LYS  81          2HD       LYS  81  -3.652  10.926   5.182
  621   1HE   LYS  81          1HE       LYS  81  -6.248  10.460   6.669
  622   2HE   LYS  81          2HE       LYS  81  -4.605  10.557   7.335
  623   1HZ   LYS  81          1HZ       LYS  81  -5.756  12.588   7.661
  624   2HZ   LYS  81          2HZ       LYS  81  -4.500  12.827   6.620
  625   3HZ   LYS  81          3HZ       LYS  81  -6.045  12.760   6.049
  626    H    GLY  82           H        GLY  82  -3.562  12.942   0.835
  627   1HA   GLY  82          2HA       GLY  82  -2.873  15.087   1.269
  628   2HA   GLY  82          1HA       GLY  82  -3.603  14.748   2.859
  629    H    GLY  83           H        GLY  83  -0.519  13.426   1.490
  630   1HA   GLY  83          2HA       GLY  83   1.651  13.766   2.161
  631   2HA   GLY  83          1HA       GLY  83   1.126  15.166   3.081
  632    H    LYS  84           HN       LYS  84  -0.731  12.548   4.237
  633    HA   LYS  84           HA       LYS  84   1.314  11.885   6.317
  634   1HB   LYS  84          2HB       LYS  84  -1.620  12.513   6.770
  635   2HB   LYS  84          1HB       LYS  84  -0.437  12.112   8.014
  636   1HG   LYS  84          2HG       LYS  84  -0.367  14.625   6.276
  637   2HG   LYS  84          1HG       LYS  84  -0.991  14.514   7.921
  638   1HD   LYS  84          1HD       LYS  84   1.231  13.897   8.792
  639   2HD   LYS  84          2HD       LYS  84   1.902  13.864   7.160
  640   1HE   LYS  84          2HE       LYS  84   2.506  15.950   8.251
  641   2HE   LYS  84          1HE       LYS  84   1.466  16.252   6.851
  642   1HZ   LYS  84          1HZ       LYS  84   0.574  16.193   9.652
  643   2HZ   LYS  84          2HZ       LYS  84  -0.372  16.522   8.342
  644   3HZ   LYS  84          3HZ       LYS  84   0.843  17.551   8.757
  645    H    LYS  85           HN       LYS  85   0.805  10.076   7.579
  646    HA   LYS  85           HA       LYS  85  -0.209   7.788   5.999
  647   1HB   LYS  85          2HB       LYS  85   2.098   7.821   7.093
  648   2HB   LYS  85          1HB       LYS  85   1.281   7.868   8.647
  649   1HG   LYS  85          1HG       LYS  85   0.055   5.673   7.329
  650   2HG   LYS  85          2HG       LYS  85   1.702   5.657   6.726
  651   1HD   LYS  85          2HD       LYS  85   1.887   4.321   8.579
  652   2HD   LYS  85          1HD       LYS  85   2.403   5.855   9.266
  653   1HE   LYS  85          1HE       LYS  85  -0.437   4.689   9.428
  654   2HE   LYS  85          2HE       LYS  85   0.786   4.520  10.688
  655   1HZ   LYS  85          1HZ       LYS  85  -0.750   6.265  11.140
  656   2HZ   LYS  85          2HZ       LYS  85   0.773   6.877  10.966
  657   3HZ   LYS  85          3HZ       LYS  85  -0.344   7.071   9.772
  658    H    CYS  86           H        CYS  86  -2.056   6.672   6.702
  659    HA   CYS  86           HA       CYS  86  -3.438   7.662   9.172
  660   1HB   CYS  86          1HB       CYS  86  -4.628   8.282   7.171
  661   2HB   CYS  86          2HB       CYS  86  -4.613   6.646   6.541
  662    HG   CYS  86           HG       CYS  86  -5.809   7.718   9.444
  663    H    GLU  87           HN       GLU  87  -4.028   4.774   7.157
  664    HA   GLU  87           HA       GLU  87  -3.960   3.136   9.624
  665   1HB   GLU  87          1HB       GLU  87  -4.680   2.175   6.853
  666   2HB   GLU  87          2HB       GLU  87  -5.171   1.502   8.396
  667   1HG   GLU  87          2HG       GLU  87  -6.091   4.229   7.337
  668   2HG   GLU  87          1HG       GLU  87  -6.956   2.737   7.140
  669    H    THR  88           H        THR  88  -2.978   0.955   9.531
  670    HA   THR  88           HA       THR  88  -0.801   0.440   7.661
  671    HB   THR  88           HB       THR  88  -0.304   1.167  10.573
  672    HG1  THR  88           HG1      THR  88  -0.183   2.584   8.430
  673   1HG2  THR  88          1HG2      THR  88   2.083   0.558  10.124
  674   2HG2  THR  88          2HG2      THR  88   1.579  -0.209   8.600
  675   3HG2  THR  88          3HG2      THR  88   1.014  -0.842  10.165
  676    H    ILE  89           H        ILE  89  -0.941  -1.680   7.281
  677    HA   ILE  89           HA       ILE  89  -1.661  -3.584   9.458
  678    HB   ILE  89           HB       ILE  89  -1.975  -4.069   6.470
  679   1HG1  ILE  89          1HG1      ILE  89  -4.071  -2.973   8.388
  680   2HG1  ILE  89          2HG1      ILE  89  -3.311  -2.120   7.050
  681   1HG2  ILE  89          1HG2      ILE  89  -3.281  -5.362   8.910
  682   2HG2  ILE  89          2HG2      ILE  89  -1.884  -6.026   8.038
  683   3HG2  ILE  89          3HG2      ILE  89  -3.438  -5.893   7.223
  684   1HD1  ILE  89          1HD1      ILE  89  -5.452  -2.809   6.280
  685   2HD1  ILE  89          2HD1      ILE  89  -4.201  -3.733   5.426
  686   3HD1  ILE  89          3HD1      ILE  89  -5.149  -4.499   6.729
  687    H    ILE  90           H        ILE  90  -0.145  -5.228   9.658
  688    HA   ILE  90           HA       ILE  90   2.310  -5.173   7.931
  689    HB   ILE  90           HB       ILE  90   2.143  -5.149  10.978
  690   1HG1  ILE  90          2HG1      ILE  90   3.651  -3.246   9.138
  691   2HG1  ILE  90          1HG1      ILE  90   2.003  -2.929   9.689
  692   1HG2  ILE  90          1HG2      ILE  90   4.573  -5.575   9.172
  693   2HG2  ILE  90          2HG2      ILE  90   4.657  -5.273  10.915
  694   3HG2  ILE  90          3HG2      ILE  90   3.901  -6.740  10.334
  695   1HD1  ILE  90          1HD1      ILE  90   2.771  -3.036  12.053
  696   2HD1  ILE  90          2HD1      ILE  90   3.491  -1.722  11.104
  697   3HD1  ILE  90          3HD1      ILE  90   4.449  -3.159  11.472
  698    H    GLY  91           H        GLY  91   3.170  -7.142   7.450
  699   1HA   GLY  91          2HA       GLY  91   3.738  -9.361   7.887
  700   2HA   GLY  91          1HA       GLY  91   2.453  -9.509   9.093
  701    H    ALA  92           H        ALA  92   2.773 -11.500   7.309
  702    HA   ALA  92           HA       ALA  92   1.323 -11.265   4.854
  703   1HB   ALA  92          1HB       ALA  92   3.000 -13.028   5.300
  704   2HB   ALA  92          2HB       ALA  92   1.423 -13.731   4.875
  705   3HB   ALA  92          3HB       ALA  92   1.957 -13.709   6.568
  706    H    VAL  93           H        VAL  93  -0.838 -11.385   4.440
  707    HA   VAL  93           HA       VAL  93  -2.673 -12.631   6.327
  708    HB   VAL  93           HB       VAL  93  -3.924 -10.259   5.302
  709   1HG1  VAL  93          1HG1      VAL  93  -1.575  -9.562   7.120
  710   2HG1  VAL  93          2HG1      VAL  93  -1.661  -9.149   5.387
  711   3HG1  VAL  93          3HG1      VAL  93  -2.822  -8.455   6.525
  712   1HG2  VAL  93          1HG2      VAL  93  -3.413 -11.002   8.148
  713   2HG2  VAL  93          2HG2      VAL  93  -4.782 -11.512   7.129
  714   3HG2  VAL  93          3HG2      VAL  93  -4.575  -9.800   7.519
  715    HA   PRO  94           HA       PRO  94  -4.322 -13.337   2.153
  716   1HB   PRO  94          1HB       PRO  94  -7.046 -13.685   3.172
  717   2HB   PRO  94          2HB       PRO  94  -5.985 -14.889   2.404
  718   1HG   PRO  94          2HG       PRO  94  -6.622 -15.001   5.124
  719   2HG   PRO  94          1HG       PRO  94  -5.028 -15.515   4.494
  720   1HD   PRO  94          2HD       PRO  94  -5.785 -12.805   5.606
  721   2HD   PRO  94          1HD       PRO  94  -4.405 -13.798   6.097
  722    H    LYS  95           HN       LYS  95  -5.250 -11.807   0.742
  723    HA   LYS  95           HA       LYS  95  -5.524  -9.231   1.763
  724   1HB   LYS  95          2HB       LYS  95  -4.990  -9.806  -0.667
  725   2HB   LYS  95          1HB       LYS  95  -6.673 -10.303  -0.869
  726   1HG   LYS  95          1HG       LYS  95  -6.616  -8.144  -1.785
  727   2HG   LYS  95          2HG       LYS  95  -7.308  -7.874  -0.204
  728   1HD   LYS  95          2HD       LYS  95  -4.965  -7.183   0.568
  729   2HD   LYS  95          1HD       LYS  95  -4.450  -7.355  -1.120
  730   1HE   LYS  95          1HE       LYS  95  -6.258  -5.720  -1.790
  731   2HE   LYS  95          2HE       LYS  95  -6.672  -5.522  -0.081
  732   1HZ   LYS  95          1HZ       LYS  95  -5.259  -3.791  -0.802
  733   2HZ   LYS  95          2HZ       LYS  95  -4.429  -4.719   0.276
  734   3HZ   LYS  95          3HZ       LYS  95  -4.110  -4.838  -1.335
  735    H    ALA  96           H        ALA  96  -8.066 -11.654   1.201
  736    HA   ALA  96           HA       ALA  96 -10.390 -10.178   1.495
  737   1HB   ALA  96          1HB       ALA  96  -9.700 -12.796   2.907
  738   2HB   ALA  96          2HB       ALA  96 -10.317 -12.634   1.246
  739   3HB   ALA  96          3HB       ALA  96 -11.336 -12.165   2.620
  740    H    THR  97           H        THR  97  -7.990 -10.845   4.063
  741    HA   THR  97           HA       THR  97  -9.683  -9.846   6.242
  742    HB   THR  97           HB       THR  97  -6.678 -10.306   6.092
  743    HG1  THR  97           HG1      THR  97  -8.056 -12.155   5.687
  744   1HG2  THR  97          1HG2      THR  97  -8.587 -10.060   8.464
  745   2HG2  THR  97          2HG2      THR  97  -7.305  -8.904   8.031
  746   3HG2  THR  97          3HG2      THR  97  -6.883 -10.540   8.565
  747    H    ILE  98           H        ILE  98  -7.173  -8.608   4.032
  748    HA   ILE  98           HA       ILE  98  -6.853  -6.037   5.314
  749    HB   ILE  98           HB       ILE  98  -6.130  -7.139   2.565
  750   1HG1  ILE  98          1HG1      ILE  98  -4.397  -6.212   4.889
  751   2HG1  ILE  98          2HG1      ILE  98  -4.924  -7.886   4.694
  752   1HG2  ILE  98          1HG2      ILE  98  -5.691  -4.347   3.727
  753   2HG2  ILE  98          2HG2      ILE  98  -6.589  -4.750   2.256
  754   3HG2  ILE  98          3HG2      ILE  98  -4.845  -4.968   2.302
  755   1HD1  ILE  98          1HD1      ILE  98  -2.662  -7.576   3.847
  756   2HD1  ILE  98          2HD1      ILE  98  -3.221  -6.387   2.668
  757   3HD1  ILE  98          3HD1      ILE  98  -3.756  -8.073   2.553
  758    H    VAL  99           H        VAL  99  -8.922  -7.289   2.613
  759    HA   VAL  99           HA       VAL  99 -10.182  -4.858   1.964
  760    HB   VAL  99           HB       VAL  99 -11.430  -7.655   2.007
  761   1HG1  VAL  99          1HG1      VAL  99 -12.934  -6.702   0.258
  762   2HG1  VAL  99          2HG1      VAL  99 -13.159  -5.921   1.821
  763   3HG1  VAL  99          3HG1      VAL  99 -12.235  -5.097   0.550
  764   1HG2  VAL  99          1HG2      VAL  99 -10.878  -7.564  -0.462
  765   2HG2  VAL  99          2HG2      VAL  99  -9.479  -7.708   0.582
  766   3HG2  VAL  99          3HG2      VAL  99  -9.868  -6.134  -0.117
  767    H    GLN 100           H        GLN 100 -11.254  -7.357   4.361
  768    HA   GLN 100           HA       GLN 100 -13.404  -5.900   5.464
  769   1HB   GLN 100          2HB       GLN 100 -11.470  -7.919   6.660
  770   2HB   GLN 100          1HB       GLN 100 -12.843  -7.267   7.570
  771   1HG   GLN 100          1HG       GLN 100 -14.433  -8.098   6.035
  772   2HG   GLN 100          2HG       GLN 100 -13.226  -8.500   4.812
  773   1HE2  GLN 100          1HE2      GLN 100 -11.734 -10.237   5.202
  774   2HE2  GLN 100          2HE2      GLN 100 -12.185 -11.552   6.298
  775    H    THR 101           H        THR 101  -9.950  -5.776   6.303
  776    HA   THR 101           HA       THR 101 -10.165  -3.921   8.456
  777    HB   THR 101           HB       THR 101  -7.818  -4.228   6.540
  778    HG1  THR 101           HG1      THR 101  -8.474  -6.205   7.532
  779   1HG2  THR 101          1HG2      THR 101  -6.528  -3.542   8.580
  780   2HG2  THR 101          2HG2      THR 101  -8.060  -3.136   9.371
  781   3HG2  THR 101          3HG2      THR 101  -7.548  -2.262   7.911
  782    H    VAL 102           H        VAL 102  -9.937  -3.355   4.876
  783    HA   VAL 102           HA       VAL 102  -9.845  -0.471   5.151
  784    HB   VAL 102           HB       VAL 102 -10.779  -2.233   2.842
  785   1HG1  VAL 102          1HG1      VAL 102  -8.347  -2.431   3.406
  786   2HG1  VAL 102          2HG1      VAL 102  -8.632  -1.670   1.836
  787   3HG1  VAL 102          3HG1      VAL 102  -8.195  -0.673   3.243
  788   1HG2  VAL 102          1HG2      VAL 102 -10.227   0.766   2.915
  789   2HG2  VAL 102          2HG2      VAL 102 -10.508  -0.197   1.449
  790   3HG2  VAL 102          3HG2      VAL 102 -11.801  -0.002   2.630
  791    H    GLU 103           HN       GLU 103 -12.479  -2.802   4.543
  792    HA   GLU 103           HA       GLU 103 -14.580  -1.050   4.308
  793   1HB   GLU 103          1HB       GLU 103 -14.645  -3.808   5.617
  794   2HB   GLU 103          2HB       GLU 103 -16.016  -2.881   5.034
  795   1HG   GLU 103          2HG       GLU 103 -14.304  -2.901   2.798
  796   2HG   GLU 103          1HG       GLU 103 -14.041  -4.479   3.530
  797    H    LYS 104           HN       LYS 104 -13.427  -2.449   7.380
  798    HA   LYS 104           HA       LYS 104 -15.423  -1.231   9.000
  799   1HB   LYS 104          1HB       LYS 104 -13.840  -1.441  10.881
  800   2HB   LYS 104          2HB       LYS 104 -13.988  -2.928   9.928
  801   1HG   LYS 104          2HG       LYS 104 -11.865  -2.728   9.050
  802   2HG   LYS 104          1HG       LYS 104 -11.781  -0.982   9.274
  803   1HD   LYS 104          2HD       LYS 104 -10.234  -1.921  10.730
  804   2HD   LYS 104          1HD       LYS 104 -11.536  -1.237  11.700
  805   1HE   LYS 104          2HE       LYS 104 -11.305  -4.215  10.978
  806   2HE   LYS 104          1HE       LYS 104 -10.615  -3.508  12.446
  807   1HZ   LYS 104          1HZ       LYS 104 -12.719  -4.452  12.896
  808   2HZ   LYS 104          2HZ       LYS 104 -12.801  -2.819  13.095
  809   3HZ   LYS 104          3HZ       LYS 104 -13.461  -3.523  11.760
  810    H    TYR 105           H        TYR 105 -12.688   0.315   7.396
  811    HA   TYR 105           HA       TYR 105 -12.917   2.738   9.098
  812   1HB   TYR 105          1HB       TYR 105 -11.136   2.283   6.691
  813   2HB   TYR 105          2HB       TYR 105 -11.000   3.516   7.943
  814    HD1  TYR 105           HD1      TYR 105  -9.057   1.238   6.769
  815    HD2  TYR 105           HD2      TYR 105 -11.164   1.955  10.463
  816    HE1  TYR 105           HE1      TYR 105  -7.277   0.062   8.016
  817    HE2  TYR 105           HE2      TYR 105  -9.397   0.755  11.700
  818    HH   TYR 105           HH       TYR 105  -7.338  -0.295  11.559
  819    H    LEU 106           H        LEU 106 -13.198   1.711   5.667
  820    HA   LEU 106           HA       LEU 106 -14.888   4.131   5.084
  821   1HB   LEU 106          2HB       LEU 106 -12.876   2.633   3.359
  822   2HB   LEU 106          1HB       LEU 106 -14.147   3.686   2.721
  823    HG   LEU 106           HG       LEU 106 -13.222   5.591   4.049
  824   1HD1  LEU 106          1HD1      LEU 106 -11.413   4.245   1.994
  825   2HD1  LEU 106          2HD1      LEU 106 -11.367   5.964   2.440
  826   3HD1  LEU 106          3HD1      LEU 106 -12.804   5.301   1.652
  827   1HD2  LEU 106          1HD2      LEU 106 -10.769   5.387   4.663
  828   2HD2  LEU 106          2HD2      LEU 106 -10.935   3.625   4.528
  829   3HD2  LEU 106          3HD2      LEU 106 -11.859   4.537   5.748
  830    H    ASN 107           H        ASN 107 -14.408   1.327   2.973
  831    HA   ASN 107           HA       ASN 107 -16.661  -0.203   3.545
  832   1HB   ASN 107          1HB       ASN 107 -17.717   2.000   2.547
  833   2HB   ASN 107          2HB       ASN 107 -16.986   1.482   1.027
  834   1HD2  ASN 107          2HD2      ASN 107 -17.448  -1.364   1.241
  835   2HD2  ASN 107          1HD2      ASN 107 -19.197  -1.617   1.216
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1  -1.903  -3.086 -11.436
    2   2H    MET   1          2H        MET   1  -1.236  -1.590 -11.506
    3   3H    MET   1          3H        MET   1  -0.643  -2.816 -12.456
    4    HA   MET   1           HA       MET   1  -1.840  -1.501 -13.893
    5   1HB   MET   1          1HB       MET   1  -2.323  -3.878 -14.192
    6   2HB   MET   1          2HB       MET   1  -3.597  -3.842 -12.971
    7   1HG   MET   1          2HG       MET   1  -4.478  -3.815 -15.286
    8   2HG   MET   1          1HG       MET   1  -4.968  -2.386 -14.383
    9   1HE   MET   1          1HE       MET   1  -5.620  -2.122 -17.183
   10   2HE   MET   1          2HE       MET   1  -4.797  -0.647 -17.745
   11   3HE   MET   1          3HE       MET   1  -5.567  -0.675 -16.143
   12    H    GLU   2           HN       GLU   2  -4.573  -2.451 -11.728
   13    HA   GLU   2           HA       GLU   2  -5.669   0.258 -11.845
   14   1HB   GLU   2          1HB       GLU   2  -6.352  -2.153 -10.092
   15   2HB   GLU   2          2HB       GLU   2  -7.289  -0.653 -10.203
   16   1HG   GLU   2          1HG       GLU   2  -6.797  -2.661 -12.459
   17   2HG   GLU   2          2HG       GLU   2  -8.285  -2.472 -11.535
   18    H    ALA   3           H        ALA   3  -3.877  -1.828  -9.625
   19    HA   ALA   3           HA       ALA   3  -3.321   0.367  -7.743
   20   1HB   ALA   3          1HB       ALA   3  -1.673  -1.238  -6.781
   21   2HB   ALA   3          2HB       ALA   3  -2.081  -2.397  -8.067
   22   3HB   ALA   3          3HB       ALA   3  -3.302  -1.914  -6.866
   23    H    GLY   4           H        GLY   4  -1.495   1.747  -7.872
   24   1HA   GLY   4          1HA       GLY   4   0.106   1.622 -10.363
   25   2HA   GLY   4          2HA       GLY   4   0.133   2.875  -9.119
   26    H    ALA   5           H        ALA   5   2.559   2.337  -9.813
   27    HA   ALA   5           HA       ALA   5   3.701   0.506  -7.757
   28   1HB   ALA   5          1HB       ALA   5   5.587   0.138  -9.293
   29   2HB   ALA   5          2HB       ALA   5   4.067  -0.457  -9.994
   30   3HB   ALA   5          3HB       ALA   5   4.763   1.082 -10.554
   31    H    VAL   6           H        VAL   6   5.270   1.563  -6.474
   32    HA   VAL   6           HA       VAL   6   6.097   4.298  -7.305
   33    HB   VAL   6           HB       VAL   6   5.794   4.906  -4.775
   34   1HG1  VAL   6          1HG1      VAL   6   5.110   2.732  -3.927
   35   2HG1  VAL   6          2HG1      VAL   6   3.681   2.724  -4.972
   36   3HG1  VAL   6          3HG1      VAL   6   3.842   3.930  -3.684
   37   1HG2  VAL   6          1HG2      VAL   6   4.680   6.118  -6.464
   38   2HG2  VAL   6          2HG2      VAL   6   3.514   4.813  -6.744
   39   3HG2  VAL   6          3HG2      VAL   6   3.502   5.717  -5.207
   40    H    ASN   7           H        ASN   7   7.746   5.196  -5.980
   41    HA   ASN   7           HA       ASN   7   9.526   3.393  -4.558
   42   1HB   ASN   7          2HB       ASN   7  10.562   3.186  -6.729
   43   2HB   ASN   7          1HB       ASN   7  10.204   4.886  -7.108
   44   1HD2  ASN   7          1HD2      ASN   7  12.160   3.006  -4.696
   45   2HD2  ASN   7          2HD2      ASN   7  13.543   4.068  -4.834
   46    H    ASP   8           HN       ASP   8  11.252   4.855  -3.646
   47    HA   ASP   8           HA       ASP   8  10.331   6.782  -1.910
   48   1HB   ASP   8          2HB       ASP   8  12.666   5.751  -2.067
   49   2HB   ASP   8          1HB       ASP   8  13.043   6.910  -3.326
   50    H    ASP   9           HN       ASP   9  11.621   7.353  -5.137
   51    HA   ASP   9           HA       ASP   9  11.417  10.185  -5.231
   52   1HB   ASP   9          2HB       ASP   9  12.590   8.881  -6.928
   53   2HB   ASP   9          1HB       ASP   9  11.107   8.104  -7.456
   54    H    THR  10           H        THR  10   9.135   7.959  -6.864
   55    HA   THR  10           HA       THR  10   7.172   9.926  -7.386
   56    HB   THR  10           HB       THR  10   5.761   7.811  -7.826
   57    HG1  THR  10           HG1      THR  10   7.208   5.940  -7.960
   58   1HG2  THR  10          1HG2      THR  10   8.513   8.032  -9.137
   59   2HG2  THR  10          2HG2      THR  10   7.086   8.992  -9.568
   60   3HG2  THR  10          3HG2      THR  10   7.082   7.239  -9.825
   61    H    PHE  11           H        PHE  11   7.587   7.790  -4.648
   62    HA   PHE  11           HA       PHE  11   5.249   7.726  -3.278
   63   1HB   PHE  11          2HB       PHE  11   7.520   6.864  -2.596
   64   2HB   PHE  11          1HB       PHE  11   7.942   8.473  -2.063
   65    HD1  PHE  11           HD1      PHE  11   5.844   5.506  -1.434
   66    HD2  PHE  11           HD2      PHE  11   7.098   9.347   0.044
   67    HE1  PHE  11           HE1      PHE  11   5.175   4.839   0.847
   68    HE2  PHE  11           HE2      PHE  11   6.416   8.709   2.313
   69    HZ   PHE  11           HZ       PHE  11   5.440   6.438   2.743
   70    H    LYS  12           HN       LYS  12   7.509  10.351  -3.367
   71    HA   LYS  12           HA       LYS  12   6.493  12.196  -1.511
   72   1HB   LYS  12          2HB       LYS  12   7.699  12.789  -4.251
   73   2HB   LYS  12          1HB       LYS  12   7.565  13.943  -2.934
   74   1HG   LYS  12          1HG       LYS  12   9.097  11.308  -2.717
   75   2HG   LYS  12          2HG       LYS  12   9.843  12.811  -3.233
   76   1HD   LYS  12          2HD       LYS  12  10.107  13.514  -1.109
   77   2HD   LYS  12          1HD       LYS  12   8.410  13.247  -0.723
   78   1HE   LYS  12          2HE       LYS  12   9.866  11.884   0.729
   79   2HE   LYS  12          1HE       LYS  12   8.848  10.855  -0.286
   80   1HZ   LYS  12          1HZ       LYS  12  10.694  10.501  -1.734
   81   2HZ   LYS  12          2HZ       LYS  12  11.122  10.094  -0.211
   82   3HZ   LYS  12          3HZ       LYS  12  11.656  11.515  -0.854
   83    H    ASN  13           H        ASN  13   5.578  11.764  -4.917
   84    HA   ASN  13           HA       ASN  13   3.480  13.832  -4.808
   85   1HB   ASN  13          2HB       ASN  13   4.551  11.894  -6.904
   86   2HB   ASN  13          1HB       ASN  13   3.062  12.766  -7.169
   87   1HD2  ASN  13          2HD2      ASN  13   3.541  15.370  -6.378
   88   2HD2  ASN  13          1HD2      ASN  13   5.028  15.983  -7.082
   89    H    VAL  14           H        VAL  14   3.649  10.391  -5.598
   90    HA   VAL  14           HA       VAL  14   0.823  10.080  -5.862
   91    HB   VAL  14           HB       VAL  14   3.114   8.075  -5.571
   92   1HG1  VAL  14          1HG1      VAL  14   1.791   9.266  -8.052
   93   2HG1  VAL  14          2HG1      VAL  14   3.450   9.588  -7.513
   94   3HG1  VAL  14          3HG1      VAL  14   3.005   7.973  -8.058
   95   1HG2  VAL  14          1HG2      VAL  14   0.280   7.734  -6.612
   96   2HG2  VAL  14          2HG2      VAL  14   1.020   6.903  -5.218
   97   3HG2  VAL  14          3HG2      VAL  14   1.589   6.557  -6.861
   98    H    VAL  15           H        VAL  15   2.957   9.655  -3.056
   99    HA   VAL  15           HA       VAL  15   0.701   8.374  -1.583
  100    HB   VAL  15           HB       VAL  15   3.673   8.298  -0.972
  101   1HG1  VAL  15          1HG1      VAL  15   2.991   6.517   0.583
  102   2HG1  VAL  15          2HG1      VAL  15   1.286   6.827   0.188
  103   3HG1  VAL  15          3HG1      VAL  15   2.263   8.059   1.010
  104   1HG2  VAL  15          1HG2      VAL  15   3.566   5.985  -1.797
  105   2HG2  VAL  15          2HG2      VAL  15   3.199   7.120  -3.090
  106   3HG2  VAL  15          3HG2      VAL  15   1.885   6.242  -2.312
  107    H    LEU  16           H        LEU  16   3.435  10.671  -0.939
  108    HA   LEU  16           HA       LEU  16   2.118  11.542   1.507
  109   1HB   LEU  16          2HB       LEU  16   4.457  12.688  -0.073
  110   2HB   LEU  16          1HB       LEU  16   3.889  13.329   1.459
  111    HG   LEU  16           HG       LEU  16   4.976  10.520   0.949
  112   1HD1  LEU  16          1HD2      LEU  16   6.197  12.893   2.426
  113   2HD1  LEU  16          2HD2      LEU  16   6.935  11.288   2.240
  114   3HD1  LEU  16          3HD2      LEU  16   6.685  12.317   0.821
  115   1HD2  LEU  16          1HD1      LEU  16   4.080  11.866   3.537
  116   2HD2  LEU  16          2HD1      LEU  16   5.072  10.399   3.482
  117   3HD2  LEU  16          3HD1      LEU  16   3.435  10.367   2.825
  118    H    GLU  17           HN       GLU  17   2.983  13.564  -1.353
  119    HA   GLU  17           HA       GLU  17   0.933  15.493  -0.658
  120   1HB   GLU  17          2HB       GLU  17   2.720  15.216  -3.105
  121   2HB   GLU  17          1HB       GLU  17   1.812  16.654  -2.643
  122   1HG   GLU  17          2HG       GLU  17   3.151  16.931  -0.617
  123   2HG   GLU  17          1HG       GLU  17   4.031  15.429  -0.928
  124    H    SER  18           H        SER  18  -0.475  13.199  -0.948
  125    HA   SER  18           HA       SER  18  -1.640  13.008  -3.648
  126   1HB   SER  18          2HB       SER  18  -2.835  11.085  -2.539
  127   2HB   SER  18          1HB       SER  18  -1.072  10.942  -2.539
  128    HG   SER  18           HG       SER  18  -1.051  11.063  -0.429
  129    H    SER  19           H        SER  19  -3.891  13.462  -3.990
  130    HA   SER  19           HA       SER  19  -5.079  15.476  -2.223
  131   1HB   SER  19          2HB       SER  19  -6.819  15.317  -4.129
  132   2HB   SER  19          1HB       SER  19  -5.196  15.896  -4.562
  133    HG   SER  19           HG       SER  19  -5.886  14.259  -6.013
  134    H    VAL  20           H        VAL  20  -6.253  12.584  -3.847
  135    HA   VAL  20           HA       VAL  20  -8.234  11.990  -1.782
  136    HB   VAL  20           HB       VAL  20  -8.846  10.110  -3.236
  137   1HG1  VAL  20          1HG2      VAL  20  -7.669   9.754  -5.413
  138   2HG1  VAL  20          2HG2      VAL  20  -6.370  10.823  -4.878
  139   3HG1  VAL  20          3HG2      VAL  20  -6.694   9.304  -4.017
  140   1HG2  VAL  20          1HG1      VAL  20  -9.671  12.389  -3.773
  141   2HG2  VAL  20          2HG1      VAL  20  -9.541  11.340  -5.195
  142   3HG2  VAL  20          3HG1      VAL  20  -8.323  12.597  -4.913
  143    HA   PRO  21           HA       PRO  21  -5.855   9.230   0.720
  144   1HB   PRO  21          1HB       PRO  21  -8.010   7.163   0.158
  145   2HB   PRO  21          2HB       PRO  21  -7.206   7.502   1.721
  146   1HG   PRO  21          2HG       PRO  21  -9.618   8.539   1.217
  147   2HG   PRO  21          1HG       PRO  21  -8.364   9.623   1.891
  148   1HD   PRO  21          1HD       PRO  21  -9.316   9.424  -0.967
  149   2HD   PRO  21          2HD       PRO  21  -8.886  10.862  -0.002
  150    H    VAL  22           H        VAL  22  -4.767   7.102   0.764
  151    HA   VAL  22           HA       VAL  22  -4.186   5.872  -1.842
  152    HB   VAL  22           HB       VAL  22  -2.044   6.907   0.040
  153   1HG1  VAL  22          1HG1      VAL  22  -1.663   6.156  -2.861
  154   2HG1  VAL  22          2HG1      VAL  22  -1.368   5.052  -1.499
  155   3HG1  VAL  22          3HG1      VAL  22  -0.445   6.530  -1.650
  156   1HG2  VAL  22          1HG2      VAL  22  -3.112   8.920  -0.770
  157   2HG2  VAL  22          2HG2      VAL  22  -3.093   8.318  -2.441
  158   3HG2  VAL  22          3HG2      VAL  22  -1.580   8.712  -1.610
  159    H    LEU  23           H        LEU  23  -3.270   3.749  -1.608
  160    HA   LEU  23           HA       LEU  23  -2.868   2.680   1.146
  161   1HB   LEU  23          1HB       LEU  23  -5.095   2.025   0.476
  162   2HB   LEU  23          2HB       LEU  23  -4.513   1.297  -1.022
  163    HG   LEU  23           HG       LEU  23  -3.455   0.406   1.696
  164   1HD1  LEU  23          1HD1      LEU  23  -3.712  -0.953  -1.031
  165   2HD1  LEU  23          2HD1      LEU  23  -3.318  -1.831   0.451
  166   3HD1  LEU  23          3HD1      LEU  23  -2.209  -0.608  -0.149
  167   1HD2  LEU  23          1HD2      LEU  23  -5.935  -0.677   0.312
  168   2HD2  LEU  23          2HD2      LEU  23  -5.185  -1.316   1.788
  169   3HD2  LEU  23          3HD2      LEU  23  -5.914   0.295   1.806
  170    H    VAL  24           H        VAL  24  -0.678   2.383   1.070
  171    HA   VAL  24           HA       VAL  24   0.581   1.494  -1.489
  172    HB   VAL  24           HB       VAL  24   1.835   2.613   1.042
  173   1HG1  VAL  24          1HG1      VAL  24   2.986   2.054  -1.731
  174   2HG1  VAL  24          2HG1      VAL  24   3.395   1.177  -0.241
  175   3HG1  VAL  24          3HG1      VAL  24   3.833   2.879  -0.406
  176   1HG2  VAL  24          1HG2      VAL  24   0.501   4.352  -0.050
  177   2HG2  VAL  24          2HG2      VAL  24   2.224   4.615  -0.350
  178   3HG2  VAL  24          3HG2      VAL  24   1.208   3.931  -1.631
  179    H    ASP  25           HN       ASP  25   1.076  -0.678  -1.649
  180    HA   ASP  25           HA       ASP  25   1.431  -2.262   0.865
  181   1HB   ASP  25          1HB       ASP  25  -0.101  -3.287  -0.704
  182   2HB   ASP  25          2HB       ASP  25   1.078  -3.116  -2.016
  183    H    PHE  26           H        PHE  26   3.516  -2.394   1.572
  184    HA   PHE  26           HA       PHE  26   5.766  -1.731  -0.223
  185   1HB   PHE  26          2HB       PHE  26   5.574  -2.628   2.670
  186   2HB   PHE  26          1HB       PHE  26   7.082  -2.411   1.798
  187    HD1  PHE  26           HD1      PHE  26   3.945  -0.233   2.047
  188    HD2  PHE  26           HD2      PHE  26   8.222  -0.578   2.574
  189    HE1  PHE  26           HE1      PHE  26   4.059   2.119   2.715
  190    HE2  PHE  26           HE2      PHE  26   8.266   1.702   3.524
  191    HZ   PHE  26           HZ       PHE  26   6.174   3.068   3.583
  192    H    TRP  27           H        TRP  27   6.415  -3.262  -1.654
  193    HA   TRP  27           HA       TRP  27   6.263  -6.140  -0.844
  194   1HB   TRP  27          1HB       TRP  27   5.447  -6.745  -2.996
  195   2HB   TRP  27          2HB       TRP  27   4.434  -5.422  -2.476
  196    HD1  TRP  27           HD1      TRP  27   5.285  -2.966  -3.583
  197    HE1  TRP  27           HE1      TRP  27   6.449  -2.415  -5.836
  198    HE3  TRP  27           HE3      TRP  27   6.524  -7.714  -5.040
  199    HZ2  TRP  27           HZ2      TRP  27   7.966  -3.866  -7.824
  200    HZ3  TRP  27           HZ3      TRP  27   7.714  -8.089  -7.153
  201    HH2  TRP  27           HH2      TRP  27   8.425  -6.180  -8.568
  202    H    ALA  28           H        ALA  28   7.458  -7.365  -2.734
  203    HA   ALA  28           HA       ALA  28   9.612  -6.092  -4.037
  204   1HB   ALA  28          1HB       ALA  28  10.711  -6.052  -1.812
  205   2HB   ALA  28          2HB       ALA  28  10.402  -7.800  -1.633
  206   3HB   ALA  28          3HB       ALA  28  11.511  -7.211  -2.885
  207    HA   PRO  29           HA       PRO  29   8.881  -9.860  -6.316
  208   1HB   PRO  29          1HB       PRO  29  11.440 -10.470  -7.275
  209   2HB   PRO  29          2HB       PRO  29  10.282  -9.306  -7.993
  210   1HG   PRO  29          1HG       PRO  29  12.573  -8.710  -6.095
  211   2HG   PRO  29          2HG       PRO  29  12.140  -7.852  -7.605
  212   1HD   PRO  29          2HD       PRO  29  11.327  -6.792  -5.282
  213   2HD   PRO  29          1HD       PRO  29  10.171  -6.934  -6.591
  214    H    TRP  30           H        TRP  30  11.841 -10.012  -4.236
  215    HA   TRP  30           HA       TRP  30  11.713 -12.868  -3.950
  216   1HB   TRP  30          2HB       TRP  30  13.265 -12.511  -2.074
  217   2HB   TRP  30          1HB       TRP  30  13.762 -11.705  -3.554
  218    HD1  TRP  30           HD1      TRP  30  14.329  -9.235  -3.403
  219    HE1  TRP  30           HE1      TRP  30  14.258  -7.414  -1.615
  220    HE3  TRP  30           HE3      TRP  30  11.772 -11.778   0.249
  221    HZ2  TRP  30           HZ2      TRP  30  13.062  -7.031   0.987
  222    HZ3  TRP  30           HZ3      TRP  30  11.093 -10.619   2.321
  223    HH2  TRP  30           HH2      TRP  30  11.649  -8.226   2.665
  224    H    CYS  31           H        CYS  31   9.712 -10.366  -2.542
  225    HA   CYS  31           HA       CYS  31   9.277 -11.804  -0.007
  226   1HB   CYS  31          2HB       CYS  31   9.167  -9.413   0.044
  227   2HB   CYS  31          1HB       CYS  31   7.923  -9.386  -1.208
  228    H    GLY  32           H        GLY  32   8.740 -13.822  -0.971
  229   1HA   GLY  32          2HA       GLY  32   6.858 -14.771  -2.549
  230   2HA   GLY  32          1HA       GLY  32   7.014 -15.431  -0.920
  231    HA   PRO  33           HA       PRO  33   2.955 -14.250   0.212
  232   1HB   PRO  33          2HB       PRO  33   3.042 -12.361   2.262
  233   2HB   PRO  33          1HB       PRO  33   3.192 -14.131   2.437
  234   1HG   PRO  33          2HG       PRO  33   5.380 -12.076   2.333
  235   2HG   PRO  33          1HG       PRO  33   5.261 -13.517   3.373
  236   1HD   PRO  33          1HD       PRO  33   6.801 -13.398   1.158
  237   2HD   PRO  33          2HD       PRO  33   5.975 -14.926   1.585
  238    H    CYS  34           H        CYS  34   5.021 -11.373  -0.095
  239    HA   CYS  34           HA       CYS  34   2.919  -9.489  -0.655
  240   1HB   CYS  34          2HB       CYS  34   5.721  -9.293  -1.804
  241   2HB   CYS  34          1HB       CYS  34   4.527  -8.042  -1.497
  242    H    ARG  35           HN       ARG  35   5.037 -11.533  -2.661
  243    HA   ARG  35           HA       ARG  35   4.303 -10.684  -5.229
  244   1HB   ARG  35          2HB       ARG  35   6.156 -12.296  -4.420
  245   2HB   ARG  35          1HB       ARG  35   4.938 -13.566  -4.487
  246   1HG   ARG  35          2HG       ARG  35   4.528 -12.902  -6.928
  247   2HG   ARG  35          1HG       ARG  35   5.977 -11.887  -6.792
  248   1HD   ARG  35          1HD       ARG  35   5.756 -14.888  -6.365
  249   2HD   ARG  35          2HD       ARG  35   6.582 -14.084  -7.709
  250    HE   ARG  35           HE       ARG  35   8.034 -13.023  -5.818
  251   1HH1  ARG  35          1HH2      ARG  35   6.949 -16.411  -5.824
  252   2HH1  ARG  35          2HH2      ARG  35   8.163 -16.905  -4.678
  253   1HH2  ARG  35          1HH1      ARG  35   9.532 -13.642  -4.422
  254   2HH2  ARG  35          2HH1      ARG  35   9.694 -15.285  -3.830
  255    H    ILE  36           H        ILE  36   2.972 -13.423  -3.325
  256    HA   ILE  36           HA       ILE  36   0.923 -13.968  -5.315
  257    HB   ILE  36           HB       ILE  36  -0.040 -15.493  -3.671
  258   1HG1  ILE  36          1HG1      ILE  36   2.144 -14.599  -1.767
  259   2HG1  ILE  36          2HG1      ILE  36   0.470 -14.031  -1.640
  260   1HG2  ILE  36          1HG2      ILE  36   3.018 -15.666  -3.767
  261   2HG2  ILE  36          2HG2      ILE  36   1.934 -16.107  -5.098
  262   3HG2  ILE  36          3HG2      ILE  36   1.882 -17.015  -3.583
  263   1HD1  ILE  36          1HD1      ILE  36   0.781 -15.781  -0.091
  264   2HD1  ILE  36          2HD1      ILE  36  -0.324 -16.318  -1.376
  265   3HD1  ILE  36          3HD1      ILE  36   1.372 -16.887  -1.351
  266    H    ILE  37           H        ILE  37   0.948 -11.953  -2.385
  267    HA   ILE  37           HA       ILE  37  -1.864 -11.336  -2.501
  268    HB   ILE  37           HB       ILE  37   0.553 -10.160  -1.105
  269   1HG1  ILE  37          1HG1      ILE  37  -2.054 -11.384  -0.072
  270   2HG1  ILE  37          2HG1      ILE  37  -0.624 -12.346  -0.449
  271   1HG2  ILE  37          1HG2      ILE  37  -0.670  -8.197  -1.420
  272   2HG2  ILE  37          2HG2      ILE  37  -1.090  -8.710   0.193
  273   3HG2  ILE  37          3HG2      ILE  37  -2.248  -8.988  -1.120
  274   1HD1  ILE  37          1HD1      ILE  37  -0.639 -11.979   1.881
  275   2HD1  ILE  37          2HD1      ILE  37  -0.823 -10.231   1.724
  276   3HD1  ILE  37          3HD1      ILE  37   0.692 -11.015   1.213
  277    H    ALA  38           H        ALA  38   0.933  -9.738  -4.038
  278    HA   ALA  38           HA       ALA  38   0.061  -7.350  -4.798
  279   1HB   ALA  38          1HB       ALA  38   1.454  -9.279  -6.709
  280   2HB   ALA  38          2HB       ALA  38   1.441  -7.514  -6.804
  281   3HB   ALA  38          3HB       ALA  38   2.229  -8.316  -5.437
  282    HA   PRO  39           HA       PRO  39  -2.571  -8.703  -8.617
  283   1HB   PRO  39          1HB       PRO  39  -3.670 -11.352  -7.783
  284   2HB   PRO  39          2HB       PRO  39  -3.083 -10.843  -9.389
  285   1HG   PRO  39          2HG       PRO  39  -1.625 -12.556  -7.831
  286   2HG   PRO  39          1HG       PRO  39  -0.811 -11.260  -8.766
  287   1HD   PRO  39          1HD       PRO  39  -1.740 -11.134  -5.878
  288   2HD   PRO  39          2HD       PRO  39  -0.084 -10.857  -6.502
  289    H    VAL  40           H        VAL  40  -3.252  -9.851  -5.325
  290    HA   VAL  40           HA       VAL  40  -6.071  -9.278  -5.340
  291    HB   VAL  40           HB       VAL  40  -4.249  -9.582  -2.905
  292   1HG1  VAL  40          1HG1      VAL  40  -6.501  -8.732  -2.496
  293   2HG1  VAL  40          2HG1      VAL  40  -6.232 -10.345  -1.811
  294   3HG1  VAL  40          3HG1      VAL  40  -7.179 -10.166  -3.308
  295   1HG2  VAL  40          1HG2      VAL  40  -4.898 -11.995  -2.949
  296   2HG2  VAL  40          2HG2      VAL  40  -5.626 -11.757  -4.551
  297   3HG2  VAL  40          3HG2      VAL  40  -3.872 -11.582  -4.322
  298    H    VAL  41           H        VAL  41  -3.073  -7.645  -4.233
  299    HA   VAL  41           HA       VAL  41  -4.262  -5.284  -3.188
  300    HB   VAL  41           HB       VAL  41  -1.646  -5.485  -4.767
  301   1HG1  VAL  41          1HG1      VAL  41  -2.137  -5.792  -1.781
  302   2HG1  VAL  41          2HG1      VAL  41  -0.551  -5.735  -2.591
  303   3HG1  VAL  41          3HG1      VAL  41  -1.657  -7.059  -2.924
  304   1HG2  VAL  41          1HG2      VAL  41  -2.251  -3.178  -4.531
  305   2HG2  VAL  41          2HG2      VAL  41  -0.992  -3.527  -3.346
  306   3HG2  VAL  41          3HG2      VAL  41  -2.676  -3.401  -2.811
  307    H    ASP  42           HN       ASP  42  -3.375  -6.174  -6.518
  308    HA   ASP  42           HA       ASP  42  -4.217  -3.729  -7.722
  309   1HB   ASP  42          2HB       ASP  42  -2.838  -5.948  -8.582
  310   2HB   ASP  42          1HB       ASP  42  -4.399  -6.205  -9.364
  311    H    GLU  43           HN       GLU  43  -6.014  -6.887  -7.413
  312    HA   GLU  43           HA       GLU  43  -8.298  -5.854  -8.766
  313   1HB   GLU  43          1HB       GLU  43  -9.339  -7.774  -8.287
  314   2HB   GLU  43          2HB       GLU  43  -7.670  -8.316  -8.110
  315   1HG   GLU  43          2HG       GLU  43  -7.998  -7.956  -5.573
  316   2HG   GLU  43          1HG       GLU  43  -9.707  -7.675  -5.923
  317    H    ILE  44           H        ILE  44  -7.375  -5.827  -5.306
  318    HA   ILE  44           HA       ILE  44  -9.749  -4.618  -4.306
  319    HB   ILE  44           HB       ILE  44  -6.848  -4.563  -3.377
  320   1HG1  ILE  44          2HG1      ILE  44  -9.390  -5.945  -2.381
  321   2HG1  ILE  44          1HG1      ILE  44  -8.118  -6.736  -3.283
  322   1HG2  ILE  44          1HG2      ILE  44  -8.009  -2.481  -2.573
  323   2HG2  ILE  44          2HG2      ILE  44  -9.270  -3.511  -1.856
  324   3HG2  ILE  44          3HG2      ILE  44  -7.594  -3.576  -1.273
  325   1HD1  ILE  44          1HD1      ILE  44  -7.784  -7.292  -0.976
  326   2HD1  ILE  44          2HD1      ILE  44  -7.913  -5.611  -0.471
  327   3HD1  ILE  44          3HD1      ILE  44  -6.502  -6.150  -1.420
  328    H    ALA  45           H        ALA  45  -6.755  -3.166  -5.726
  329    HA   ALA  45           HA       ALA  45  -7.579  -0.471  -5.524
  330   1HB   ALA  45          1HB       ALA  45  -5.380  -1.392  -6.422
  331   2HB   ALA  45          2HB       ALA  45  -6.184  -1.642  -7.961
  332   3HB   ALA  45          3HB       ALA  45  -6.088  -0.013  -7.330
  333    H    GLY  46           H        GLY  46  -8.240  -2.873  -8.136
  334   1HA   GLY  46          1HA       GLY  46  -9.839  -1.310  -9.823
  335   2HA   GLY  46          2HA       GLY  46 -10.037  -3.056  -9.570
  336    H    GLU  47           HN       GLU  47 -10.848  -3.187  -6.912
  337    HA   GLU  47           HA       GLU  47 -13.606  -2.527  -7.055
  338   1HB   GLU  47          1HB       GLU  47 -11.825  -3.293  -4.713
  339   2HB   GLU  47          2HB       GLU  47 -13.580  -3.209  -4.642
  340   1HG   GLU  47          1HG       GLU  47 -13.818  -4.964  -6.300
  341   2HG   GLU  47          2HG       GLU  47 -12.081  -5.035  -6.573
  342    H    TYR  48           H        TYR  48 -10.971  -0.946  -5.235
  343    HA   TYR  48           HA       TYR  48 -12.908   1.206  -4.376
  344   1HB   TYR  48          2HB       TYR  48 -10.337   0.201  -3.109
  345   2HB   TYR  48          1HB       TYR  48 -11.339   1.508  -2.480
  346    HD1  TYR  48           HD1      TYR  48 -13.728   1.079  -1.803
  347    HD2  TYR  48           HD2      TYR  48 -10.971  -2.110  -2.675
  348    HE1  TYR  48           HE1      TYR  48 -15.287  -0.540  -0.786
  349    HE2  TYR  48           HE2      TYR  48 -12.550  -3.745  -1.677
  350    HH   TYR  48           HH       TYR  48 -15.558  -2.724  -0.058
  351    H    LYS  49           HN       LYS  49 -11.146   1.134  -6.901
  352    HA   LYS  49           HA       LYS  49  -9.227   3.080  -6.866
  353   1HB   LYS  49          2HB       LYS  49  -9.813   3.441  -9.287
  354   2HB   LYS  49          1HB       LYS  49  -9.630   1.761  -8.824
  355   1HG   LYS  49          2HG       LYS  49 -12.148   1.586  -8.633
  356   2HG   LYS  49          1HG       LYS  49 -12.267   3.253  -9.220
  357   1HD   LYS  49          2HD       LYS  49 -11.044   2.570 -11.300
  358   2HD   LYS  49          1HD       LYS  49 -10.981   0.904 -10.697
  359   1HE   LYS  49          2HE       LYS  49 -13.496   2.500 -11.375
  360   2HE   LYS  49          1HE       LYS  49 -12.811   1.146 -12.292
  361   1HZ   LYS  49          1HZ       LYS  49 -13.167  -0.210 -10.280
  362   2HZ   LYS  49          2HZ       LYS  49 -14.564   0.342 -10.974
  363   3HZ   LYS  49          3HZ       LYS  49 -13.978   1.043  -9.604
  364    H    ASP  50           HN       ASP  50  -9.312   5.180  -7.958
  365    HA   ASP  50           HA       ASP  50  -9.780   7.374  -8.088
  366   1HB   ASP  50          1HB       ASP  50 -12.696   6.590  -7.592
  367   2HB   ASP  50          2HB       ASP  50 -12.112   8.201  -7.976
  368    H    LYS  51           HN       LYS  51 -11.549   5.942  -5.342
  369    HA   LYS  51           HA       LYS  51 -11.002   8.347  -3.692
  370   1HB   LYS  51          1HB       LYS  51 -12.130   5.663  -2.845
  371   2HB   LYS  51          2HB       LYS  51 -12.119   7.156  -1.905
  372   1HG   LYS  51          1HG       LYS  51 -13.472   8.233  -3.791
  373   2HG   LYS  51          2HG       LYS  51 -13.672   6.618  -4.485
  374   1HD   LYS  51          2HD       LYS  51 -14.566   7.511  -1.699
  375   2HD   LYS  51          1HD       LYS  51 -15.611   7.303  -3.113
  376   1HE   LYS  51          1HE       LYS  51 -14.985   4.873  -3.192
  377   2HE   LYS  51          2HE       LYS  51 -14.040   5.090  -1.705
  378   1HZ   LYS  51          1HZ       LYS  51 -16.034   5.761  -0.596
  379   2HZ   LYS  51          2HZ       LYS  51 -16.921   5.553  -1.970
  380   3HZ   LYS  51          3HZ       LYS  51 -16.204   4.258  -1.248
  381    H    LEU  52           H        LEU  52 -10.049   4.919  -3.759
  382    HA   LEU  52           HA       LEU  52  -7.854   5.496  -1.838
  383   1HB   LEU  52          1HB       LEU  52  -9.647   3.682  -1.437
  384   2HB   LEU  52          2HB       LEU  52  -8.863   2.788  -2.742
  385    HG   LEU  52           HG       LEU  52  -6.675   3.023  -1.419
  386   1HD1  LEU  52          1HD1      LEU  52  -7.247   4.822   0.148
  387   2HD1  LEU  52          2HD1      LEU  52  -7.027   3.342   1.075
  388   3HD1  LEU  52          3HD1      LEU  52  -8.664   3.922   0.727
  389   1HD2  LEU  52          1HD2      LEU  52  -9.079   1.514  -0.283
  390   2HD2  LEU  52          2HD2      LEU  52  -7.950   0.930  -1.525
  391   3HD2  LEU  52          3HD2      LEU  52  -7.394   1.166   0.141
  392    H    LYS  53           HN       LYS  53  -6.106   6.163  -2.953
  393    HA   LYS  53           HA       LYS  53  -5.503   5.170  -5.620
  394   1HB   LYS  53          2HB       LYS  53  -4.967   7.499  -4.336
  395   2HB   LYS  53          1HB       LYS  53  -3.471   6.678  -3.989
  396   1HG   LYS  53          2HG       LYS  53  -4.634   7.041  -6.778
  397   2HG   LYS  53          1HG       LYS  53  -3.362   8.030  -6.045
  398   1HD   LYS  53          2HD       LYS  53  -1.886   6.072  -5.841
  399   2HD   LYS  53          1HD       LYS  53  -3.125   5.021  -6.562
  400   1HE   LYS  53          2HE       LYS  53  -3.063   6.349  -8.648
  401   2HE   LYS  53          1HE       LYS  53  -1.814   7.398  -7.948
  402   1HZ   LYS  53          1HZ       LYS  53  -0.402   5.481  -7.764
  403   2HZ   LYS  53          2HZ       LYS  53  -1.568   4.507  -8.405
  404   3HZ   LYS  53          3HZ       LYS  53  -0.885   5.692  -9.326
  405    H    CYS  54           H        CYS  54  -5.370   2.915  -5.274
  406    HA   CYS  54           HA       CYS  54  -3.636   1.830  -3.231
  407   1HB   CYS  54          1HB       CYS  54  -5.618   0.628  -4.090
  408   2HB   CYS  54          2HB       CYS  54  -4.792   0.549  -5.673
  409    HG   CYS  54           HG       CYS  54  -4.603  -1.799  -4.502
  410    H    VAL  55           H        VAL  55  -1.489   1.116  -3.423
  411    HA   VAL  55           HA       VAL  55  -0.164   1.215  -6.027
  412    HB   VAL  55           HB       VAL  55   1.456   2.675  -4.075
  413   1HG1  VAL  55          1HG1      VAL  55   0.300   4.770  -3.918
  414   2HG1  VAL  55          2HG1      VAL  55  -1.113   4.121  -4.761
  415   3HG1  VAL  55          3HG1      VAL  55  -0.674   3.518  -3.140
  416   1HG2  VAL  55          1HG2      VAL  55   1.504   4.334  -5.922
  417   2HG2  VAL  55          2HG2      VAL  55   1.872   2.688  -6.471
  418   3HG2  VAL  55          3HG2      VAL  55   0.267   3.401  -6.778
  419    H    LYS  56           HN       LYS  56   2.002   0.379  -5.945
  420    HA   LYS  56           HA       LYS  56   2.601  -1.322  -3.564
  421   1HB   LYS  56          1HB       LYS  56   2.360  -1.874  -6.479
  422   2HB   LYS  56          2HB       LYS  56   3.685  -2.680  -5.635
  423   1HG   LYS  56          1HG       LYS  56   2.225  -3.653  -4.004
  424   2HG   LYS  56          2HG       LYS  56   0.831  -2.730  -4.593
  425   1HD   LYS  56          2HD       LYS  56   2.332  -4.775  -6.293
  426   2HD   LYS  56          1HD       LYS  56   0.962  -5.183  -5.245
  427   1HE   LYS  56          2HE       LYS  56  -0.458  -3.506  -6.450
  428   2HE   LYS  56          1HE       LYS  56   0.876  -3.212  -7.581
  429   1HZ   LYS  56          1HZ       LYS  56  -0.531  -5.757  -7.159
  430   2HZ   LYS  56          2HZ       LYS  56   0.755  -5.541  -8.173
  431   3HZ   LYS  56          3HZ       LYS  56  -0.667  -4.761  -8.461
  432    H    LEU  57           H        LEU  57   4.407  -0.710  -2.566
  433    HA   LEU  57           HA       LEU  57   6.402   0.971  -4.004
  434   1HB   LEU  57          1HB       LEU  57   5.593   1.812  -1.834
  435   2HB   LEU  57          2HB       LEU  57   6.110   0.314  -1.066
  436    HG   LEU  57           HG       LEU  57   8.487   1.089  -2.250
  437   1HD1  LEU  57          1HD2      LEU  57   7.372   1.975   0.423
  438   2HD1  LEU  57          2HD2      LEU  57   8.220   0.448   0.066
  439   3HD1  LEU  57          3HD2      LEU  57   9.090   1.989  -0.028
  440   1HD2  LEU  57          1HD1      LEU  57   7.111   3.660  -1.433
  441   2HD2  LEU  57          2HD1      LEU  57   7.421   3.190  -3.118
  442   3HD2  LEU  57          3HD1      LEU  57   8.776   3.476  -2.009
  443    H    ASN  58           H        ASN  58   8.129  -0.008  -4.893
  444    HA   ASN  58           HA       ASN  58   8.807  -2.765  -4.083
  445   1HB   ASN  58          2HB       ASN  58   9.103  -2.057  -6.427
  446   2HB   ASN  58          1HB       ASN  58  10.338  -0.900  -5.920
  447   1HD2  ASN  58          2HD2      ASN  58   9.976  -3.982  -7.161
  448   2HD2  ASN  58          1HD2      ASN  58  11.468  -4.685  -6.563
  449    H    THR  59           H        THR  59   9.619  -3.060  -2.209
  450    HA   THR  59           HA       THR  59  10.777  -1.014  -0.555
  451    HB   THR  59           HB       THR  59  10.796  -4.037  -0.176
  452    HG1  THR  59           HG1      THR  59   8.704  -3.401  -0.601
  453   1HG2  THR  59          1HG2      THR  59  10.645  -1.771   1.851
  454   2HG2  THR  59          2HG2      THR  59  10.697  -3.508   2.207
  455   3HG2  THR  59          3HG2      THR  59  12.118  -2.713   1.508
  456    H    ASP  60           HN       ASP  60  12.090  -3.531  -2.628
  457    HA   ASP  60           HA       ASP  60  14.752  -3.666  -1.547
  458   1HB   ASP  60          1HB       ASP  60  13.335  -5.278  -3.096
  459   2HB   ASP  60          2HB       ASP  60  13.972  -4.300  -4.418
  460    H    GLU  61           HN       GLU  61  13.109  -1.916  -4.080
  461    HA   GLU  61           HA       GLU  61  15.374  -0.351  -5.018
  462   1HB   GLU  61          2HB       GLU  61  13.403  -1.184  -6.383
  463   2HB   GLU  61          1HB       GLU  61  12.384  -0.036  -5.489
  464   1HG   GLU  61          2HG       GLU  61  13.739   1.845  -6.392
  465   2HG   GLU  61          1HG       GLU  61  14.783   0.679  -7.209
  466    H    SER  62           H        SER  62  12.826  -0.010  -2.609
  467    HA   SER  62           HA       SER  62  13.595   2.831  -2.071
  468   1HB   SER  62          1HB       SER  62  10.954   1.503  -1.432
  469   2HB   SER  62          2HB       SER  62  11.400   3.220  -1.471
  470    HG   SER  62           HG       SER  62  11.075   1.349  -3.573
  471    HA   PRO  63           HA       PRO  63  14.421   0.162   1.781
  472   1HB   PRO  63          1HB       PRO  63  17.120   0.683   2.005
  473   2HB   PRO  63          2HB       PRO  63  16.435  -0.722   1.131
  474   1HG   PRO  63          1HG       PRO  63  17.366   1.916  -0.016
  475   2HG   PRO  63          2HG       PRO  63  17.699   0.268  -0.629
  476   1HD   PRO  63          1HD       PRO  63  15.739   1.817  -1.693
  477   2HD   PRO  63          2HD       PRO  63  15.453   0.067  -1.485
  478    H    ASN  64           H        ASN  64  15.267   3.265   0.464
  479    HA   ASN  64           HA       ASN  64  15.873   4.871   2.689
  480   1HB   ASN  64          2HB       ASN  64  14.321   5.375   0.112
  481   2HB   ASN  64          1HB       ASN  64  14.537   6.629   1.326
  482   1HD2  ASN  64          1HD2      ASN  64  15.571   7.558  -0.803
  483   2HD2  ASN  64          2HD2      ASN  64  17.303   7.267  -0.955
  484    H    VAL  65           H        VAL  65  12.665   4.693   1.217
  485    HA   VAL  65           HA       VAL  65  11.144   5.834   3.266
  486    HB   VAL  65           HB       VAL  65  10.423   3.676   1.217
  487   1HG1  VAL  65          1HG2      VAL  65   8.125   4.446   1.437
  488   2HG1  VAL  65          2HG2      VAL  65   8.709   3.861   2.996
  489   3HG1  VAL  65          3HG2      VAL  65   8.611   5.609   2.697
  490   1HG2  VAL  65          1HG1      VAL  65  11.315   5.649   0.107
  491   2HG2  VAL  65          2HG1      VAL  65  10.303   6.717   1.102
  492   3HG2  VAL  65          3HG1      VAL  65   9.557   5.623  -0.084
  493    H    ALA  66           H        ALA  66  11.833   2.473   2.532
  494    HA   ALA  66           HA       ALA  66  10.407   1.162   4.547
  495   1HB   ALA  66          1HB       ALA  66  13.180   0.323   3.616
  496   2HB   ALA  66          2HB       ALA  66  11.902  -0.716   4.232
  497   3HB   ALA  66          3HB       ALA  66  11.705   0.085   2.654
  498    H    SER  67           H        SER  67  13.752   2.446   4.769
  499    HA   SER  67           HA       SER  67  14.117   1.664   7.522
  500   1HB   SER  67          1HB       SER  67  15.630   3.712   5.838
  501   2HB   SER  67          2HB       SER  67  16.165   2.991   7.369
  502    HG   SER  67           HG       SER  67  15.714   1.682   4.890
  503    H    GLU  68           HN       GLU  68  13.234   4.698   5.885
  504    HA   GLU  68           HA       GLU  68  13.288   6.456   8.103
  505   1HB   GLU  68          1HB       GLU  68  11.508   6.375   5.635
  506   2HB   GLU  68          2HB       GLU  68  11.494   7.712   6.785
  507   1HG   GLU  68          1HG       GLU  68  13.694   8.381   6.280
  508   2HG   GLU  68          2HG       GLU  68  14.121   6.838   5.545
  509    H    TYR  69           H        TYR  69  10.581   4.416   6.885
  510    HA   TYR  69           HA       TYR  69   8.916   5.085   9.225
  511   1HB   TYR  69          2HB       TYR  69   8.645   3.186   6.871
  512   2HB   TYR  69          1HB       TYR  69   7.530   3.172   8.228
  513    HD1  TYR  69           HD1      TYR  69   8.455   4.912   5.161
  514    HD2  TYR  69           HD2      TYR  69   6.249   5.297   8.838
  515    HE1  TYR  69           HE1      TYR  69   7.329   6.918   4.268
  516    HE2  TYR  69           HE2      TYR  69   5.111   7.310   7.932
  517    HH   TYR  69           HH       TYR  69   5.822   8.616   4.700
  518    H    GLY  70           H        GLY  70  10.995   2.387   8.186
  519   1HA   GLY  70          1HA       GLY  70  12.050   0.768   9.419
  520   2HA   GLY  70          2HA       GLY  70  11.432   1.477  10.907
  521    H    ILE  71           H        ILE  71  10.017   0.128   7.985
  522    HA   ILE  71           HA       ILE  71   7.699  -0.984   9.126
  523    HB   ILE  71           HB       ILE  71   7.583  -2.243   6.989
  524   1HG1  ILE  71          1HG1      ILE  71  10.462  -1.259   6.654
  525   2HG1  ILE  71          2HG1      ILE  71   9.874  -2.934   6.680
  526   1HG2  ILE  71          1HG2      ILE  71   7.361  -0.317   5.592
  527   2HG2  ILE  71          2HG2      ILE  71   8.603   0.588   6.483
  528   3HG2  ILE  71          3HG2      ILE  71   7.038   0.232   7.240
  529   1HD1  ILE  71          1HD1      ILE  71   9.389  -0.909   4.501
  530   2HD1  ILE  71          2HD1      ILE  71   8.496  -2.441   4.627
  531   3HD1  ILE  71          3HD1      ILE  71  10.259  -2.450   4.408
  532    H    ARG  72           HN       ARG  72   7.125  -3.003   9.860
  533    HA   ARG  72           HA       ARG  72   9.281  -4.702  10.911
  534   1HB   ARG  72          1HB       ARG  72   7.266  -4.117  12.222
  535   2HB   ARG  72          2HB       ARG  72   6.254  -4.969  11.051
  536   1HG   ARG  72          1HG       ARG  72   7.443  -7.100  11.605
  537   2HG   ARG  72          2HG       ARG  72   8.480  -6.211  12.739
  538   1HD   ARG  72          2HD       ARG  72   6.480  -5.580  14.060
  539   2HD   ARG  72          1HD       ARG  72   5.445  -6.453  12.901
  540    HE   ARG  72           HE       ARG  72   7.437  -8.235  13.834
  541   1HH1  ARG  72          2HH2      ARG  72   4.611  -6.513  15.049
  542   2HH1  ARG  72          1HH2      ARG  72   4.225  -7.696  16.269
  543   1HH2  ARG  72          2HH1      ARG  72   6.957  -9.799  15.419
  544   2HH2  ARG  72          1HH1      ARG  72   5.590  -9.604  16.482
  545    H    SER  73           H        SER  73   9.990  -4.899   8.580
  546    HA   SER  73           HA       SER  73  10.413  -6.240   6.778
  547   1HB   SER  73          1HB       SER  73  10.145  -8.147   8.435
  548   2HB   SER  73          2HB       SER  73   8.452  -8.294   7.915
  549    HG   SER  73           HG       SER  73   9.862  -9.681   6.743
  550    H    ILE  74           H        ILE  74   8.528  -7.930   5.342
  551    HA   ILE  74           HA       ILE  74   6.322  -6.141   4.657
  552    HB   ILE  74           HB       ILE  74   6.917  -6.444   2.190
  553   1HG1  ILE  74          1HG1      ILE  74   9.735  -6.926   3.185
  554   2HG1  ILE  74          2HG1      ILE  74   8.683  -8.195   2.533
  555   1HG2  ILE  74          1HG2      ILE  74   7.150  -4.327   3.571
  556   2HG2  ILE  74          2HG2      ILE  74   8.222  -4.422   2.179
  557   3HG2  ILE  74          3HG2      ILE  74   8.862  -4.743   3.799
  558   1HD1  ILE  74          1HD1      ILE  74  10.055  -7.375   0.715
  559   2HD1  ILE  74          2HD1      ILE  74   8.403  -6.829   0.433
  560   3HD1  ILE  74          3HD1      ILE  74   9.630  -5.704   1.056
  561    HA   PRO  75           HA       PRO  75   4.696  -6.544   2.638
  562   1HB   PRO  75          2HB       PRO  75   2.040  -7.163   3.012
  563   2HB   PRO  75          1HB       PRO  75   3.072  -7.790   1.708
  564   1HG   PRO  75          1HG       PRO  75   2.413  -9.083   4.371
  565   2HG   PRO  75          2HG       PRO  75   2.337  -9.848   2.755
  566   1HD   PRO  75          2HD       PRO  75   4.505 -10.229   4.367
  567   2HD   PRO  75          1HD       PRO  75   4.732  -9.952   2.638
  568    H    THR  76           H        THR  76   3.918  -4.710   3.281
  569    HA   THR  76           HA       THR  76   2.812  -4.248   5.952
  570    HB   THR  76           HB       THR  76   5.389  -2.953   4.987
  571    HG1  THR  76           HG1      THR  76   6.050  -4.398   6.411
  572   1HG2  THR  76          1HG2      THR  76   3.444  -2.032   7.152
  573   2HG2  THR  76          2HG2      THR  76   3.965  -1.117   5.721
  574   3HG2  THR  76          3HG2      THR  76   5.122  -1.479   7.008
  575    H    ILE  77           H        ILE  77   0.947  -3.354   5.376
  576    HA   ILE  77           HA       ILE  77   0.692  -1.767   2.883
  577    HB   ILE  77           HB       ILE  77  -1.347  -3.052   4.734
  578   1HG1  ILE  77          2HG1      ILE  77  -0.678  -3.604   1.802
  579   2HG1  ILE  77          1HG1      ILE  77  -0.030  -4.542   3.150
  580   1HG2  ILE  77          1HG2      ILE  77  -2.255  -0.926   3.886
  581   2HG2  ILE  77          2HG2      ILE  77  -3.025  -2.251   3.030
  582   3HG2  ILE  77          3HG2      ILE  77  -1.720  -1.334   2.243
  583   1HD1  ILE  77          1HD1      ILE  77  -2.958  -4.361   2.356
  584   2HD1  ILE  77          2HD1      ILE  77  -1.876  -5.754   2.254
  585   3HD1  ILE  77          3HD1      ILE  77  -2.359  -5.134   3.844
  586    H    MET  78           H        MET  78   0.395   0.451   3.075
  587    HA   MET  78           HA       MET  78  -0.115   1.619   5.794
  588   1HB   MET  78          1HB       MET  78   1.715   2.622   3.593
  589   2HB   MET  78          2HB       MET  78   1.201   3.577   5.000
  590   1HG   MET  78          1HG       MET  78   2.223   1.817   6.481
  591   2HG   MET  78          2HG       MET  78   2.836   1.047   5.020
  592   1HE   MET  78          1HE       MET  78   4.836   1.668   7.308
  593   2HE   MET  78          2HE       MET  78   5.223   1.050   5.682
  594   3HE   MET  78          3HE       MET  78   6.137   2.418   6.349
  595    H    VAL  79           H        VAL  79  -1.815   2.918   5.848
  596    HA   VAL  79           HA       VAL  79  -3.182   3.685   3.299
  597    HB   VAL  79           HB       VAL  79  -4.194   3.548   6.164
  598   1HG1  VAL  79          1HG1      VAL  79  -5.010   2.025   3.651
  599   2HG1  VAL  79          2HG1      VAL  79  -5.771   1.881   5.250
  600   3HG1  VAL  79          3HG1      VAL  79  -4.094   1.359   5.021
  601   1HG2  VAL  79          1HG2      VAL  79  -6.380   4.294   5.238
  602   2HG2  VAL  79          2HG2      VAL  79  -5.609   4.576   3.659
  603   3HG2  VAL  79          3HG2      VAL  79  -5.169   5.550   5.059
  604    H    PHE  80           H        PHE  80  -3.188   5.809   2.763
  605    HA   PHE  80           HA       PHE  80  -2.421   7.842   4.803
  606   1HB   PHE  80          1HB       PHE  80  -1.754   7.975   1.844
  607   2HB   PHE  80          2HB       PHE  80  -1.422   9.189   3.051
  608    HD1  PHE  80           HD1      PHE  80   0.756   9.295   3.940
  609    HD2  PHE  80           HD2      PHE  80  -0.632   5.593   2.214
  610    HE1  PHE  80           HE1      PHE  80   2.961   8.260   4.377
  611    HE2  PHE  80           HE2      PHE  80   1.596   4.603   2.571
  612    HZ   PHE  80           HZ       PHE  80   3.360   5.876   3.775
  613    H    LYS  81           HN       LYS  81  -3.828   9.454   4.930
  614    HA   LYS  81           HA       LYS  81  -6.314   9.306   3.238
  615   1HB   LYS  81          1HB       LYS  81  -7.550  10.088   5.050
  616   2HB   LYS  81          2HB       LYS  81  -6.483   8.859   5.714
  617   1HG   LYS  81          2HG       LYS  81  -6.369  11.878   6.051
  618   2HG   LYS  81          1HG       LYS  81  -6.581  10.641   7.284
  619   1HD   LYS  81          1HD       LYS  81  -4.246   9.862   6.912
  620   2HD   LYS  81          2HD       LYS  81  -4.023  11.152   5.700
  621   1HE   LYS  81          1HE       LYS  81  -4.740  11.758   8.575
  622   2HE   LYS  81          2HE       LYS  81  -3.090  11.695   7.939
  623   1HZ   LYS  81          1HZ       LYS  81  -5.213  13.470   6.970
  624   2HZ   LYS  81          2HZ       LYS  81  -3.707  13.354   6.316
  625   3HZ   LYS  81          3HZ       LYS  81  -3.898  13.908   7.860
  626    H    GLY  82           H        GLY  82  -3.740  10.649   2.588
  627   1HA   GLY  82          2HA       GLY  82  -3.548  12.586   1.178
  628   2HA   GLY  82          1HA       GLY  82  -4.704  13.441   2.220
  629    H    GLY  83           H        GLY  83  -1.449  13.337   1.537
  630   1HA   GLY  83          2HA       GLY  83   0.251  14.485   2.554
  631   2HA   GLY  83          1HA       GLY  83  -0.809  14.880   3.900
  632    H    LYS  84           HN       LYS  84  -1.394  12.735   5.179
  633    HA   LYS  84           HA       LYS  84   1.172  11.301   5.806
  634   1HB   LYS  84          2HB       LYS  84  -0.779  12.562   7.775
  635   2HB   LYS  84          1HB       LYS  84   0.664  11.646   8.213
  636   1HG   LYS  84          2HG       LYS  84   0.649  14.293   6.701
  637   2HG   LYS  84          1HG       LYS  84   0.974  14.077   8.420
  638   1HD   LYS  84          2HD       LYS  84   2.936  12.645   7.902
  639   2HD   LYS  84          1HD       LYS  84   2.683  12.901   6.168
  640   1HE   LYS  84          2HE       LYS  84   3.244  15.115   8.190
  641   2HE   LYS  84          1HE       LYS  84   4.434  14.376   7.106
  642   1HZ   LYS  84          1HZ       LYS  84   3.611  16.385   6.189
  643   2HZ   LYS  84          2HZ       LYS  84   2.052  15.861   6.258
  644   3HZ   LYS  84          3HZ       LYS  84   3.124  15.121   5.249
  645    H    LYS  85           HN       LYS  85   0.786   9.584   7.461
  646    HA   LYS  85           HA       LYS  85  -0.868   7.580   6.283
  647   1HB   LYS  85          2HB       LYS  85   0.723   7.695   8.872
  648   2HB   LYS  85          1HB       LYS  85  -0.171   6.270   8.316
  649   1HG   LYS  85          2HG       LYS  85   1.130   6.192   6.235
  650   2HG   LYS  85          1HG       LYS  85   2.033   7.633   6.731
  651   1HD   LYS  85          1HD       LYS  85   3.338   5.635   7.152
  652   2HD   LYS  85          2HD       LYS  85   2.942   6.435   8.686
  653   1HE   LYS  85          1HE       LYS  85   1.195   4.744   9.133
  654   2HE   LYS  85          2HE       LYS  85   1.462   4.029   7.530
  655   1HZ   LYS  85          1HZ       LYS  85   3.393   4.154   9.740
  656   2HZ   LYS  85          2HZ       LYS  85   3.703   3.529   8.249
  657   3HZ   LYS  85          3HZ       LYS  85   2.584   2.815   9.223
  658    H    CYS  86           H        CYS  86  -2.395   6.309   7.471
  659    HA   CYS  86           HA       CYS  86  -4.045   7.711   9.552
  660   1HB   CYS  86          1HB       CYS  86  -5.155   7.735   7.314
  661   2HB   CYS  86          2HB       CYS  86  -5.031   5.977   7.237
  662    HG   CYS  86           HG       CYS  86  -6.372   7.651   9.733
  663    H    GLU  87           HN       GLU  87  -3.476   4.621   7.898
  664    HA   GLU  87           HA       GLU  87  -3.229   3.143  10.466
  665   1HB   GLU  87          2HB       GLU  87  -5.146   2.546   8.164
  666   2HB   GLU  87          1HB       GLU  87  -4.705   1.348   9.374
  667   1HG   GLU  87          1HG       GLU  87  -6.031   4.029  10.036
  668   2HG   GLU  87          2HG       GLU  87  -6.882   2.545   9.789
  669    H    THR  88           H        THR  88  -2.479   0.796   9.943
  670    HA   THR  88           HA       THR  88  -1.248   0.348   7.426
  671    HB   THR  88           HB       THR  88   0.487   1.825   8.330
  672    HG1  THR  88           HG1      THR  88   1.101  -0.251   7.330
  673   1HG2  THR  88          1HG2      THR  88   0.561  -0.015  10.771
  674   2HG2  THR  88          2HG2      THR  88  -0.015   1.666  10.752
  675   3HG2  THR  88          3HG2      THR  88   1.689   1.304  10.437
  676    H    ILE  89           H        ILE  89  -0.550  -1.909   7.289
  677    HA   ILE  89           HA       ILE  89  -1.228  -3.650   9.594
  678    HB   ILE  89           HB       ILE  89  -2.342  -3.901   6.757
  679   1HG1  ILE  89          1HG1      ILE  89  -3.680  -2.425   8.224
  680   2HG1  ILE  89          2HG1      ILE  89  -4.509  -3.905   7.757
  681   1HG2  ILE  89          1HG2      ILE  89  -1.678  -6.126   7.376
  682   2HG2  ILE  89          2HG2      ILE  89  -2.324  -5.944   9.019
  683   3HG2  ILE  89          3HG2      ILE  89  -3.418  -6.022   7.623
  684   1HD1  ILE  89          1HD1      ILE  89  -4.128  -4.888   9.983
  685   2HD1  ILE  89          2HD1      ILE  89  -3.234  -3.438  10.491
  686   3HD1  ILE  89          3HD1      ILE  89  -4.948  -3.330  10.101
  687    H    ILE  90           H        ILE  90  -0.089  -5.673   9.446
  688    HA   ILE  90           HA       ILE  90   2.157  -5.730   7.503
  689    HB   ILE  90           HB       ILE  90   2.397  -6.097  10.529
  690   1HG1  ILE  90          2HG1      ILE  90   4.233  -4.193   9.903
  691   2HG1  ILE  90          1HG1      ILE  90   3.043  -3.818   8.665
  692   1HG2  ILE  90          1HG2      ILE  90   4.796  -6.406  10.079
  693   2HG2  ILE  90          2HG2      ILE  90   4.502  -6.308   8.331
  694   3HG2  ILE  90          3HG2      ILE  90   3.865  -7.661   9.295
  695   1HD1  ILE  90          1HD1      ILE  90   2.720  -2.475  10.704
  696   2HD1  ILE  90          2HD1      ILE  90   2.583  -3.946  11.686
  697   3HD1  ILE  90          3HD1      ILE  90   1.323  -3.540  10.505
  698    H    GLY  91           H        GLY  91   2.718  -7.781   6.874
  699   1HA   GLY  91          1HA       GLY  91   2.793 -10.103   6.945
  700   2HA   GLY  91          2HA       GLY  91   1.639 -10.146   8.284
  701    H    ALA  92           H        ALA  92   1.432 -11.915   6.205
  702    HA   ALA  92           HA       ALA  92  -0.404 -11.021   4.139
  703   1HB   ALA  92          1HB       ALA  92   1.197 -12.824   3.709
  704   2HB   ALA  92          2HB       ALA  92   0.537 -13.780   5.053
  705   3HB   ALA  92          3HB       ALA  92  -0.451 -13.481   3.616
  706    H    VAL  93           H        VAL  93  -2.631 -11.054   4.208
  707    HA   VAL  93           HA       VAL  93  -4.016 -12.796   6.087
  708    HB   VAL  93           HB       VAL  93  -5.498 -11.051   6.890
  709   1HG1  VAL  93          1HG2      VAL  93  -3.746  -9.082   5.358
  710   2HG1  VAL  93          2HG2      VAL  93  -5.470  -9.436   5.110
  711   3HG1  VAL  93          3HG2      VAL  93  -4.949  -8.631   6.586
  712   1HG2  VAL  93          1HG1      VAL  93  -4.057  -9.929   8.463
  713   2HG2  VAL  93          2HG1      VAL  93  -2.630 -10.207   7.452
  714   3HG2  VAL  93          3HG1      VAL  93  -3.465 -11.580   8.218
  715    HA   PRO  94           HA       PRO  94  -6.299 -13.394   2.360
  716   1HB   PRO  94          2HB       PRO  94  -8.815 -13.286   4.028
  717   2HB   PRO  94          1HB       PRO  94  -8.366 -14.492   2.793
  718   1HG   PRO  94          2HG       PRO  94  -8.079 -15.079   5.431
  719   2HG   PRO  94          1HG       PRO  94  -6.771 -15.501   4.285
  720   1HD   PRO  94          2HD       PRO  94  -6.904 -13.135   6.168
  721   2HD   PRO  94          1HD       PRO  94  -5.552 -14.239   5.791
  722    H    LYS  95           HN       LYS  95  -7.644 -12.410   0.812
  723    HA   LYS  95           HA       LYS  95  -7.794  -9.698   0.533
  724   1HB   LYS  95          1HB       LYS  95  -8.304 -11.453  -1.223
  725   2HB   LYS  95          2HB       LYS  95  -9.862 -11.735  -0.467
  726   1HG   LYS  95          2HG       LYS  95 -10.443  -9.297  -0.842
  727   2HG   LYS  95          1HG       LYS  95  -8.936  -9.128  -1.751
  728   1HD   LYS  95          1HD       LYS  95  -9.723 -10.775  -3.402
  729   2HD   LYS  95          2HD       LYS  95 -11.170 -11.095  -2.422
  730   1HE   LYS  95          2HE       LYS  95 -11.867  -8.709  -2.664
  731   2HE   LYS  95          1HE       LYS  95 -10.456  -8.405  -3.687
  732   1HZ   LYS  95          1HZ       LYS  95 -12.619 -10.310  -4.269
  733   2HZ   LYS  95          2HZ       LYS  95 -11.340  -9.971  -5.258
  734   3HZ   LYS  95          3HZ       LYS  95 -12.455  -8.804  -4.918
  735    H    ALA  96           H        ALA  96 -10.379 -11.837   1.672
  736    HA   ALA  96           HA       ALA  96 -12.402  -9.990   2.236
  737   1HB   ALA  96          1HB       ALA  96 -13.218 -11.636   3.897
  738   2HB   ALA  96          2HB       ALA  96 -12.690 -12.438   2.404
  739   3HB   ALA  96          3HB       ALA  96 -11.653 -12.477   3.849
  740    H    THR  97           H        THR  97  -9.607 -10.909   4.328
  741    HA   THR  97           HA       THR  97 -10.442  -9.304   6.559
  742    HB   THR  97           HB       THR  97  -7.626 -10.247   5.885
  743    HG1  THR  97           HG1      THR  97  -9.788 -11.680   7.038
  744   1HG2  THR  97          1HG2      THR  97  -7.462 -10.456   8.349
  745   2HG2  THR  97          2HG2      THR  97  -7.840  -8.790   7.875
  746   3HG2  THR  97          3HG2      THR  97  -9.117  -9.841   8.523
  747    H    ILE  98           H        ILE  98  -8.093  -8.869   3.846
  748    HA   ILE  98           HA       ILE  98  -7.128  -6.312   4.594
  749    HB   ILE  98           HB       ILE  98  -7.562  -7.437   1.775
  750   1HG1  ILE  98          2HG1      ILE  98  -5.120  -7.449   3.599
  751   2HG1  ILE  98          1HG1      ILE  98  -6.101  -8.840   3.107
  752   1HG2  ILE  98          1HG2      ILE  98  -5.803  -5.127   2.756
  753   2HG2  ILE  98          2HG2      ILE  98  -7.287  -4.923   1.810
  754   3HG2  ILE  98          3HG2      ILE  98  -5.903  -5.715   1.086
  755   1HD1  ILE  98          1HD1      ILE  98  -4.288  -7.216   1.314
  756   2HD1  ILE  98          2HD1      ILE  98  -5.477  -8.405   0.720
  757   3HD1  ILE  98          3HD1      ILE  98  -4.153  -8.911   1.787
  758    H    VAL  99           H        VAL  99  -9.795  -7.079   2.323
  759    HA   VAL  99           HA       VAL  99 -10.698  -4.480   1.825
  760    HB   VAL  99           HB       VAL  99 -12.149  -7.159   1.887
  761   1HG1  VAL  99          1HG1      VAL  99 -13.111  -4.454   0.874
  762   2HG1  VAL  99          2HG1      VAL  99 -13.854  -6.001   0.416
  763   3HG1  VAL  99          3HG1      VAL  99 -13.894  -5.473   2.101
  764   1HG2  VAL  99          1HG2      VAL  99 -11.897  -7.011  -0.567
  765   2HG2  VAL  99          2HG2      VAL  99 -11.114  -5.426  -0.414
  766   3HG2  VAL  99          3HG2      VAL  99 -10.302  -6.878   0.189
  767    H    GLN 100           H        GLN 100 -11.993  -6.781   4.345
  768    HA   GLN 100           HA       GLN 100 -13.848  -4.932   5.432
  769   1HB   GLN 100          2HB       GLN 100 -12.317  -7.266   6.632
  770   2HB   GLN 100          1HB       GLN 100 -13.503  -6.337   7.563
  771   1HG   GLN 100          1HG       GLN 100 -15.284  -6.835   6.050
  772   2HG   GLN 100          2HG       GLN 100 -14.203  -7.602   4.882
  773   1HE2  GLN 100          1HE2      GLN 100 -12.866  -9.439   5.794
  774   2HE2  GLN 100          2HE2      GLN 100 -13.707 -10.587   6.854
  775    H    THR 101           H        THR 101 -10.434  -5.518   6.311
  776    HA   THR 101           HA       THR 101 -10.344  -3.684   8.494
  777    HB   THR 101           HB       THR 101  -8.097  -4.611   6.638
  778    HG1  THR 101           HG1      THR 101  -9.109  -6.329   7.625
  779   1HG2  THR 101          1HG2      THR 101  -7.312  -2.727   7.955
  780   2HG2  THR 101          2HG2      THR 101  -8.059  -3.382   9.432
  781   3HG2  THR 101          3HG2      THR 101  -6.689  -4.218   8.678
  782    H    VAL 102           H        VAL 102  -9.696  -3.184   4.969
  783    HA   VAL 102           HA       VAL 102  -8.954  -0.413   5.286
  784    HB   VAL 102           HB       VAL 102 -10.055  -2.021   2.941
  785   1HG1  VAL 102          1HG1      VAL 102  -7.286  -0.874   3.503
  786   2HG1  VAL 102          2HG1      VAL 102  -7.758  -1.884   2.117
  787   3HG1  VAL 102          3HG1      VAL 102  -7.730  -2.568   3.748
  788   1HG2  VAL 102          1HG2      VAL 102  -9.323  -0.130   1.508
  789   2HG2  VAL 102          2HG2      VAL 102 -10.683   0.321   2.537
  790   3HG2  VAL 102          3HG2      VAL 102  -9.040   0.856   2.959
  791    H    GLU 103           HN       GLU 103 -12.011  -1.961   4.313
  792    HA   GLU 103           HA       GLU 103 -13.643   0.239   4.033
  793   1HB   GLU 103          1HB       GLU 103 -14.181  -2.564   5.073
  794   2HB   GLU 103          2HB       GLU 103 -15.480  -1.404   4.846
  795   1HG   GLU 103          2HG       GLU 103 -13.577  -1.957   2.546
  796   2HG   GLU 103          1HG       GLU 103 -14.868  -3.101   2.936
  797    H    LYS 104           HN       LYS 104 -13.316  -1.625   7.072
  798    HA   LYS 104           HA       LYS 104 -14.966   0.100   8.578
  799   1HB   LYS 104          1HB       LYS 104 -14.101  -1.006  10.550
  800   2HB   LYS 104          2HB       LYS 104 -14.413  -2.143   9.248
  801   1HG   LYS 104          2HG       LYS 104 -12.413  -2.977   9.943
  802   2HG   LYS 104          1HG       LYS 104 -11.857  -1.814   8.750
  803   1HD   LYS 104          2HD       LYS 104 -10.438  -1.534  10.600
  804   2HD   LYS 104          1HD       LYS 104 -11.532  -0.147  10.665
  805   1HE   LYS 104          2HE       LYS 104 -12.888  -1.296  12.413
  806   2HE   LYS 104          1HE       LYS 104 -11.814  -2.704  12.312
  807   1HZ   LYS 104          1HZ       LYS 104 -11.021   0.007  13.108
  808   2HZ   LYS 104          2HZ       LYS 104 -10.021  -1.301  13.023
  809   3HZ   LYS 104          3HZ       LYS 104 -11.250  -1.273  14.120
  810    H    TYR 105           H        TYR 105 -11.720   0.878   7.479
  811    HA   TYR 105           HA       TYR 105 -11.325   2.863   9.641
  812   1HB   TYR 105          2HB       TYR 105  -9.832   2.585   7.008
  813   2HB   TYR 105          1HB       TYR 105  -9.358   3.506   8.411
  814    HD1  TYR 105           HD1      TYR 105  -9.810   1.521  10.634
  815    HD2  TYR 105           HD2      TYR 105  -7.942   1.204   6.759
  816    HE1  TYR 105           HE1      TYR 105  -8.138  -0.025  11.566
  817    HE2  TYR 105           HE2      TYR 105  -6.262  -0.347   7.706
  818    HH   TYR 105           HH       TYR 105  -5.776  -0.430  11.092
  819    H    LEU 106           H        LEU 106 -12.919   2.633   6.555
  820    HA   LEU 106           HA       LEU 106 -13.003   5.575   6.164
  821   1HB   LEU 106          2HB       LEU 106 -13.879   3.297   4.350
  822   2HB   LEU 106          1HB       LEU 106 -13.785   5.008   3.924
  823    HG   LEU 106           HG       LEU 106 -11.407   3.215   4.629
  824   1HD1  LEU 106          1HD2      LEU 106 -10.042   5.112   3.755
  825   2HD1  LEU 106          2HD2      LEU 106 -11.510   6.106   3.654
  826   3HD1  LEU 106          3HD2      LEU 106 -10.911   5.544   5.232
  827   1HD2  LEU 106          1HD1      LEU 106 -10.868   3.369   2.242
  828   2HD2  LEU 106          2HD1      LEU 106 -12.464   2.636   2.482
  829   3HD2  LEU 106          3HD1      LEU 106 -12.336   4.328   1.953
  830    H    ASN 107           H        ASN 107 -15.108   2.708   6.535
  831    HA   ASN 107           HA       ASN 107 -17.310   4.306   7.559
  832   1HB   ASN 107          2HB       ASN 107 -18.865   3.348   5.758
  833   2HB   ASN 107          1HB       ASN 107 -17.852   4.720   5.312
  834   1HD2  ASN 107          2HD2      ASN 107 -16.784   1.271   5.448
  835   2HD2  ASN 107          1HD2      ASN 107 -16.470   1.152   3.705
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1  -3.047  -5.428 -13.758
    2   2H    MET   1          2H        MET   1  -4.343  -4.417 -13.758
    3   3H    MET   1          3H        MET   1  -3.591  -4.790 -12.350
    4    HA   MET   1           HA       MET   1  -1.673  -3.542 -12.928
    5   1HB   MET   1          1HB       MET   1  -1.499  -2.502 -15.184
    6   2HB   MET   1          2HB       MET   1  -1.440  -4.260 -15.214
    7   1HG   MET   1          1HG       MET   1  -4.024  -2.740 -15.778
    8   2HG   MET   1          2HG       MET   1  -2.828  -3.106 -17.020
    9   1HE   MET   1          1HE       MET   1  -6.099  -5.457 -17.383
   10   2HE   MET   1          2HE       MET   1  -6.115  -3.957 -16.428
   11   3HE   MET   1          3HE       MET   1  -5.321  -3.990 -18.023
   12    H    GLU   2           HN       GLU   2  -3.567  -2.789 -11.260
   13    HA   GLU   2           HA       GLU   2  -4.420  -0.062 -12.130
   14   1HB   GLU   2          2HB       GLU   2  -6.006  -1.982 -10.381
   15   2HB   GLU   2          1HB       GLU   2  -6.432  -0.323 -10.825
   16   1HG   GLU   2          1HG       GLU   2  -7.664  -1.505 -12.420
   17   2HG   GLU   2          2HG       GLU   2  -6.183  -1.205 -13.318
   18    H    ALA   3           H        ALA   3  -3.507  -2.152  -9.369
   19    HA   ALA   3           HA       ALA   3  -3.097   0.068  -7.543
   20   1HB   ALA   3          1HB       ALA   3  -1.872  -2.709  -7.690
   21   2HB   ALA   3          2HB       ALA   3  -3.231  -2.203  -6.670
   22   3HB   ALA   3          3HB       ALA   3  -1.623  -1.552  -6.350
   23    H    GLY   4           H        GLY   4  -1.468   1.627  -7.730
   24   1HA   GLY   4          1HA       GLY   4   0.403   1.444  -9.923
   25   2HA   GLY   4          2HA       GLY   4   0.352   2.694  -8.675
   26    H    ALA   5           H        ALA   5   2.759   1.844  -9.590
   27    HA   ALA   5           HA       ALA   5   3.934   0.271  -7.340
   28   1HB   ALA   5          1HB       ALA   5   5.795  -0.208  -8.862
   29   2HB   ALA   5          2HB       ALA   5   4.942   0.609 -10.190
   30   3HB   ALA   5          3HB       ALA   5   4.268  -0.877  -9.476
   31    H    VAL   6           H        VAL   6   5.031   1.628  -6.007
   32    HA   VAL   6           HA       VAL   6   5.883   4.313  -7.030
   33    HB   VAL   6           HB       VAL   6   5.745   4.903  -4.496
   34   1HG1  VAL   6          1HG1      VAL   6   4.025   3.822  -3.206
   35   2HG1  VAL   6          2HG1      VAL   6   3.613   2.726  -4.536
   36   3HG1  VAL   6          3HG1      VAL   6   5.183   2.591  -3.728
   37   1HG2  VAL   6          1HG2      VAL   6   4.415   6.021  -6.142
   38   2HG2  VAL   6          2HG2      VAL   6   3.291   4.647  -6.246
   39   3HG2  VAL   6          3HG2      VAL   6   3.394   5.612  -4.754
   40    H    ASN   7           H        ASN   7   7.703   5.217  -5.938
   41    HA   ASN   7           HA       ASN   7   9.592   3.365  -4.680
   42   1HB   ASN   7          2HB       ASN   7  10.269   3.271  -6.996
   43   2HB   ASN   7          1HB       ASN   7  10.131   5.034  -7.185
   44   1HD2  ASN   7          2HD2      ASN   7  11.788   2.699  -4.953
   45   2HD2  ASN   7          1HD2      ASN   7  13.377   3.392  -5.127
   46    H    ASP   8           HN       ASP   8  11.451   4.809  -3.915
   47    HA   ASP   8           HA       ASP   8  10.661   6.531  -1.929
   48   1HB   ASP   8          2HB       ASP   8  13.198   6.791  -3.620
   49   2HB   ASP   8          1HB       ASP   8  12.943   7.574  -2.059
   50    H    ASP   9           HN       ASP   9  11.451   7.498  -5.236
   51    HA   ASP   9           HA       ASP   9  10.969  10.311  -4.880
   52   1HB   ASP   9          2HB       ASP   9  12.289   9.496  -6.744
   53   2HB   ASP   9          1HB       ASP   9  10.957   8.533  -7.370
   54    H    THR  10           H        THR  10   8.990   8.177  -6.964
   55    HA   THR  10           HA       THR  10   6.783   9.816  -7.202
   56    HB   THR  10           HB       THR  10   5.571   7.588  -7.687
   57    HG1  THR  10           HG1      THR  10   7.171   5.870  -7.941
   58   1HG2  THR  10          1HG2      THR  10   6.875   7.232  -9.754
   59   2HG2  THR  10          2HG2      THR  10   6.679   8.960  -9.425
   60   3HG2  THR  10          3HG2      THR  10   8.228   8.167  -9.086
   61    H    PHE  11           H        PHE  11   7.371   7.512  -4.572
   62    HA   PHE  11           HA       PHE  11   5.033   7.351  -3.157
   63   1HB   PHE  11          1HB       PHE  11   7.233   6.466  -2.500
   64   2HB   PHE  11          2HB       PHE  11   7.811   8.062  -2.143
   65    HD1  PHE  11           HD1      PHE  11   5.535   5.350  -1.028
   66    HD2  PHE  11           HD2      PHE  11   7.308   9.149  -0.018
   67    HE1  PHE  11           HE1      PHE  11   5.002   4.966   1.360
   68    HE2  PHE  11           HE2      PHE  11   6.707   8.789   2.359
   69    HZ   PHE  11           HZ       PHE  11   5.552   6.694   3.050
   70    H    LYS  12           HN       LYS  12   7.276  10.040  -3.208
   71    HA   LYS  12           HA       LYS  12   6.136  11.829  -1.352
   72   1HB   LYS  12          1HB       LYS  12   7.426  12.403  -4.054
   73   2HB   LYS  12          2HB       LYS  12   7.007  13.614  -2.869
   74   1HG   LYS  12          1HG       LYS  12   8.553  12.583  -1.212
   75   2HG   LYS  12          2HG       LYS  12   8.839  11.213  -2.297
   76   1HD   LYS  12          2HD       LYS  12   9.807  12.738  -4.001
   77   2HD   LYS  12          1HD       LYS  12   9.638  14.096  -2.867
   78   1HE   LYS  12          2HE       LYS  12  11.125  12.923  -1.252
   79   2HE   LYS  12          1HE       LYS  12  11.243  11.538  -2.356
   80   1HZ   LYS  12          1HZ       LYS  12  13.123  12.976  -2.545
   81   2HZ   LYS  12          2HZ       LYS  12  12.273  12.969  -3.958
   82   3HZ   LYS  12          3HZ       LYS  12  12.169  14.262  -2.939
   83    H    ASN  13           H        ASN  13   5.378  11.651  -4.873
   84    HA   ASN  13           HA       ASN  13   3.335  13.729  -4.638
   85   1HB   ASN  13          1HB       ASN  13   4.204  11.885  -6.896
   86   2HB   ASN  13          2HB       ASN  13   3.045  13.193  -7.067
   87   1HD2  ASN  13          2HD2      ASN  13   4.009  15.434  -5.886
   88   2HD2  ASN  13          1HD2      ASN  13   5.599  15.794  -6.532
   89    H    VAL  14           H        VAL  14   3.546  10.274  -4.815
   90    HA   VAL  14           HA       VAL  14   0.668   9.944  -5.515
   91    HB   VAL  14           HB       VAL  14   2.989   7.989  -5.249
   92   1HG1  VAL  14          1HG1      VAL  14   1.605   9.162  -7.707
   93   2HG1  VAL  14          2HG1      VAL  14   3.233   9.591  -7.154
   94   3HG1  VAL  14          3HG1      VAL  14   2.905   7.955  -7.727
   95   1HG2  VAL  14          1HG2      VAL  14   1.530   6.439  -6.574
   96   2HG2  VAL  14          2HG2      VAL  14   0.169   7.543  -6.303
   97   3HG2  VAL  14          3HG2      VAL  14   0.946   6.715  -4.929
   98    H    VAL  15           H        VAL  15   2.656   9.598  -2.650
   99    HA   VAL  15           HA       VAL  15   0.413   8.238  -1.211
  100    HB   VAL  15           HB       VAL  15   3.404   8.142  -0.626
  101   1HG1  VAL  15          1HG1      VAL  15   2.031   7.884   1.357
  102   2HG1  VAL  15          2HG1      VAL  15   1.114   6.580   0.571
  103   3HG1  VAL  15          3HG1      VAL  15   2.842   6.397   0.936
  104   1HG2  VAL  15          1HG2      VAL  15   1.636   6.043  -1.940
  105   2HG2  VAL  15          2HG2      VAL  15   2.857   7.003  -2.784
  106   3HG2  VAL  15          3HG2      VAL  15   3.361   5.885  -1.539
  107    H    LEU  16           H        LEU  16   3.150  10.543  -0.748
  108    HA   LEU  16           HA       LEU  16   2.000  11.443   1.789
  109   1HB   LEU  16          2HB       LEU  16   4.236  12.521   0.034
  110   2HB   LEU  16          1HB       LEU  16   3.733  13.271   1.520
  111    HG   LEU  16           HG       LEU  16   4.834  10.434   1.143
  112   1HD1  LEU  16          1HD1      LEU  16   6.811  11.297   2.336
  113   2HD1  LEU  16          2HD1      LEU  16   6.046  12.896   2.467
  114   3HD1  LEU  16          3HD1      LEU  16   6.498  12.251   0.877
  115   1HD2  LEU  16          1HD2      LEU  16   4.007  11.857   3.715
  116   2HD2  LEU  16          2HD2      LEU  16   5.015  10.399   3.663
  117   3HD2  LEU  16          3HD2      LEU  16   3.357  10.324   3.079
  118    H    GLU  17           HN       GLU  17   2.552  13.186  -1.261
  119    HA   GLU  17           HA       GLU  17   0.753  15.317  -0.561
  120   1HB   GLU  17          2HB       GLU  17   2.866  15.227  -2.080
  121   2HB   GLU  17          1HB       GLU  17   1.769  14.595  -3.318
  122   1HG   GLU  17          1HG       GLU  17   0.497  16.742  -3.240
  123   2HG   GLU  17          2HG       GLU  17   1.571  17.311  -1.953
  124    H    SER  18           H        SER  18  -0.664  12.707  -0.567
  125    HA   SER  18           HA       SER  18  -2.412  12.764  -2.927
  126   1HB   SER  18          1HB       SER  18  -2.562  10.867  -0.566
  127   2HB   SER  18          2HB       SER  18  -3.099  10.628  -2.248
  128    HG   SER  18           HG       SER  18  -1.154   9.734  -2.394
  129    H    SER  19           H        SER  19  -4.447  13.573  -2.945
  130    HA   SER  19           HA       SER  19  -5.567  15.023  -0.689
  131   1HB   SER  19          1HB       SER  19  -7.424  15.222  -2.519
  132   2HB   SER  19          2HB       SER  19  -5.850  15.979  -2.848
  133    HG   SER  19           HG       SER  19  -6.552  14.669  -4.617
  134    H    VAL  20           H        VAL  20  -6.432  12.277  -2.773
  135    HA   VAL  20           HA       VAL  20  -8.372  11.165  -0.846
  136    HB   VAL  20           HB       VAL  20  -8.142   9.119  -2.396
  137   1HG1  VAL  20          1HG1      VAL  20  -7.266   9.404  -4.617
  138   2HG1  VAL  20          2HG1      VAL  20  -6.839  11.091  -4.319
  139   3HG1  VAL  20          3HG1      VAL  20  -5.976   9.784  -3.472
  140   1HG2  VAL  20          1HG2      VAL  20  -9.619  10.034  -4.124
  141   2HG2  VAL  20          2HG2      VAL  20 -10.095  10.536  -2.498
  142   3HG2  VAL  20          3HG2      VAL  20  -9.252  11.682  -3.574
  143    HA   PRO  21           HA       PRO  21  -5.128   9.083   1.327
  144   1HB   PRO  21          1HB       PRO  21  -6.287   6.830   2.374
  145   2HB   PRO  21          2HB       PRO  21  -6.735   8.463   2.920
  146   1HG   PRO  21          1HG       PRO  21  -8.129   6.737   0.859
  147   2HG   PRO  21          2HG       PRO  21  -8.859   7.605   2.234
  148   1HD   PRO  21          1HD       PRO  21  -8.836   8.590  -0.349
  149   2HD   PRO  21          2HD       PRO  21  -8.736   9.684   1.056
  150    H    VAL  22           H        VAL  22  -3.893   7.005   1.321
  151    HA   VAL  22           HA       VAL  22  -4.385   5.195  -0.879
  152    HB   VAL  22           HB       VAL  22  -2.823   7.515  -1.383
  153   1HG1  VAL  22          1HG1      VAL  22  -0.861   6.460  -0.538
  154   2HG1  VAL  22          2HG1      VAL  22  -0.787   6.501  -2.311
  155   3HG1  VAL  22          3HG1      VAL  22  -1.145   4.987  -1.470
  156   1HG2  VAL  22          1HG2      VAL  22  -3.479   4.976  -2.931
  157   2HG2  VAL  22          2HG2      VAL  22  -4.463   6.445  -2.845
  158   3HG2  VAL  22          3HG2      VAL  22  -2.905   6.501  -3.656
  159    H    LEU  23           H        LEU  23  -3.639   3.169  -0.690
  160    HA   LEU  23           HA       LEU  23  -2.242   2.510   1.799
  161   1HB   LEU  23          2HB       LEU  23  -4.430   1.575   1.168
  162   2HB   LEU  23          1HB       LEU  23  -3.676   0.769  -0.216
  163    HG   LEU  23           HG       LEU  23  -2.717   0.217   2.574
  164   1HD1  LEU  23          1HD2      LEU  23  -2.288  -2.061   1.404
  165   2HD1  LEU  23          2HD2      LEU  23  -1.280  -0.733   0.835
  166   3HD1  LEU  23          3HD2      LEU  23  -2.679  -1.265  -0.118
  167   1HD2  LEU  23          1HD1      LEU  23  -5.035  -1.094   1.085
  168   2HD2  LEU  23          2HD1      LEU  23  -4.322  -1.697   2.593
  169   3HD2  LEU  23          3HD1      LEU  23  -5.151  -0.136   2.578
  170    H    VAL  24           H        VAL  24  -0.112   2.208   1.656
  171    HA   VAL  24           HA       VAL  24   1.106   1.337  -0.913
  172    HB   VAL  24           HB       VAL  24   2.328   2.598   1.586
  173   1HG1  VAL  24          1HG1      VAL  24   3.579   1.769  -1.068
  174   2HG1  VAL  24          2HG1      VAL  24   3.929   1.036   0.512
  175   3HG1  VAL  24          3HG1      VAL  24   4.394   2.711   0.205
  176   1HG2  VAL  24          1HG2      VAL  24   1.843   3.648  -1.239
  177   2HG2  VAL  24          2HG2      VAL  24   1.053   4.219   0.252
  178   3HG2  VAL  24          3HG2      VAL  24   2.800   4.441   0.028
  179    H    ASP  25           HN       ASP  25   1.275  -0.832  -0.989
  180    HA   ASP  25           HA       ASP  25   1.761  -2.385   1.514
  181   1HB   ASP  25          2HB       ASP  25   0.252  -3.443  -0.050
  182   2HB   ASP  25          1HB       ASP  25   1.411  -3.214  -1.363
  183    H    PHE  26           H        PHE  26   3.883  -2.415   2.224
  184    HA   PHE  26           HA       PHE  26   6.050  -1.672   0.357
  185   1HB   PHE  26          2HB       PHE  26   5.992  -2.484   3.276
  186   2HB   PHE  26          1HB       PHE  26   7.469  -2.265   2.357
  187    HD1  PHE  26           HD1      PHE  26   8.530  -0.190   2.414
  188    HD2  PHE  26           HD2      PHE  26   4.263  -0.333   3.087
  189    HE1  PHE  26           HE1      PHE  26   8.507   2.233   2.898
  190    HE2  PHE  26           HE2      PHE  26   4.263   2.070   3.590
  191    HZ   PHE  26           HZ       PHE  26   6.392   3.367   3.540
  192    H    TRP  27           H        TRP  27   6.654  -3.219  -1.078
  193    HA   TRP  27           HA       TRP  27   6.364  -6.100  -0.326
  194   1HB   TRP  27          1HB       TRP  27   5.437  -6.580  -2.474
  195   2HB   TRP  27          2HB       TRP  27   4.578  -5.175  -1.896
  196    HD1  TRP  27           HD1      TRP  27   5.580  -2.807  -2.939
  197    HE1  TRP  27           HE1      TRP  27   6.552  -2.257  -5.294
  198    HE3  TRP  27           HE3      TRP  27   6.467  -7.555  -4.569
  199    HZ2  TRP  27           HZ2      TRP  27   7.595  -3.710  -7.515
  200    HZ3  TRP  27           HZ3      TRP  27   7.501  -7.941  -6.781
  201    HH2  TRP  27           HH2      TRP  27   8.051  -6.037  -8.270
  202    H    ALA  28           H        ALA  28   7.364  -7.356  -2.381
  203    HA   ALA  28           HA       ALA  28   9.624  -6.275  -3.670
  204   1HB   ALA  28          1HB       ALA  28  10.716  -6.464  -1.406
  205   2HB   ALA  28          2HB       ALA  28  11.403  -7.612  -2.553
  206   3HB   ALA  28          3HB       ALA  28  10.242  -8.179  -1.349
  207    HA   PRO  29           HA       PRO  29   8.468  -9.895  -6.020
  208   1HB   PRO  29          1HB       PRO  29  10.810 -10.677  -7.246
  209   2HB   PRO  29          2HB       PRO  29   9.846  -9.257  -7.745
  210   1HG   PRO  29          1HG       PRO  29  12.306  -9.305  -5.983
  211   2HG   PRO  29          2HG       PRO  29  11.935  -8.188  -7.324
  212   1HD   PRO  29          1HD       PRO  29  11.506  -7.473  -4.738
  213   2HD   PRO  29          2HD       PRO  29  10.353  -6.999  -5.996
  214    H    TRP  30           H        TRP  30  11.496 -10.194  -4.150
  215    HA   TRP  30           HA       TRP  30  11.333 -13.039  -3.790
  216   1HB   TRP  30          1HB       TRP  30  13.006 -12.571  -1.978
  217   2HB   TRP  30          2HB       TRP  30  13.434 -12.004  -3.583
  218    HD1  TRP  30           HD1      TRP  30  14.127  -9.559  -3.844
  219    HE1  TRP  30           HE1      TRP  30  14.415  -7.549  -2.266
  220    HE3  TRP  30           HE3      TRP  30  11.694 -11.408   0.275
  221    HZ2  TRP  30           HZ2      TRP  30  13.464  -6.756   0.338
  222    HZ3  TRP  30           HZ3      TRP  30  11.298  -9.959   2.234
  223    HH2  TRP  30           HH2      TRP  30  12.015  -7.594   2.211
  224    H    CYS  31           H        CYS  31   9.412 -10.480  -2.420
  225    HA   CYS  31           HA       CYS  31   9.084 -11.855   0.185
  226   1HB   CYS  31          2HB       CYS  31   9.032  -9.497   0.250
  227   2HB   CYS  31          1HB       CYS  31   7.770  -9.405  -0.988
  228    H    GLY  32           H        GLY  32   8.398 -13.893  -0.644
  229   1HA   GLY  32          1HA       GLY  32   6.309 -14.701  -2.147
  230   2HA   GLY  32          2HA       GLY  32   6.625 -15.424  -0.564
  231    HA   PRO  33           HA       PRO  33   2.793 -13.984   1.027
  232   1HB   PRO  33          2HB       PRO  33   3.216 -12.255   3.164
  233   2HB   PRO  33          1HB       PRO  33   3.341 -14.028   3.212
  234   1HG   PRO  33          2HG       PRO  33   5.613 -12.052   2.869
  235   2HG   PRO  33          1HG       PRO  33   5.508 -13.467   3.942
  236   1HD   PRO  33          2HD       PRO  33   6.797 -13.567   1.567
  237   2HD   PRO  33          1HD       PRO  33   5.782 -14.926   2.118
  238    H    CYS  34           H        CYS  34   4.947 -11.445  -0.118
  239    HA   CYS  34           HA       CYS  34   2.781  -9.422  -0.187
  240   1HB   CYS  34          2HB       CYS  34   5.480  -9.288  -1.572
  241   2HB   CYS  34          1HB       CYS  34   4.312  -8.016  -1.234
  242    H    ARG  35           HN       ARG  35   4.800 -11.387  -2.344
  243    HA   ARG  35           HA       ARG  35   3.800 -10.703  -4.822
  244   1HB   ARG  35          2HB       ARG  35   5.773 -12.256  -4.077
  245   2HB   ARG  35          1HB       ARG  35   4.591 -13.550  -4.052
  246   1HG   ARG  35          1HG       ARG  35   5.794 -13.586  -6.130
  247   2HG   ARG  35          2HG       ARG  35   4.110 -13.153  -6.476
  248   1HD   ARG  35          2HD       ARG  35   4.699 -10.839  -6.824
  249   2HD   ARG  35          1HD       ARG  35   6.324 -11.087  -6.128
  250    HE   ARG  35           HE       ARG  35   6.132 -12.822  -8.303
  251   1HH1  ARG  35          2HH2      ARG  35   5.977  -9.338  -7.769
  252   2HH1  ARG  35          1HH2      ARG  35   6.633  -8.916  -9.327
  253   1HH2  ARG  35          1HH1      ARG  35   7.007 -12.299 -10.341
  254   2HH2  ARG  35          2HH1      ARG  35   7.233 -10.639 -10.819
  255    H    ILE  36           H        ILE  36   2.664 -13.301  -2.657
  256    HA   ILE  36           HA       ILE  36   0.515 -14.074  -4.444
  257    HB   ILE  36           HB       ILE  36  -0.290 -15.472  -2.611
  258   1HG1  ILE  36          2HG1      ILE  36   1.483 -15.471  -0.575
  259   2HG1  ILE  36          1HG1      ILE  36   1.512 -13.745  -0.934
  260   1HG2  ILE  36          1HG2      ILE  36   1.595 -16.159  -4.074
  261   2HG2  ILE  36          2HG2      ILE  36   1.675 -16.886  -2.463
  262   3HG2  ILE  36          3HG2      ILE  36   2.748 -15.539  -2.878
  263   1HD1  ILE  36          1HD1      ILE  36  -0.158 -14.246   0.780
  264   2HD1  ILE  36          2HD1      ILE  36  -1.025 -13.756  -0.689
  265   3HD1  ILE  36          3HD1      ILE  36  -0.917 -15.471  -0.254
  266    H    ILE  37           H        ILE  37   0.715 -11.351  -2.262
  267    HA   ILE  37           HA       ILE  37  -2.226 -11.019  -2.192
  268    HB   ILE  37           HB       ILE  37   0.125  -9.524  -0.951
  269   1HG1  ILE  37          1HG1      ILE  37  -0.476 -11.646   0.138
  270   2HG1  ILE  37          2HG1      ILE  37  -0.809 -10.249   1.156
  271   1HG2  ILE  37          1HG2      ILE  37  -2.818  -8.769  -0.975
  272   2HG2  ILE  37          2HG2      ILE  37  -1.400  -7.798  -1.430
  273   3HG2  ILE  37          3HG2      ILE  37  -1.670  -8.209   0.262
  274   1HD1  ILE  37          1HD1      ILE  37  -3.249 -10.454   0.510
  275   2HD1  ILE  37          2HD1      ILE  37  -2.841 -11.956  -0.353
  276   3HD1  ILE  37          3HD1      ILE  37  -2.596 -11.844   1.386
  277    H    ALA  38           H        ALA  38   0.621  -9.748  -3.854
  278    HA   ALA  38           HA       ALA  38  -0.039  -7.562  -5.111
  279   1HB   ALA  38          1HB       ALA  38   1.214  -8.177  -7.018
  280   2HB   ALA  38          2HB       ALA  38   1.951  -8.933  -5.595
  281   3HB   ALA  38          3HB       ALA  38   0.991  -9.902  -6.733
  282    HA   PRO  39           HA       PRO  39  -3.039  -9.409  -8.400
  283   1HB   PRO  39          1HB       PRO  39  -4.214 -11.833  -7.118
  284   2HB   PRO  39          2HB       PRO  39  -3.654 -11.620  -8.797
  285   1HG   PRO  39          1HG       PRO  39  -2.237 -13.132  -7.004
  286   2HG   PRO  39          2HG       PRO  39  -1.396 -12.067  -8.175
  287   1HD   PRO  39          1HD       PRO  39  -2.142 -11.426  -5.304
  288   2HD   PRO  39          2HD       PRO  39  -0.543 -11.312  -6.072
  289    H    VAL  40           H        VAL  40  -3.646  -9.991  -4.963
  290    HA   VAL  40           HA       VAL  40  -6.488  -9.457  -5.027
  291    HB   VAL  40           HB       VAL  40  -4.599  -9.571  -2.626
  292   1HG1  VAL  40          1HG1      VAL  40  -6.651 -10.211  -1.438
  293   2HG1  VAL  40          2HG1      VAL  40  -6.809  -8.605  -2.177
  294   3HG1  VAL  40          3HG1      VAL  40  -7.581 -10.012  -2.946
  295   1HG2  VAL  40          1HG2      VAL  40  -4.352 -11.685  -3.869
  296   2HG2  VAL  40          2HG2      VAL  40  -6.117 -11.820  -4.019
  297   3HG2  VAL  40          3HG2      VAL  40  -5.336 -11.945  -2.429
  298    H    VAL  41           H        VAL  41  -3.629  -7.746  -3.717
  299    HA   VAL  41           HA       VAL  41  -4.947  -5.182  -3.155
  300    HB   VAL  41           HB       VAL  41  -2.571  -6.316  -2.609
  301   1HG1  VAL  41          1HG2      VAL  41  -3.538  -3.949  -1.718
  302   2HG1  VAL  41          2HG2      VAL  41  -1.786  -4.224  -1.680
  303   3HG1  VAL  41          3HG2      VAL  41  -2.483  -3.291  -2.988
  304   1HG2  VAL  41          1HG1      VAL  41  -1.775  -6.467  -4.659
  305   2HG2  VAL  41          2HG1      VAL  41  -0.708  -5.512  -3.644
  306   3HG2  VAL  41          3HG1      VAL  41  -1.692  -4.713  -4.902
  307    H    ASP  42           HN       ASP  42  -3.380  -6.435  -6.126
  308    HA   ASP  42           HA       ASP  42  -3.867  -4.061  -7.585
  309   1HB   ASP  42          2HB       ASP  42  -2.488  -5.991  -8.376
  310   2HB   ASP  42          1HB       ASP  42  -3.960  -6.877  -8.752
  311    H    GLU  43           HN       GLU  43  -5.903  -7.024  -7.611
  312    HA   GLU  43           HA       GLU  43  -7.923  -5.852  -9.207
  313   1HB   GLU  43          1HB       GLU  43  -9.147  -7.715  -8.894
  314   2HB   GLU  43          2HB       GLU  43  -7.550  -8.338  -8.505
  315   1HG   GLU  43          2HG       GLU  43  -8.209  -7.903  -6.019
  316   2HG   GLU  43          1HG       GLU  43  -9.850  -7.652  -6.625
  317    H    ILE  44           H        ILE  44  -7.603  -5.858  -5.608
  318    HA   ILE  44           HA       ILE  44 -10.018  -4.490  -5.056
  319    HB   ILE  44           HB       ILE  44  -7.307  -4.509  -3.666
  320   1HG1  ILE  44          2HG1      ILE  44 -10.019  -5.758  -3.000
  321   2HG1  ILE  44          1HG1      ILE  44  -8.688  -6.632  -3.725
  322   1HG2  ILE  44          1HG2      ILE  44  -8.454  -2.372  -3.127
  323   2HG2  ILE  44          2HG2      ILE  44  -8.416  -3.433  -1.736
  324   3HG2  ILE  44          3HG2      ILE  44  -9.917  -3.278  -2.679
  325   1HD1  ILE  44          1HD1      ILE  44  -7.268  -6.045  -1.712
  326   2HD1  ILE  44          2HD1      ILE  44  -8.629  -7.129  -1.381
  327   3HD1  ILE  44          3HD1      ILE  44  -8.754  -5.435  -0.933
  328    H    ALA  45           H        ALA  45  -6.772  -3.211  -6.046
  329    HA   ALA  45           HA       ALA  45  -7.544  -0.470  -5.985
  330   1HB   ALA  45          1HB       ALA  45  -5.749  -0.048  -7.464
  331   2HB   ALA  45          2HB       ALA  45  -5.790  -1.666  -8.158
  332   3HB   ALA  45          3HB       ALA  45  -5.241  -1.459  -6.501
  333    H    GLY  46           H        GLY  46  -7.742  -2.898  -8.658
  334   1HA   GLY  46          1HA       GLY  46  -8.999  -1.415 -10.630
  335   2HA   GLY  46          2HA       GLY  46  -9.311  -3.136 -10.333
  336    H    GLU  47           HN       GLU  47 -10.606  -3.038  -7.868
  337    HA   GLU  47           HA       GLU  47 -13.258  -2.385  -8.582
  338   1HB   GLU  47          2HB       GLU  47 -11.951  -2.890  -5.882
  339   2HB   GLU  47          1HB       GLU  47 -13.681  -2.704  -6.103
  340   1HG   GLU  47          1HG       GLU  47 -13.749  -4.622  -7.634
  341   2HG   GLU  47          2HG       GLU  47 -11.997  -4.778  -7.608
  342    H    TYR  48           H        TYR  48 -10.985  -0.420  -6.667
  343    HA   TYR  48           HA       TYR  48 -13.073   1.788  -6.619
  344   1HB   TYR  48          2HB       TYR  48 -10.878   1.316  -4.605
  345   2HB   TYR  48          1HB       TYR  48 -12.183   2.514  -4.543
  346    HD1  TYR  48           HD1      TYR  48 -11.410  -1.074  -4.265
  347    HD2  TYR  48           HD2      TYR  48 -14.143   2.107  -3.345
  348    HE1  TYR  48           HE1      TYR  48 -12.513  -2.531  -2.569
  349    HE2  TYR  48           HE2      TYR  48 -15.146   0.713  -1.553
  350    HH   TYR  48           HH       TYR  48 -15.033  -1.277  -0.391
  351    H    LYS  49           HN       LYS  49 -10.299   1.178  -8.215
  352    HA   LYS  49           HA       LYS  49  -8.363   2.930  -7.903
  353   1HB   LYS  49          1HB       LYS  49  -8.135   3.055 -10.397
  354   2HB   LYS  49          2HB       LYS  49  -8.309   1.424  -9.744
  355   1HG   LYS  49          2HG       LYS  49 -10.706   1.412 -10.426
  356   2HG   LYS  49          1HG       LYS  49 -10.519   3.037 -11.106
  357   1HD   LYS  49          2HD       LYS  49  -8.817   2.264 -12.668
  358   2HD   LYS  49          1HD       LYS  49  -8.912   0.619 -12.019
  359   1HE   LYS  49          1HE       LYS  49 -11.287   2.108 -13.240
  360   2HE   LYS  49          2HE       LYS  49 -10.231   1.022 -14.159
  361   1HZ   LYS  49          1HZ       LYS  49 -11.756   0.198 -11.784
  362   2HZ   LYS  49          2HZ       LYS  49 -10.855  -0.760 -12.759
  363   3HZ   LYS  49          3HZ       LYS  49 -12.222  -0.052 -13.347
  364    H    ASP  50           HN       ASP  50 -11.414   3.884  -9.363
  365    HA   ASP  50           HA       ASP  50 -11.080   6.403 -10.294
  366   1HB   ASP  50          1HB       ASP  50 -13.305   5.346  -8.485
  367   2HB   ASP  50          2HB       ASP  50 -13.415   6.801  -9.473
  368    H    LYS  51           HN       LYS  51 -11.320   5.522  -6.878
  369    HA   LYS  51           HA       LYS  51 -10.638   8.330  -6.049
  370   1HB   LYS  51          2HB       LYS  51 -12.779   6.373  -5.175
  371   2HB   LYS  51          1HB       LYS  51 -12.170   7.571  -4.048
  372   1HG   LYS  51          2HG       LYS  51 -12.777   9.381  -5.681
  373   2HG   LYS  51          1HG       LYS  51 -13.402   8.171  -6.798
  374   1HD   LYS  51          1HD       LYS  51 -14.447   8.791  -3.988
  375   2HD   LYS  51          2HD       LYS  51 -15.212   9.258  -5.508
  376   1HE   LYS  51          2HE       LYS  51 -14.892   6.414  -4.430
  377   2HE   LYS  51          1HE       LYS  51 -16.381   7.346  -4.571
  378   1HZ   LYS  51          1HZ       LYS  51 -16.098   7.342  -6.947
  379   2HZ   LYS  51          2HZ       LYS  51 -16.165   5.806  -6.353
  380   3HZ   LYS  51          3HZ       LYS  51 -14.720   6.447  -6.814
  381    H    LEU  52           H        LEU  52 -10.842   4.975  -4.935
  382    HA   LEU  52           HA       LEU  52  -9.519   5.788  -2.484
  383   1HB   LEU  52          1HB       LEU  52 -11.635   4.375  -2.727
  384   2HB   LEU  52          2HB       LEU  52 -10.546   3.051  -3.238
  385    HG   LEU  52           HG       LEU  52  -9.631   2.952  -1.072
  386   1HD1  LEU  52          1HD1      LEU  52 -10.497   4.436   0.798
  387   2HD1  LEU  52          2HD1      LEU  52  -9.526   5.316  -0.368
  388   3HD1  LEU  52          3HD1      LEU  52 -11.286   5.442  -0.444
  389   1HD2  LEU  52          1HD2      LEU  52 -12.647   3.172  -0.987
  390   2HD2  LEU  52          2HD2      LEU  52 -11.673   1.748  -1.406
  391   3HD2  LEU  52          3HD2      LEU  52 -11.648   2.380   0.246
  392    H    LYS  53           HN       LYS  53  -7.927   4.650  -1.471
  393    HA   LYS  53           HA       LYS  53  -5.667   4.656  -2.326
  394   1HB   LYS  53          1HB       LYS  53  -5.372   3.589   0.153
  395   2HB   LYS  53          2HB       LYS  53  -6.445   4.949  -0.029
  396   1HG   LYS  53          1HG       LYS  53  -7.098   3.383   1.561
  397   2HG   LYS  53          2HG       LYS  53  -8.332   3.583   0.393
  398   1HD   LYS  53          1HD       LYS  53  -6.436   1.202   0.633
  399   2HD   LYS  53          2HD       LYS  53  -8.015   1.296   1.340
  400   1HE   LYS  53          2HE       LYS  53  -9.133   0.808  -0.596
  401   2HE   LYS  53          1HE       LYS  53  -7.942   1.586  -1.639
  402   1HZ   LYS  53          1HZ       LYS  53  -6.462  -0.168  -1.259
  403   2HZ   LYS  53          2HZ       LYS  53  -7.520  -0.954  -0.263
  404   3HZ   LYS  53          3HZ       LYS  53  -7.883  -0.752  -1.862
  405    H    CYS  54           H        CYS  54  -4.738   3.167  -4.060
  406    HA   CYS  54           HA       CYS  54  -3.632   0.821  -2.603
  407   1HB   CYS  54          1HB       CYS  54  -5.857   0.118  -3.713
  408   2HB   CYS  54          2HB       CYS  54  -5.022   0.400  -5.269
  409    HG   CYS  54           HG       CYS  54  -5.039  -2.141  -4.537
  410    H    VAL  55           H        VAL  55  -1.582   0.609  -2.849
  411    HA   VAL  55           HA       VAL  55  -0.327   0.818  -5.441
  412    HB   VAL  55           HB       VAL  55   1.097   2.588  -3.536
  413   1HG1  VAL  55          1HG1      VAL  55  -0.197   4.556  -3.598
  414   2HG1  VAL  55          2HG1      VAL  55  -1.195   3.305  -2.842
  415   3HG1  VAL  55          3HG1      VAL  55  -1.497   3.810  -4.525
  416   1HG2  VAL  55          1HG2      VAL  55   1.095   4.116  -5.497
  417   2HG2  VAL  55          2HG2      VAL  55   1.665   2.485  -5.883
  418   3HG2  VAL  55          3HG2      VAL  55   0.009   2.991  -6.335
  419    H    LYS  56           HN       LYS  56   2.008   0.349  -5.284
  420    HA   LYS  56           HA       LYS  56   2.737  -1.314  -2.897
  421   1HB   LYS  56          1HB       LYS  56   2.894  -1.795  -5.877
  422   2HB   LYS  56          2HB       LYS  56   3.832  -2.737  -4.746
  423   1HG   LYS  56          2HG       LYS  56   1.979  -3.605  -3.599
  424   2HG   LYS  56          1HG       LYS  56   0.822  -2.567  -4.441
  425   1HD   LYS  56          2HD       LYS  56   2.625  -4.411  -6.048
  426   2HD   LYS  56          1HD       LYS  56   1.254  -5.084  -5.168
  427   1HE   LYS  56          2HE       LYS  56   0.494  -4.575  -7.422
  428   2HE   LYS  56          1HE       LYS  56  -0.290  -3.488  -6.270
  429   1HZ   LYS  56          1HZ       LYS  56   1.212  -1.770  -6.929
  430   2HZ   LYS  56          2HZ       LYS  56   2.024  -2.793  -7.934
  431   3HZ   LYS  56          3HZ       LYS  56   0.464  -2.371  -8.255
  432    H    LEU  57           H        LEU  57   4.653  -0.743  -1.990
  433    HA   LEU  57           HA       LEU  57   6.603   0.864  -3.634
  434   1HB   LEU  57          1HB       LEU  57   5.802   2.049  -1.622
  435   2HB   LEU  57          2HB       LEU  57   6.409   0.719  -0.622
  436    HG   LEU  57           HG       LEU  57   8.622   1.420  -2.249
  437   1HD1  LEU  57          1HD2      LEU  57   7.855   2.435   0.488
  438   2HD1  LEU  57          2HD2      LEU  57   8.712   0.906   0.134
  439   3HD1  LEU  57          3HD2      LEU  57   9.497   2.470  -0.171
  440   1HD2  LEU  57          1HD1      LEU  57   7.365   3.433  -3.040
  441   2HD2  LEU  57          2HD1      LEU  57   8.847   3.819  -2.147
  442   3HD2  LEU  57          3HD1      LEU  57   7.277   3.978  -1.353
  443    H    ASN  58           H        ASN  58   8.269  -0.303  -4.421
  444    HA   ASN  58           HA       ASN  58   8.947  -2.833  -3.560
  445   1HB   ASN  58          1HB       ASN  58   9.224  -1.720  -5.827
  446   2HB   ASN  58          2HB       ASN  58  10.543  -0.752  -5.148
  447   1HD2  ASN  58          1HD2      ASN  58   9.435  -3.902  -6.144
  448   2HD2  ASN  58          2HD2      ASN  58  10.889  -4.761  -5.728
  449    H    THR  59           H        THR  59   9.899  -3.353  -1.706
  450    HA   THR  59           HA       THR  59  11.540  -1.483  -0.176
  451    HB   THR  59           HB       THR  59  10.936  -4.392   0.464
  452    HG1  THR  59           HG1      THR  59   8.966  -3.549  -0.051
  453   1HG2  THR  59          1HG2      THR  59  11.133  -1.911   2.218
  454   2HG2  THR  59          2HG2      THR  59  10.879  -3.570   2.784
  455   3HG2  THR  59          3HG2      THR  59  12.423  -3.119   2.040
  456    H    ASP  60           HN       ASP  60  12.808  -1.974  -2.583
  457    HA   ASP  60           HA       ASP  60  15.311  -3.239  -1.685
  458   1HB   ASP  60          1HB       ASP  60  13.694  -4.964  -2.833
  459   2HB   ASP  60          2HB       ASP  60  14.133  -4.165  -4.337
  460    H    GLU  61           HN       GLU  61  13.464  -1.850  -4.362
  461    HA   GLU  61           HA       GLU  61  15.573  -0.105  -5.343
  462   1HB   GLU  61          2HB       GLU  61  13.638  -1.169  -6.684
  463   2HB   GLU  61          1HB       GLU  61  12.577   0.018  -5.878
  464   1HG   GLU  61          2HG       GLU  61  13.873   1.870  -6.841
  465   2HG   GLU  61          1HG       GLU  61  14.995   0.708  -7.555
  466    H    SER  62           H        SER  62  13.055  -0.023  -2.921
  467    HA   SER  62           HA       SER  62  13.518   2.814  -2.388
  468   1HB   SER  62          1HB       SER  62  10.914   1.483  -1.631
  469   2HB   SER  62          2HB       SER  62  11.226   3.162  -2.068
  470    HG   SER  62           HG       SER  62  11.047   0.818  -3.652
  471    HA   PRO  63           HA       PRO  63  14.504   0.070   1.316
  472   1HB   PRO  63          2HB       PRO  63  17.177   0.581   1.494
  473   2HB   PRO  63          1HB       PRO  63  16.479  -0.578   0.333
  474   1HG   PRO  63          2HG       PRO  63  17.362   2.212  -0.320
  475   2HG   PRO  63          1HG       PRO  63  17.728   0.690  -1.172
  476   1HD   PRO  63          2HD       PRO  63  15.615   2.259  -1.973
  477   2HD   PRO  63          1HD       PRO  63  15.541   0.519  -2.033
  478    H    ASN  64           H        ASN  64  15.653   3.092   0.213
  479    HA   ASN  64           HA       ASN  64  16.339   4.506   2.544
  480   1HB   ASN  64          1HB       ASN  64  14.926   5.772   0.171
  481   2HB   ASN  64          2HB       ASN  64  15.899   6.586   1.390
  482   1HD2  ASN  64          2HD2      ASN  64  15.990   4.966  -1.664
  483   2HD2  ASN  64          1HD2      ASN  64  17.744   4.851  -1.770
  484    H    VAL  65           H        VAL  65  13.094   4.943   1.013
  485    HA   VAL  65           HA       VAL  65  12.002   6.201   3.311
  486    HB   VAL  65           HB       VAL  65  10.820   4.752   0.909
  487   1HG1  VAL  65          1HG2      VAL  65   9.137   4.529   2.649
  488   2HG1  VAL  65          2HG2      VAL  65   9.329   6.245   3.085
  489   3HG1  VAL  65          3HG2      VAL  65   8.651   5.781   1.502
  490   1HG2  VAL  65          1HG1      VAL  65  11.010   7.678   1.792
  491   2HG2  VAL  65          2HG1      VAL  65  12.053   6.921   0.585
  492   3HG2  VAL  65          3HG1      VAL  65  10.318   7.104   0.262
  493    H    ALA  66           H        ALA  66  11.943   2.799   2.297
  494    HA   ALA  66           HA       ALA  66  10.363   1.780   4.405
  495   1HB   ALA  66          1HB       ALA  66  11.093   0.461   2.449
  496   2HB   ALA  66          2HB       ALA  66  12.756   0.439   3.074
  497   3HB   ALA  66          3HB       ALA  66  11.462  -0.359   3.985
  498    H    SER  67           H        SER  67  13.858   2.577   4.405
  499    HA   SER  67           HA       SER  67  14.345   1.535   7.057
  500   1HB   SER  67          1HB       SER  67  15.964   3.509   5.383
  501   2HB   SER  67          2HB       SER  67  16.509   2.670   6.846
  502    HG   SER  67           HG       SER  67  15.689   1.455   4.411
  503    H    GLU  68           HN       GLU  68  13.649   4.760   5.703
  504    HA   GLU  68           HA       GLU  68  13.974   6.260   8.103
  505   1HB   GLU  68          2HB       GLU  68  12.020   6.654   5.783
  506   2HB   GLU  68          1HB       GLU  68  12.251   7.813   7.088
  507   1HG   GLU  68          1HG       GLU  68  14.472   6.900   5.202
  508   2HG   GLU  68          2HG       GLU  68  13.552   8.398   5.051
  509    H    TYR  69           H        TYR  69  11.123   4.485   6.861
  510    HA   TYR  69           HA       TYR  69   9.589   5.020   9.308
  511   1HB   TYR  69          2HB       TYR  69   9.201   3.270   6.859
  512   2HB   TYR  69          1HB       TYR  69   8.133   3.168   8.248
  513    HD1  TYR  69           HD1      TYR  69   7.129   5.444   9.145
  514    HD2  TYR  69           HD2      TYR  69   8.631   4.852   5.149
  515    HE1  TYR  69           HE1      TYR  69   6.101   7.586   8.445
  516    HE2  TYR  69           HE2      TYR  69   7.590   7.007   4.455
  517    HH   TYR  69           HH       TYR  69   6.047   9.204   6.775
  518    H    GLY  70           H        GLY  70  11.625   2.386   8.123
  519   1HA   GLY  70          1HA       GLY  70  12.928   0.992   9.503
  520   2HA   GLY  70          2HA       GLY  70  11.871   1.311  10.884
  521    H    ILE  71           H        ILE  71  10.860   0.409   7.611
  522    HA   ILE  71           HA       ILE  71   9.203  -1.775   8.597
  523    HB   ILE  71           HB       ILE  71   9.689  -0.518   5.860
  524   1HG1  ILE  71          2HG1      ILE  71   7.382  -0.276   7.849
  525   2HG1  ILE  71          1HG1      ILE  71   8.685   0.892   7.766
  526   1HG2  ILE  71          1HG2      ILE  71   7.770  -2.680   6.777
  527   2HG2  ILE  71          2HG2      ILE  71   8.792  -2.674   5.329
  528   3HG2  ILE  71          3HG2      ILE  71   7.388  -1.637   5.389
  529   1HD1  ILE  71          1HD1      ILE  71   6.694   0.408   5.560
  530   2HD1  ILE  71          2HD1      ILE  71   6.933   1.849   6.552
  531   3HD1  ILE  71          3HD1      ILE  71   8.198   1.366   5.424
  532    H    ARG  72           HN       ARG  72  11.358  -2.685   9.434
  533    HA   ARG  72           HA       ARG  72  12.949  -4.170   7.467
  534   1HB   ARG  72          1HB       ARG  72  13.798  -3.093   9.607
  535   2HB   ARG  72          2HB       ARG  72  12.997  -4.394  10.499
  536   1HG   ARG  72          2HG       ARG  72  14.403  -6.056   9.193
  537   2HG   ARG  72          1HG       ARG  72  15.149  -4.698   8.337
  538   1HD   ARG  72          1HD       ARG  72  16.614  -5.443  10.113
  539   2HD   ARG  72          2HD       ARG  72  16.003  -3.819  10.503
  540    HE   ARG  72           HE       ARG  72  14.276  -5.768  11.654
  541   1HH1  ARG  72          2HH2      ARG  72  17.563  -4.544  12.031
  542   2HH1  ARG  72          1HH2      ARG  72  17.672  -4.924  13.728
  543   1HH2  ARG  72          2HH1      ARG  72  14.386  -6.262  13.876
  544   2HH2  ARG  72          1HH1      ARG  72  15.825  -5.922  14.798
  545    H    SER  73           H        SER  73  10.560  -4.976   6.872
  546    HA   SER  73           HA       SER  73  10.499  -7.673   6.718
  547   1HB   SER  73          2HB       SER  73   8.416  -8.086   8.356
  548   2HB   SER  73          1HB       SER  73  10.079  -8.379   8.845
  549    HG   SER  73           HG       SER  73  10.095  -6.468   9.938
  550    H    ILE  74           H        ILE  74   8.525  -8.418   5.635
  551    HA   ILE  74           HA       ILE  74   6.470  -6.495   5.079
  552    HB   ILE  74           HB       ILE  74   6.969  -6.709   2.541
  553   1HG1  ILE  74          1HG1      ILE  74   9.817  -7.217   3.393
  554   2HG1  ILE  74          2HG1      ILE  74   8.727  -8.475   2.786
  555   1HG2  ILE  74          1HG2      ILE  74   9.021  -5.041   4.030
  556   2HG2  ILE  74          2HG2      ILE  74   8.201  -4.681   2.514
  557   3HG2  ILE  74          3HG2      ILE  74   7.289  -4.629   4.014
  558   1HD1  ILE  74          1HD1      ILE  74   9.538  -5.935   1.309
  559   2HD1  ILE  74          2HD1      ILE  74   9.963  -7.585   0.891
  560   3HD1  ILE  74          3HD1      ILE  74   8.295  -7.067   0.743
  561    HA   PRO  75           HA       PRO  75   4.796  -6.752   2.990
  562   1HB   PRO  75          1HB       PRO  75   2.126  -7.304   3.365
  563   2HB   PRO  75          2HB       PRO  75   3.129  -7.842   2.006
  564   1HG   PRO  75          1HG       PRO  75   2.453  -9.321   4.576
  565   2HG   PRO  75          2HG       PRO  75   2.333  -9.966   2.911
  566   1HD   PRO  75          2HD       PRO  75   4.512 -10.559   4.442
  567   2HD   PRO  75          1HD       PRO  75   4.704 -10.096   2.747
  568    H    THR  76           H        THR  76   4.349  -4.967   3.824
  569    HA   THR  76           HA       THR  76   3.226  -4.601   6.542
  570    HB   THR  76           HB       THR  76   5.811  -3.372   5.527
  571    HG1  THR  76           HG1      THR  76   6.696  -4.737   6.892
  572   1HG2  THR  76          1HG2      THR  76   5.769  -2.200   7.788
  573   2HG2  THR  76          2HG2      THR  76   4.096  -2.737   7.977
  574   3HG2  THR  76          3HG2      THR  76   4.529  -1.626   6.660
  575    H    ILE  77           H        ILE  77   1.404  -3.651   5.996
  576    HA   ILE  77           HA       ILE  77   1.151  -1.995   3.541
  577    HB   ILE  77           HB       ILE  77  -0.695  -3.603   5.325
  578   1HG1  ILE  77          1HG1      ILE  77  -0.409  -3.518   2.298
  579   2HG1  ILE  77          2HG1      ILE  77   0.558  -4.577   3.332
  580   1HG2  ILE  77          1HG2      ILE  77  -1.909  -1.536   5.113
  581   2HG2  ILE  77          2HG2      ILE  77  -1.422  -1.378   3.415
  582   3HG2  ILE  77          3HG2      ILE  77  -2.590  -2.627   3.915
  583   1HD1  ILE  77          1HD1      ILE  77  -1.290  -5.842   2.470
  584   2HD1  ILE  77          2HD1      ILE  77  -1.508  -5.629   4.217
  585   3HD1  ILE  77          3HD1      ILE  77  -2.471  -4.670   3.068
  586    H    MET  78           H        MET  78   0.926   0.231   3.787
  587    HA   MET  78           HA       MET  78  -0.022   1.241   6.440
  588   1HB   MET  78          2HB       MET  78   2.106   2.588   4.807
  589   2HB   MET  78          1HB       MET  78   1.439   3.121   6.346
  590   1HG   MET  78          2HG       MET  78   2.323   1.011   7.394
  591   2HG   MET  78          1HG       MET  78   3.190   0.685   5.890
  592   1HE   MET  78          1HE       MET  78   5.100   0.432   7.898
  593   2HE   MET  78          2HE       MET  78   5.712   1.825   8.822
  594   3HE   MET  78          3HE       MET  78   4.082   1.187   9.143
  595    H    VAL  79           H        VAL  79  -1.165   3.187   6.236
  596    HA   VAL  79           HA       VAL  79  -2.025   3.873   3.449
  597    HB   VAL  79           HB       VAL  79  -3.777   3.784   5.911
  598   1HG1  VAL  79          1HG1      VAL  79  -4.248   2.512   3.193
  599   2HG1  VAL  79          2HG1      VAL  79  -5.134   2.215   4.695
  600   3HG1  VAL  79          3HG1      VAL  79  -3.466   1.634   4.513
  601   1HG2  VAL  79          1HG2      VAL  79  -5.545   4.716   4.337
  602   2HG2  VAL  79          2HG2      VAL  79  -4.262   5.879   4.650
  603   3HG2  VAL  79          3HG2      VAL  79  -4.271   4.982   3.131
  604    H    PHE  80           H        PHE  80  -2.040   5.990   2.977
  605    HA   PHE  80           HA       PHE  80  -1.361   7.934   5.115
  606   1HB   PHE  80          2HB       PHE  80  -0.171   7.720   2.325
  607   2HB   PHE  80          1HB       PHE  80   0.082   9.028   3.443
  608    HD1  PHE  80           HD1      PHE  80   0.754   5.382   2.934
  609    HD2  PHE  80           HD2      PHE  80   1.855   8.987   5.024
  610    HE1  PHE  80           HE1      PHE  80   2.881   4.329   3.651
  611    HE2  PHE  80           HE2      PHE  80   3.929   7.899   5.807
  612    HZ   PHE  80           HZ       PHE  80   4.404   5.529   5.217
  613    H    LYS  81           HN       LYS  81  -1.690  10.159   4.398
  614    HA   LYS  81           HA       LYS  81  -3.182  10.871   2.078
  615   1HB   LYS  81          2HB       LYS  81  -5.285  11.420   2.939
  616   2HB   LYS  81          1HB       LYS  81  -5.005   9.787   3.528
  617   1HG   LYS  81          2HG       LYS  81  -4.869  12.363   5.145
  618   2HG   LYS  81          1HG       LYS  81  -6.084  11.086   5.199
  619   1HD   LYS  81          1HD       LYS  81  -4.084   9.520   5.831
  620   2HD   LYS  81          2HD       LYS  81  -3.240  11.009   6.257
  621   1HE   LYS  81          1HE       LYS  81  -5.897  10.072   7.418
  622   2HE   LYS  81          2HE       LYS  81  -4.321  10.051   8.221
  623   1HZ   LYS  81          1HZ       LYS  81  -4.245  12.422   8.056
  624   2HZ   LYS  81          2HZ       LYS  81  -5.588  11.936   8.878
  625   3HZ   LYS  81          3HZ       LYS  81  -5.721  12.464   7.322
  626    H    GLY  82           H        GLY  82  -3.201  13.303   2.000
  627   1HA   GLY  82          2HA       GLY  82  -2.366  15.383   2.581
  628   2HA   GLY  82          1HA       GLY  82  -3.071  14.949   4.157
  629    H    GLY  83           H        GLY  83  -0.179  13.521   2.640
  630   1HA   GLY  83          2HA       GLY  83   2.020  13.512   3.212
  631   2HA   GLY  83          1HA       GLY  83   1.759  15.015   4.092
  632    H    LYS  84           HN       LYS  84  -0.241  12.407   5.281
  633    HA   LYS  84           HA       LYS  84   1.774  11.596   7.312
  634   1HB   LYS  84          2HB       LYS  84  -1.039  12.638   7.871
  635   2HB   LYS  84          1HB       LYS  84   0.051  11.963   9.086
  636   1HG   LYS  84          2HG       LYS  84   0.572  14.514   7.495
  637   2HG   LYS  84          1HG       LYS  84  -0.088  14.422   9.126
  638   1HD   LYS  84          2HD       LYS  84   1.979  13.394   9.983
  639   2HD   LYS  84          1HD       LYS  84   2.665  13.320   8.358
  640   1HE   LYS  84          2HE       LYS  84   3.594  15.218   9.563
  641   2HE   LYS  84          1HE       LYS  84   2.664  15.750   8.153
  642   1HZ   LYS  84          1HZ       LYS  84   0.856  16.279   9.612
  643   2HZ   LYS  84          2HZ       LYS  84   1.691  15.741  10.928
  644   3HZ   LYS  84          3HZ       LYS  84   2.218  17.064  10.100
  645    H    LYS  85           HN       LYS  85   0.857   9.816   8.690
  646    HA   LYS  85           HA       LYS  85  -0.195   7.720   6.930
  647   1HB   LYS  85          1HB       LYS  85   0.825   7.762   9.792
  648   2HB   LYS  85          2HB       LYS  85   0.036   6.358   9.052
  649   1HG   LYS  85          2HG       LYS  85   1.695   6.277   7.262
  650   2HG   LYS  85          1HG       LYS  85   2.501   7.716   7.914
  651   1HD   LYS  85          2HD       LYS  85   3.699   5.663   8.521
  652   2HD   LYS  85          1HD       LYS  85   3.101   6.498   9.963
  653   1HE   LYS  85          1HE       LYS  85   1.234   4.881  10.155
  654   2HE   LYS  85          2HE       LYS  85   1.715   4.122   8.622
  655   1HZ   LYS  85          1HZ       LYS  85   3.297   4.214  11.093
  656   2HZ   LYS  85          2HZ       LYS  85   3.771   3.513   9.679
  657   3HZ   LYS  85          3HZ       LYS  85   2.481   2.908  10.507
  658    H    CYS  86           H        CYS  86  -1.981   6.422   7.571
  659    HA   CYS  86           HA       CYS  86  -4.141   7.787   9.155
  660   1HB   CYS  86          2HB       CYS  86  -4.562   7.443   6.667
  661   2HB   CYS  86          1HB       CYS  86  -4.475   5.708   6.952
  662    HG   CYS  86           HG       CYS  86  -6.221   5.848   9.052
  663    H    GLU  87           HN       GLU  87  -2.882   4.607   8.092
  664    HA   GLU  87           HA       GLU  87  -2.982   3.463  10.744
  665   1HB   GLU  87          2HB       GLU  87  -4.665   1.779  10.369
  666   2HB   GLU  87          1HB       GLU  87  -5.353   3.382  10.206
  667   1HG   GLU  87          2HG       GLU  87  -6.306   2.218   8.474
  668   2HG   GLU  87          1HG       GLU  87  -5.067   3.114   7.643
  669    H    THR  88           H        THR  88  -2.662   0.817  10.262
  670    HA   THR  88           HA       THR  88  -1.184   0.241   7.894
  671    HB   THR  88           HB       THR  88   0.608   1.441   9.018
  672    HG1  THR  88           HG1      THR  88   1.116  -0.729   8.207
  673   1HG2  THR  88          1HG2      THR  88  -0.253   1.519  11.326
  674   2HG2  THR  88          2HG2      THR  88  -0.010  -0.234  11.495
  675   3HG2  THR  88          3HG2      THR  88   1.382   0.845  11.306
  676    H    ILE  89           H        ILE  89  -0.609  -2.005   7.768
  677    HA   ILE  89           HA       ILE  89  -1.785  -3.869   9.715
  678    HB   ILE  89           HB       ILE  89  -2.420  -3.811   6.718
  679   1HG1  ILE  89          1HG1      ILE  89  -3.802  -2.224   7.963
  680   2HG1  ILE  89          2HG1      ILE  89  -4.697  -3.568   7.280
  681   1HG2  ILE  89          1HG2      ILE  89  -2.193  -6.131   7.319
  682   2HG2  ILE  89          2HG2      ILE  89  -3.125  -5.904   8.817
  683   3HG2  ILE  89          3HG2      ILE  89  -3.913  -5.772   7.233
  684   1HD1  ILE  89          1HD1      ILE  89  -3.923  -3.389  10.229
  685   2HD1  ILE  89          2HD1      ILE  89  -4.945  -4.628   9.470
  686   3HD1  ILE  89          3HD1      ILE  89  -5.490  -2.949   9.548
  687    H    ILE  90           H        ILE  90  -0.776  -6.057   9.313
  688    HA   ILE  90           HA       ILE  90   1.708  -5.982   7.700
  689    HB   ILE  90           HB       ILE  90   1.692  -6.687  10.673
  690   1HG1  ILE  90          2HG1      ILE  90   2.765  -4.220   9.232
  691   2HG1  ILE  90          1HG1      ILE  90   1.482  -4.267  10.453
  692   1HG2  ILE  90          1HG2      ILE  90   3.996  -6.446   8.676
  693   2HG2  ILE  90          2HG2      ILE  90   4.136  -6.892  10.389
  694   3HG2  ILE  90          3HG2      ILE  90   3.332  -7.978   9.282
  695   1HD1  ILE  90          1HD1      ILE  90   3.408  -3.450  11.535
  696   2HD1  ILE  90          2HD1      ILE  90   4.435  -4.748  10.919
  697   3HD1  ILE  90          3HD1      ILE  90   3.165  -5.108  12.120
  698    H    GLY  91           H        GLY  91   2.315  -8.014   6.990
  699   1HA   GLY  91          1HA       GLY  91   2.250 -10.319   6.778
  700   2HA   GLY  91          2HA       GLY  91   0.999 -10.438   8.020
  701    H    ALA  92           H        ALA  92   0.998 -11.846   5.518
  702    HA   ALA  92           HA       ALA  92  -0.820 -10.569   3.648
  703   1HB   ALA  92          1HB       ALA  92   0.013 -13.481   4.039
  704   2HB   ALA  92          2HB       ALA  92   0.756 -12.309   2.928
  705   3HB   ALA  92          3HB       ALA  92  -0.910 -12.854   2.661
  706    H    VAL  93           H        VAL  93  -3.074 -10.698   3.605
  707    HA   VAL  93           HA       VAL  93  -4.486 -12.548   5.393
  708    HB   VAL  93           HB       VAL  93  -5.947 -10.823   6.251
  709   1HG1  VAL  93          1HG2      VAL  93  -5.470  -8.395   5.936
  710   2HG1  VAL  93          2HG2      VAL  93  -5.977  -9.211   4.460
  711   3HG1  VAL  93          3HG2      VAL  93  -4.263  -8.812   4.701
  712   1HG2  VAL  93          1HG1      VAL  93  -3.090  -9.924   6.767
  713   2HG2  VAL  93          2HG1      VAL  93  -3.877 -11.322   7.535
  714   3HG2  VAL  93          3HG1      VAL  93  -4.503  -9.687   7.806
  715    HA   PRO  94           HA       PRO  94  -6.642 -12.887   1.603
  716   1HB   PRO  94          1HB       PRO  94  -9.147 -13.796   2.264
  717   2HB   PRO  94          2HB       PRO  94  -7.658 -14.757   2.467
  718   1HG   PRO  94          2HG       PRO  94  -9.101 -13.102   4.549
  719   2HG   PRO  94          1HG       PRO  94  -8.525 -14.785   4.711
  720   1HD   PRO  94          2HD       PRO  94  -7.097 -12.662   5.654
  721   2HD   PRO  94          1HD       PRO  94  -6.271 -14.074   4.943
  722    H    LYS  95           HN       LYS  95  -8.254 -12.097   0.230
  723    HA   LYS  95           HA       LYS  95  -8.626  -9.436   0.070
  724   1HB   LYS  95          2HB       LYS  95  -9.102 -11.251  -1.663
  725   2HB   LYS  95          1HB       LYS  95 -10.671 -11.510  -0.897
  726   1HG   LYS  95          1HG       LYS  95 -11.278  -9.131  -1.385
  727   2HG   LYS  95          2HG       LYS  95  -9.690  -8.911  -2.147
  728   1HD   LYS  95          1HD       LYS  95 -10.241 -10.761  -3.752
  729   2HD   LYS  95          2HD       LYS  95 -11.879 -10.816  -3.081
  730   1HE   LYS  95          2HE       LYS  95 -10.554  -8.390  -4.400
  731   2HE   LYS  95          1HE       LYS  95 -11.735  -9.464  -5.168
  732   1HZ   LYS  95          1HZ       LYS  95 -13.311  -8.800  -3.479
  733   2HZ   LYS  95          2HZ       LYS  95 -12.782  -7.525  -4.378
  734   3HZ   LYS  95          3HZ       LYS  95 -12.216  -7.741  -2.844
  735    H    ALA  96           H        ALA  96 -11.067 -11.690   1.446
  736    HA   ALA  96           HA       ALA  96 -13.082  -9.853   2.069
  737   1HB   ALA  96          1HB       ALA  96 -13.751 -11.475   3.815
  738   2HB   ALA  96          2HB       ALA  96 -12.180 -12.292   3.673
  739   3HB   ALA  96          3HB       ALA  96 -13.315 -12.298   2.305
  740    H    THR  97           H        THR  97 -10.124 -10.660   3.982
  741    HA   THR  97           HA       THR  97 -10.877  -9.018   6.235
  742    HB   THR  97           HB       THR  97  -8.109  -9.977   5.391
  743    HG1  THR  97           HG1      THR  97 -10.138 -11.263   6.905
  744   1HG2  THR  97          1HG2      THR  97  -7.699  -9.956   7.842
  745   2HG2  THR  97          2HG2      THR  97  -8.092  -8.336   7.241
  746   3HG2  THR  97          3HG2      THR  97  -9.318  -9.281   8.112
  747    H    ILE  98           H        ILE  98  -8.740  -8.611   3.350
  748    HA   ILE  98           HA       ILE  98  -7.780  -6.023   4.030
  749    HB   ILE  98           HB       ILE  98  -8.292  -7.154   1.232
  750   1HG1  ILE  98          1HG1      ILE  98  -5.827  -7.228   3.028
  751   2HG1  ILE  98          2HG1      ILE  98  -6.823  -8.601   2.510
  752   1HG2  ILE  98          1HG2      ILE  98  -7.981  -4.652   1.282
  753   2HG2  ILE  98          2HG2      ILE  98  -6.488  -4.876   2.210
  754   3HG2  ILE  98          3HG2      ILE  98  -6.608  -5.445   0.536
  755   1HD1  ILE  98          1HD1      ILE  98  -4.879  -8.658   1.184
  756   2HD1  ILE  98          2HD1      ILE  98  -6.200  -8.112   0.134
  757   3HD1  ILE  98          3HD1      ILE  98  -4.997  -6.951   0.751
  758    H    VAL  99           H        VAL  99 -10.594  -6.896   1.943
  759    HA   VAL  99           HA       VAL  99 -11.471  -4.260   1.441
  760    HB   VAL  99           HB       VAL  99 -13.003  -6.882   1.570
  761   1HG1  VAL  99          1HG1      VAL  99 -14.641  -5.070   1.784
  762   2HG1  VAL  99          2HG1      VAL  99 -13.872  -4.181   0.451
  763   3HG1  VAL  99          3HG1      VAL  99 -14.703  -5.718   0.144
  764   1HG2  VAL  99          1HG2      VAL  99 -11.945  -5.261  -0.799
  765   2HG2  VAL  99          2HG2      VAL  99 -12.802  -6.812  -0.886
  766   3HG2  VAL  99          3HG2      VAL  99 -11.184  -6.734  -0.177
  767    H    GLN 100           H        GLN 100 -12.585  -6.544   4.070
  768    HA   GLN 100           HA       GLN 100 -14.396  -4.687   5.242
  769   1HB   GLN 100          1HB       GLN 100 -12.753  -6.971   6.390
  770   2HB   GLN 100          2HB       GLN 100 -13.888  -6.033   7.374
  771   1HG   GLN 100          2HG       GLN 100 -15.760  -6.604   5.994
  772   2HG   GLN 100          1HG       GLN 100 -14.740  -7.390   4.783
  773   1HE2  GLN 100          1HE2      GLN 100 -13.334  -9.191   5.639
  774   2HE2  GLN 100          2HE2      GLN 100 -14.079 -10.309   6.798
  775    H    THR 101           H        THR 101 -10.928  -5.231   5.846
  776    HA   THR 101           HA       THR 101 -10.605  -3.337   7.950
  777    HB   THR 101           HB       THR 101  -8.583  -4.343   5.872
  778    HG1  THR 101           HG1      THR 101  -9.445  -5.970   7.116
  779   1HG2  THR 101          1HG2      THR 101  -7.659  -2.366   6.865
  780   2HG2  THR 101          2HG2      THR 101  -6.930  -3.771   7.647
  781   3HG2  THR 101          3HG2      THR 101  -8.194  -2.857   8.494
  782    H    VAL 102           H        VAL 102 -10.377  -2.915   4.356
  783    HA   VAL 102           HA       VAL 102  -9.724  -0.109   4.529
  784    HB   VAL 102           HB       VAL 102 -11.018  -1.851   2.395
  785   1HG1  VAL 102          1HG1      VAL 102  -8.305  -0.487   2.624
  786   2HG1  VAL 102          2HG1      VAL 102  -8.872  -1.442   1.233
  787   3HG1  VAL 102          3HG1      VAL 102  -8.612  -2.218   2.803
  788   1HG2  VAL 102          1HG2      VAL 102 -11.940   0.381   2.015
  789   2HG2  VAL 102          2HG2      VAL 102 -10.320   1.101   2.166
  790   3HG2  VAL 102          3HG2      VAL 102 -10.717   0.014   0.813
  791    H    GLU 103           HN       GLU 103 -12.836  -1.748   3.941
  792    HA   GLU 103           HA       GLU 103 -14.497   0.426   3.779
  793   1HB   GLU 103          1HB       GLU 103 -14.924  -2.360   4.910
  794   2HB   GLU 103          2HB       GLU 103 -16.237  -1.195   4.826
  795   1HG   GLU 103          2HG       GLU 103 -14.572  -2.047   2.412
  796   2HG   GLU 103          1HG       GLU 103 -16.146  -2.731   2.843
  797    H    LYS 104           HN       LYS 104 -13.683  -1.205   6.864
  798    HA   LYS 104           HA       LYS 104 -15.274   0.439   8.503
  799   1HB   LYS 104          1HB       LYS 104 -13.753  -0.130  10.340
  800   2HB   LYS 104          2HB       LYS 104 -14.223  -1.539   9.377
  801   1HG   LYS 104          2HG       LYS 104 -12.098  -1.838   8.565
  802   2HG   LYS 104          1HG       LYS 104 -11.674  -0.129   8.657
  803   1HD   LYS 104          1HD       LYS 104 -10.329  -1.265  10.189
  804   2HD   LYS 104          2HD       LYS 104 -11.444  -0.236  11.084
  805   1HE   LYS 104          2HE       LYS 104 -11.815  -3.256  10.633
  806   2HE   LYS 104          1HE       LYS 104 -11.039  -2.554  12.060
  807   1HZ   LYS 104          1HZ       LYS 104 -13.080  -1.398  12.534
  808   2HZ   LYS 104          2HZ       LYS 104 -13.822  -2.122  11.254
  809   3HZ   LYS 104          3HZ       LYS 104 -13.289  -3.032  12.515
  810    H    TYR 105           H        TYR 105 -12.267   1.404   6.898
  811    HA   TYR 105           HA       TYR 105 -11.849   3.700   8.699
  812   1HB   TYR 105          1HB       TYR 105 -10.539   2.965   6.056
  813   2HB   TYR 105          2HB       TYR 105  -9.971   4.170   7.191
  814    HD1  TYR 105           HD1      TYR 105  -8.579   1.581   6.001
  815    HD2  TYR 105           HD2      TYR 105 -10.169   2.762   9.831
  816    HE1  TYR 105           HE1      TYR 105  -7.258  -0.173   7.099
  817    HE2  TYR 105           HE2      TYR 105  -8.872   0.974  10.920
  818    HH   TYR 105           HH       TYR 105  -6.416  -0.804   9.241
  819    H    LEU 106           H        LEU 106 -13.862   2.999   6.024
  820    HA   LEU 106           HA       LEU 106 -14.157   5.866   5.270
  821   1HB   LEU 106          2HB       LEU 106 -14.987   3.295   3.851
  822   2HB   LEU 106          1HB       LEU 106 -15.455   4.928   3.373
  823    HG   LEU 106           HG       LEU 106 -12.895   5.434   3.273
  824   1HD1  LEU 106          1HD1      LEU 106 -12.834   4.669   0.929
  825   2HD1  LEU 106          2HD1      LEU 106 -14.188   3.574   1.203
  826   3HD1  LEU 106          3HD1      LEU 106 -14.419   5.336   1.279
  827   1HD2  LEU 106          1HD2      LEU 106 -12.897   2.395   3.098
  828   2HD2  LEU 106          2HD2      LEU 106 -12.006   3.403   4.262
  829   3HD2  LEU 106          3HD2      LEU 106 -11.560   3.430   2.565
  830    H    ASN 107           H        ASN 107 -15.927   2.931   6.305
  831    HA   ASN 107           HA       ASN 107 -17.975   4.494   7.641
  832   1HB   ASN 107          2HB       ASN 107 -19.808   3.298   6.315
  833   2HB   ASN 107          1HB       ASN 107 -19.011   4.666   5.540
  834   1HD2  ASN 107          1HD2      ASN 107 -17.687   1.308   5.720
  835   2HD2  ASN 107          2HD2      ASN 107 -17.768   1.036   3.967
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1  -8.144  -1.367 -13.307
    2   2H    MET   1          2H        MET   1  -8.106  -1.061 -14.941
    3   3H    MET   1          3H        MET   1  -7.414  -2.445 -14.306
    4    HA   MET   1           HA       MET   1  -5.812  -0.774 -14.960
    5   1HB   MET   1          2HB       MET   1  -7.276   1.065 -13.862
    6   2HB   MET   1          1HB       MET   1  -6.617   0.525 -12.317
    7   1HG   MET   1          2HG       MET   1  -4.278   0.965 -13.330
    8   2HG   MET   1          1HG       MET   1  -5.089   1.613 -14.738
    9   1HE   MET   1          1HE       MET   1  -6.398   3.820 -14.802
   10   2HE   MET   1          2HE       MET   1  -7.509   3.391 -13.473
   11   3HE   MET   1          3HE       MET   1  -6.611   4.921 -13.423
   12    H    GLU   2           HN       GLU   2  -4.666  -0.342 -11.946
   13    HA   GLU   2           HA       GLU   2  -4.366  -2.966 -10.920
   14   1HB   GLU   2          1HB       GLU   2  -1.900  -3.100 -11.455
   15   2HB   GLU   2          2HB       GLU   2  -2.960  -3.381 -12.838
   16   1HG   GLU   2          2HG       GLU   2  -2.553  -1.069 -13.649
   17   2HG   GLU   2          1HG       GLU   2  -1.567  -0.725 -12.219
   18    H    ALA   3           H        ALA   3  -2.448  -2.725  -9.188
   19    HA   ALA   3           HA       ALA   3  -3.120  -0.273  -7.721
   20   1HB   ALA   3          1HB       ALA   3  -1.396  -2.697  -7.079
   21   2HB   ALA   3          2HB       ALA   3  -3.051  -2.369  -6.551
   22   3HB   ALA   3          3HB       ALA   3  -1.717  -1.358  -5.955
   23    H    GLY   4           H        GLY   4  -1.606   1.275  -7.043
   24   1HA   GLY   4          1HA       GLY   4   0.245   2.048  -9.106
   25   2HA   GLY   4          2HA       GLY   4   0.041   2.813  -7.528
   26    H    ALA   5           H        ALA   5   2.205   0.956  -9.443
   27    HA   ALA   5           HA       ALA   5   3.723  -0.124  -7.151
   28   1HB   ALA   5          1HB       ALA   5   5.421  -0.653  -8.816
   29   2HB   ALA   5          2HB       ALA   5   4.480   0.181 -10.076
   30   3HB   ALA   5          3HB       ALA   5   3.829  -1.286  -9.295
   31    H    VAL   6           H        VAL   6   4.845   1.280  -5.891
   32    HA   VAL   6           HA       VAL   6   5.777   3.876  -7.098
   33    HB   VAL   6           HB       VAL   6   5.488   4.922  -4.894
   34   1HG1  VAL   6          1HG1      VAL   6   5.537   3.081  -3.377
   35   2HG1  VAL   6          2HG1      VAL   6   4.114   2.327  -4.118
   36   3HG1  VAL   6          3HG1      VAL   6   3.964   3.853  -3.239
   37   1HG2  VAL   6          1HG2      VAL   6   3.075   5.160  -4.965
   38   2HG2  VAL   6          2HG2      VAL   6   3.779   5.231  -6.589
   39   3HG2  VAL   6          3HG2      VAL   6   2.942   3.758  -6.048
   40    H    ASN   7           H        ASN   7   7.470   4.915  -5.895
   41    HA   ASN   7           HA       ASN   7   9.509   3.190  -4.667
   42   1HB   ASN   7          1HB       ASN   7  10.160   3.207  -7.028
   43   2HB   ASN   7          2HB       ASN   7   9.849   4.949  -7.159
   44   1HD2  ASN   7          2HD2      ASN   7  11.922   2.530  -5.542
   45   2HD2  ASN   7          1HD2      ASN   7  13.315   3.560  -5.338
   46    H    ASP   8           HN       ASP   8  11.243   4.764  -3.905
   47    HA   ASP   8           HA       ASP   8  10.446   6.452  -1.949
   48   1HB   ASP   8          1HB       ASP   8  12.794   5.710  -2.501
   49   2HB   ASP   8          2HB       ASP   8  12.873   6.930  -3.758
   50    H    ASP   9           HN       ASP   9  11.303   7.519  -5.201
   51    HA   ASP   9           HA       ASP   9  10.681  10.282  -4.951
   52   1HB   ASP   9          1HB       ASP   9  11.923   9.426  -6.845
   53   2HB   ASP   9          2HB       ASP   9  10.581   8.422  -7.375
   54    H    THR  10           H        THR  10   8.661   7.987  -6.785
   55    HA   THR  10           HA       THR  10   6.412   9.630  -7.028
   56    HB   THR  10           HB       THR  10   5.235   7.429  -7.519
   57    HG1  THR  10           HG1      THR  10   6.769   5.662  -7.715
   58   1HG2  THR  10          1HG2      THR  10   6.557   6.979  -9.546
   59   2HG2  THR  10          2HG2      THR  10   6.470   8.726  -9.260
   60   3HG2  THR  10          3HG2      THR  10   7.953   7.836  -8.867
   61    H    PHE  11           H        PHE  11   7.204   7.365  -4.451
   62    HA   PHE  11           HA       PHE  11   4.945   7.065  -2.973
   63   1HB   PHE  11          2HB       PHE  11   7.348   6.338  -2.478
   64   2HB   PHE  11          1HB       PHE  11   7.601   7.893  -1.738
   65    HD1  PHE  11           HD1      PHE  11   5.953   4.612  -1.489
   66    HD2  PHE  11           HD2      PHE  11   6.563   8.418   0.412
   67    HE1  PHE  11           HE1      PHE  11   5.536   3.574   0.727
   68    HE2  PHE  11           HE2      PHE  11   5.903   7.434   2.601
   69    HZ   PHE  11           HZ       PHE  11   5.399   4.999   2.759
   70    H    LYS  12           HN       LYS  12   7.050   9.885  -3.021
   71    HA   LYS  12           HA       LYS  12   5.858  11.362  -0.896
   72   1HB   LYS  12          2HB       LYS  12   7.234  12.369  -3.420
   73   2HB   LYS  12          1HB       LYS  12   6.868  13.351  -1.995
   74   1HG   LYS  12          2HG       LYS  12   8.287  11.929  -0.582
   75   2HG   LYS  12          1HG       LYS  12   8.595  10.829  -1.930
   76   1HD   LYS  12          1HD       LYS  12   9.648  12.747  -3.197
   77   2HD   LYS  12          2HD       LYS  12   9.408  13.766  -1.765
   78   1HE   LYS  12          2HE       LYS  12  11.682  12.968  -1.690
   79   2HE   LYS  12          1HE       LYS  12  10.789  12.087  -0.438
   80   1HZ   LYS  12          1HZ       LYS  12  10.584  10.263  -2.048
   81   2HZ   LYS  12          2HZ       LYS  12  11.510  11.106  -3.113
   82   3HZ   LYS  12          3HZ       LYS  12  12.144  10.605  -1.677
   83    H    ASN  13           H        ASN  13   5.144  11.456  -4.410
   84    HA   ASN  13           HA       ASN  13   2.991  13.406  -4.090
   85   1HB   ASN  13          1HB       ASN  13   3.815  11.625  -6.418
   86   2HB   ASN  13          2HB       ASN  13   2.681  12.964  -6.493
   87   1HD2  ASN  13          2HD2      ASN  13   4.479  14.680  -4.560
   88   2HD2  ASN  13          1HD2      ASN  13   5.734  15.190  -5.670
   89    H    VAL  14           H        VAL  14   3.202   9.958  -4.868
   90    HA   VAL  14           HA       VAL  14   0.354   9.628  -5.180
   91    HB   VAL  14           HB       VAL  14   2.721   7.703  -4.999
   92   1HG1  VAL  14          1HG1      VAL  14   1.197   8.817  -7.398
   93   2HG1  VAL  14          2HG1      VAL  14   2.501   7.616  -7.468
   94   3HG1  VAL  14          3HG1      VAL  14   2.851   9.261  -6.936
   95   1HG2  VAL  14          1HG2      VAL  14   1.245   6.092  -6.194
   96   2HG2  VAL  14          2HG2      VAL  14  -0.130   7.174  -5.897
   97   3HG2  VAL  14          3HG2      VAL  14   0.731   6.412  -4.531
   98    H    VAL  15           H        VAL  15   2.625   8.929  -2.499
   99    HA   VAL  15           HA       VAL  15   0.404   7.612  -1.014
  100    HB   VAL  15           HB       VAL  15   3.390   7.432  -0.467
  101   1HG1  VAL  15          1HG1      VAL  15   2.679   5.392   0.713
  102   2HG1  VAL  15          2HG1      VAL  15   0.978   5.794   0.382
  103   3HG1  VAL  15          3HG1      VAL  15   1.982   6.875   1.383
  104   1HG2  VAL  15          1HG2      VAL  15   3.375   5.328  -1.623
  105   2HG2  VAL  15          2HG2      VAL  15   1.648   5.500  -2.031
  106   3HG2  VAL  15          3HG2      VAL  15   2.860   6.550  -2.783
  107    H    LEU  16           H        LEU  16   3.170   9.927  -0.381
  108    HA   LEU  16           HA       LEU  16   2.198  10.445   2.302
  109   1HB   LEU  16          2HB       LEU  16   4.076  12.057   0.518
  110   2HB   LEU  16          1HB       LEU  16   3.665  12.462   2.155
  111    HG   LEU  16           HG       LEU  16   5.095   9.960   1.155
  112   1HD1  LEU  16          1HD1      LEU  16   7.046  10.879   2.286
  113   2HD1  LEU  16          2HD1      LEU  16   6.404  12.103   1.174
  114   3HD1  LEU  16          3HD1      LEU  16   6.083  12.240   2.912
  115   1HD2  LEU  16          1HD2      LEU  16   3.898   9.215   3.073
  116   2HD2  LEU  16          2HD2      LEU  16   4.237  10.714   3.978
  117   3HD2  LEU  16          3HD2      LEU  16   5.536   9.552   3.643
  118    H    GLU  17           HN       GLU  17   2.333  12.567  -0.553
  119    HA   GLU  17           HA       GLU  17   0.312  14.379   0.407
  120   1HB   GLU  17          2HB       GLU  17   1.560  14.010  -2.333
  121   2HB   GLU  17          1HB       GLU  17   0.648  15.419  -1.802
  122   1HG   GLU  17          1HG       GLU  17   2.338  15.981  -0.139
  123   2HG   GLU  17          2HG       GLU  17   3.270  14.527  -0.505
  124    H    SER  18           H        SER  18  -0.963  11.961   0.534
  125    HA   SER  18           HA       SER  18  -2.448  11.311  -1.886
  126   1HB   SER  18          1HB       SER  18  -3.473   9.684  -0.145
  127   2HB   SER  18          2HB       SER  18  -1.780   9.477  -0.630
  128    HG   SER  18           HG       SER  18  -1.123  10.123   1.302
  129    H    SER  19           H        SER  19  -4.312  12.297  -2.456
  130    HA   SER  19           HA       SER  19  -5.860  13.978  -0.637
  131   1HB   SER  19          2HB       SER  19  -7.280  14.042  -2.804
  132   2HB   SER  19          1HB       SER  19  -5.633  14.704  -2.903
  133    HG   SER  19           HG       SER  19  -6.002  13.262  -4.634
  134    H    VAL  20           H        VAL  20  -6.488  11.228  -2.750
  135    HA   VAL  20           HA       VAL  20  -8.744  10.162  -1.175
  136    HB   VAL  20           HB       VAL  20  -8.723   8.338  -2.810
  137   1HG1  VAL  20          1HG2      VAL  20  -6.282   9.663  -4.071
  138   2HG1  VAL  20          2HG2      VAL  20  -6.310   8.093  -3.236
  139   3HG1  VAL  20          3HG2      VAL  20  -7.224   8.316  -4.729
  140   1HG2  VAL  20          1HG1      VAL  20  -8.439  11.116  -4.075
  141   2HG2  VAL  20          2HG1      VAL  20  -9.905  10.454  -3.315
  142   3HG2  VAL  20          3HG1      VAL  20  -9.247   9.718  -4.784
  143    HA   PRO  21           HA       PRO  21  -6.210   7.825   1.455
  144   1HB   PRO  21          1HB       PRO  21  -7.956   5.461   1.564
  145   2HB   PRO  21          2HB       PRO  21  -7.723   6.687   2.829
  146   1HG   PRO  21          2HG       PRO  21 -10.000   6.360   1.345
  147   2HG   PRO  21          1HG       PRO  21  -9.516   7.909   2.113
  148   1HD   PRO  21          2HD       PRO  21  -9.215   7.131  -0.817
  149   2HD   PRO  21          1HD       PRO  21  -9.748   8.640  -0.160
  150    H    VAL  22           H        VAL  22  -4.821   6.086   1.496
  151    HA   VAL  22           HA       VAL  22  -4.888   4.167  -0.610
  152    HB   VAL  22           HB       VAL  22  -2.280   5.010  -1.105
  153   1HG1  VAL  22          1HG2      VAL  22  -4.051   4.205  -2.749
  154   2HG1  VAL  22          2HG2      VAL  22  -4.871   5.760  -2.603
  155   3HG1  VAL  22          3HG2      VAL  22  -3.259   5.685  -3.316
  156   1HG2  VAL  22          1HG1      VAL  22  -3.930   7.511  -1.090
  157   2HG2  VAL  22          2HG1      VAL  22  -2.683   7.093   0.114
  158   3HG2  VAL  22          3HG1      VAL  22  -2.255   7.288  -1.597
  159    H    LEU  23           H        LEU  23  -4.069   2.206  -0.208
  160    HA   LEU  23           HA       LEU  23  -2.603   1.779   2.307
  161   1HB   LEU  23          2HB       LEU  23  -4.635   0.425   1.495
  162   2HB   LEU  23          1HB       LEU  23  -3.590  -0.191   0.216
  163    HG   LEU  23           HG       LEU  23  -3.417  -0.757   3.166
  164   1HD1  LEU  23          1HD1      LEU  23  -1.359  -1.451   1.040
  165   2HD1  LEU  23          2HD1      LEU  23  -1.107  -0.562   2.575
  166   3HD1  LEU  23          3HD1      LEU  23  -1.505  -2.274   2.604
  167   1HD2  LEU  23          1HD2      LEU  23  -3.736  -3.065   2.344
  168   2HD2  LEU  23          2HD2      LEU  23  -3.753  -2.481   0.674
  169   3HD2  LEU  23          3HD2      LEU  23  -5.050  -2.009   1.793
  170    H    VAL  24           H        VAL  24  -0.324   1.714   2.144
  171    HA   VAL  24           HA       VAL  24   0.730   0.805  -0.476
  172    HB   VAL  24           HB       VAL  24   1.279   3.277   0.496
  173   1HG1  VAL  24          1HG1      VAL  24   3.442   3.338   1.572
  174   2HG1  VAL  24          2HG1      VAL  24   3.588   1.574   1.527
  175   3HG1  VAL  24          3HG1      VAL  24   2.397   2.360   2.586
  176   1HG2  VAL  24          1HG2      VAL  24   3.391   3.126  -0.839
  177   2HG2  VAL  24          2HG2      VAL  24   3.179   1.363  -0.917
  178   3HG2  VAL  24          3HG2      VAL  24   1.995   2.444  -1.665
  179    H    ASP  25           HN       ASP  25   1.375  -1.191  -0.258
  180    HA   ASP  25           HA       ASP  25   2.204  -2.189   2.442
  181   1HB   ASP  25          2HB       ASP  25   0.671  -3.721   1.847
  182   2HB   ASP  25          1HB       ASP  25   1.013  -3.611   0.135
  183    H    PHE  26           H        PHE  26   4.467  -2.755   2.417
  184    HA   PHE  26           HA       PHE  26   6.151  -1.702   0.230
  185   1HB   PHE  26          1HB       PHE  26   6.692  -2.559   3.093
  186   2HB   PHE  26          2HB       PHE  26   7.937  -2.096   1.947
  187    HD1  PHE  26           HD1      PHE  26   4.569  -0.522   2.983
  188    HD2  PHE  26           HD2      PHE  26   8.827   0.013   2.433
  189    HE1  PHE  26           HE1      PHE  26   4.433   1.604   4.094
  190    HE2  PHE  26           HE2      PHE  26   8.621   2.272   3.370
  191    HZ   PHE  26           HZ       PHE  26   6.442   3.063   4.302
  192    H    TRP  27           H        TRP  27   6.673  -3.189  -1.285
  193    HA   TRP  27           HA       TRP  27   6.553  -6.106  -0.605
  194   1HB   TRP  27          1HB       TRP  27   5.611  -6.522  -2.786
  195   2HB   TRP  27          2HB       TRP  27   4.643  -5.290  -2.017
  196    HD1  TRP  27           HD1      TRP  27   5.310  -2.754  -2.889
  197    HE1  TRP  27           HE1      TRP  27   6.001  -1.879  -5.231
  198    HE3  TRP  27           HE3      TRP  27   6.628  -7.219  -5.069
  199    HZ2  TRP  27           HZ2      TRP  27   7.200  -2.979  -7.583
  200    HZ3  TRP  27           HZ3      TRP  27   7.524  -7.253  -7.339
  201    HH2  TRP  27           HH2      TRP  27   7.815  -5.153  -8.627
  202    H    ALA  28           H        ALA  28   7.554  -7.240  -2.701
  203    HA   ALA  28           HA       ALA  28   9.574  -5.920  -4.138
  204   1HB   ALA  28          1HB       ALA  28  10.891  -6.162  -1.982
  205   2HB   ALA  28          2HB       ALA  28  10.586  -7.916  -2.042
  206   3HB   ALA  28          3HB       ALA  28  11.565  -7.135  -3.295
  207    HA   PRO  29           HA       PRO  29   8.351  -9.395  -6.570
  208   1HB   PRO  29          1HB       PRO  29  11.156  -9.892  -7.486
  209   2HB   PRO  29          2HB       PRO  29   9.669  -9.530  -8.425
  210   1HG   PRO  29          2HG       PRO  29  11.655  -7.646  -8.038
  211   2HG   PRO  29          1HG       PRO  29   9.922  -7.232  -8.154
  212   1HD   PRO  29          1HD       PRO  29  11.602  -7.450  -5.651
  213   2HD   PRO  29          2HD       PRO  29  10.295  -6.328  -6.065
  214    H    TRP  30           H        TRP  30  11.389  -9.901  -4.727
  215    HA   TRP  30           HA       TRP  30  11.105 -12.763  -4.592
  216   1HB   TRP  30          2HB       TRP  30  12.843 -12.568  -2.835
  217   2HB   TRP  30          1HB       TRP  30  13.253 -11.816  -4.368
  218    HD1  TRP  30           HD1      TRP  30  13.933  -9.348  -4.363
  219    HE1  TRP  30           HE1      TRP  30  14.329  -7.571  -2.567
  220    HE3  TRP  30           HE3      TRP  30  11.726 -11.721  -0.386
  221    HZ2  TRP  30           HZ2      TRP  30  13.668  -7.176   0.215
  222    HZ3  TRP  30           HZ3      TRP  30  11.563 -10.582   1.802
  223    HH2  TRP  30           HH2      TRP  30  12.472  -8.296   2.100
  224    H    CYS  31           H        CYS  31   9.317 -10.254  -2.935
  225    HA   CYS  31           HA       CYS  31   9.036 -11.754  -0.423
  226   1HB   CYS  31          2HB       CYS  31   8.842  -9.425  -0.263
  227   2HB   CYS  31          1HB       CYS  31   7.671  -9.337  -1.576
  228    H    GLY  32           H        GLY  32   8.226 -13.778  -0.743
  229   1HA   GLY  32          1HA       GLY  32   6.380 -14.806  -2.458
  230   2HA   GLY  32          2HA       GLY  32   6.545 -15.371  -0.798
  231    HA   PRO  33           HA       PRO  33   2.548 -13.899   0.456
  232   1HB   PRO  33          2HB       PRO  33   3.809 -11.506   1.818
  233   2HB   PRO  33          1HB       PRO  33   2.482 -12.547   2.415
  234   1HG   PRO  33          2HG       PRO  33   4.995 -12.981   3.313
  235   2HG   PRO  33          1HG       PRO  33   3.985 -14.357   2.778
  236   1HD   PRO  33          2HD       PRO  33   6.184 -12.930   1.246
  237   2HD   PRO  33          1HD       PRO  33   5.885 -14.685   1.389
  238    H    CYS  34           H        CYS  34   4.717 -11.314  -0.595
  239    HA   CYS  34           HA       CYS  34   2.733  -9.386  -1.346
  240   1HB   CYS  34          2HB       CYS  34   5.533  -9.530  -2.435
  241   2HB   CYS  34          1HB       CYS  34   4.378  -8.216  -2.410
  242    H    ARG  35           HN       ARG  35   4.733 -11.805  -3.201
  243    HA   ARG  35           HA       ARG  35   3.649 -11.297  -5.753
  244   1HB   ARG  35          1HB       ARG  35   4.711 -13.882  -4.505
  245   2HB   ARG  35          2HB       ARG  35   4.196 -13.715  -6.176
  246   1HG   ARG  35          2HG       ARG  35   5.883 -11.796  -6.393
  247   2HG   ARG  35          1HG       ARG  35   6.542 -12.357  -4.850
  248   1HD   ARG  35          2HD       ARG  35   6.183 -13.995  -7.420
  249   2HD   ARG  35          1HD       ARG  35   7.719 -13.388  -6.838
  250    HE   ARG  35           HE       ARG  35   6.313 -15.769  -5.996
  251   1HH1  ARG  35          1HH1      ARG  35   8.522 -13.272  -4.859
  252   2HH1  ARG  35          2HH1      ARG  35   9.206 -14.233  -3.569
  253   1HH2  ARG  35          2HH2      ARG  35   7.296 -17.117  -4.433
  254   2HH2  ARG  35          1HH2      ARG  35   8.564 -16.502  -3.405
  255    H    ILE  36           H        ILE  36   2.523 -13.678  -3.246
  256    HA   ILE  36           HA       ILE  36   0.425 -14.559  -5.042
  257    HB   ILE  36           HB       ILE  36  -0.434 -15.900  -3.214
  258   1HG1  ILE  36          2HG1      ILE  36   1.198 -16.006  -1.141
  259   2HG1  ILE  36          1HG1      ILE  36   1.476 -14.314  -1.509
  260   1HG2  ILE  36          1HG2      ILE  36   1.517 -17.332  -3.031
  261   2HG2  ILE  36          2HG2      ILE  36   1.486 -16.603  -4.641
  262   3HG2  ILE  36          3HG2      ILE  36   2.608 -15.987  -3.410
  263   1HD1  ILE  36          1HD1      ILE  36  -0.297 -14.555   0.172
  264   2HD1  ILE  36          2HD1      ILE  36  -1.169 -15.706  -0.859
  265   3HD1  ILE  36          3HD1      ILE  36  -1.075 -14.002  -1.322
  266    H    ILE  37           H        ILE  37   0.392 -11.964  -2.520
  267    HA   ILE  37           HA       ILE  37  -2.512 -11.677  -2.946
  268    HB   ILE  37           HB       ILE  37  -2.406  -9.709  -1.583
  269   1HG1  ILE  37          1HG1      ILE  37   0.593 -10.011  -1.750
  270   2HG1  ILE  37          2HG1      ILE  37  -0.377  -8.632  -2.208
  271   1HG2  ILE  37          1HG2      ILE  37  -2.467 -12.019  -0.595
  272   2HG2  ILE  37          2HG2      ILE  37  -1.847 -10.779   0.493
  273   3HG2  ILE  37          3HG2      ILE  37  -0.722 -11.895  -0.299
  274   1HD1  ILE  37          1HD1      ILE  37  -0.975  -8.331   0.233
  275   2HD1  ILE  37          2HD1      ILE  37   0.742  -8.121  -0.151
  276   3HD1  ILE  37          3HD1      ILE  37   0.193  -9.619   0.612
  277    H    ALA  38           H        ALA  38   0.396 -10.287  -4.415
  278    HA   ALA  38           HA       ALA  38  -0.301  -7.928  -5.410
  279   1HB   ALA  38          1HB       ALA  38   1.086 -10.087  -7.055
  280   2HB   ALA  38          2HB       ALA  38   1.837  -8.965  -5.905
  281   3HB   ALA  38          3HB       ALA  38   1.092  -8.351  -7.383
  282    HA   PRO  39           HA       PRO  39  -2.754  -9.432  -9.270
  283   1HB   PRO  39          1HB       PRO  39  -4.086 -11.936  -8.313
  284   2HB   PRO  39          2HB       PRO  39  -3.377 -11.590  -9.913
  285   1HG   PRO  39          1HG       PRO  39  -2.119 -13.261  -8.154
  286   2HG   PRO  39          2HG       PRO  39  -1.175 -12.083  -9.120
  287   1HD   PRO  39          1HD       PRO  39  -2.222 -11.737  -6.291
  288   2HD   PRO  39          2HD       PRO  39  -0.549 -11.542  -6.873
  289    H    VAL  40           H        VAL  40  -3.744 -10.281  -5.988
  290    HA   VAL  40           HA       VAL  40  -6.520  -9.535  -6.301
  291    HB   VAL  40           HB       VAL  40  -5.065  -9.894  -3.657
  292   1HG1  VAL  40          1HG1      VAL  40  -7.864 -10.609  -4.620
  293   2HG1  VAL  40          2HG1      VAL  40  -7.443  -9.139  -3.716
  294   3HG1  VAL  40          3HG1      VAL  40  -7.248 -10.740  -2.963
  295   1HG2  VAL  40          1HG2      VAL  40  -4.385 -11.892  -4.919
  296   2HG2  VAL  40          2HG2      VAL  40  -6.043 -12.105  -5.522
  297   3HG2  VAL  40          3HG2      VAL  40  -5.673 -12.329  -3.802
  298    H    VAL  41           H        VAL  41  -3.537  -8.128  -4.921
  299    HA   VAL  41           HA       VAL  41  -4.604  -5.671  -3.950
  300    HB   VAL  41           HB       VAL  41  -1.900  -6.234  -5.253
  301   1HG1  VAL  41          1HG1      VAL  41  -2.419  -7.647  -3.185
  302   2HG1  VAL  41          2HG1      VAL  41  -1.025  -6.569  -3.034
  303   3HG1  VAL  41          3HG1      VAL  41  -2.570  -6.134  -2.288
  304   1HG2  VAL  41          1HG2      VAL  41  -2.555  -4.009  -3.293
  305   2HG2  VAL  41          2HG2      VAL  41  -2.325  -3.794  -5.043
  306   3HG2  VAL  41          3HG2      VAL  41  -0.993  -4.349  -4.038
  307    H    ASP  42           HN       ASP  42  -3.266  -6.504  -7.188
  308    HA   ASP  42           HA       ASP  42  -3.935  -4.049  -8.441
  309   1HB   ASP  42          1HB       ASP  42  -3.607  -6.867  -9.534
  310   2HB   ASP  42          2HB       ASP  42  -3.793  -5.447 -10.575
  311    H    GLU  43           HN       GLU  43  -5.887  -7.136  -8.403
  312    HA   GLU  43           HA       GLU  43  -7.901  -6.005 -10.029
  313   1HB   GLU  43          1HB       GLU  43  -9.111  -7.833  -9.693
  314   2HB   GLU  43          2HB       GLU  43  -7.547  -8.494  -9.220
  315   1HG   GLU  43          2HG       GLU  43  -8.247  -8.080  -6.799
  316   2HG   GLU  43          1HG       GLU  43  -9.840  -7.587  -7.393
  317    H    ILE  44           H        ILE  44  -7.522  -5.967  -6.450
  318    HA   ILE  44           HA       ILE  44  -9.968  -4.618  -5.891
  319    HB   ILE  44           HB       ILE  44  -7.295  -4.759  -4.445
  320   1HG1  ILE  44          2HG1      ILE  44 -10.057  -5.986  -3.950
  321   2HG1  ILE  44          1HG1      ILE  44  -8.763  -6.832  -4.768
  322   1HG2  ILE  44          1HG2      ILE  44  -8.470  -3.841  -2.468
  323   2HG2  ILE  44          2HG2      ILE  44  -8.437  -2.652  -3.762
  324   3HG2  ILE  44          3HG2      ILE  44  -9.922  -3.590  -3.463
  325   1HD1  ILE  44          1HD1      ILE  44  -8.720  -5.946  -1.868
  326   2HD1  ILE  44          2HD1      ILE  44  -7.331  -6.633  -2.757
  327   3HD1  ILE  44          3HD1      ILE  44  -8.814  -7.585  -2.522
  328    H    ALA  45           H        ALA  45  -6.741  -3.335  -6.812
  329    HA   ALA  45           HA       ALA  45  -7.430  -0.572  -6.658
  330   1HB   ALA  45          1HB       ALA  45  -5.576  -0.188  -8.056
  331   2HB   ALA  45          2HB       ALA  45  -5.151  -1.721  -7.248
  332   3HB   ALA  45          3HB       ALA  45  -5.754  -1.726  -8.907
  333    H    GLY  46           H        GLY  46  -7.763  -2.980  -9.301
  334   1HA   GLY  46          2HA       GLY  46  -9.045  -1.435 -11.257
  335   2HA   GLY  46          1HA       GLY  46  -9.269  -3.178 -11.004
  336    H    GLU  47           HN       GLU  47 -10.556  -3.231  -8.453
  337    HA   GLU  47           HA       GLU  47 -13.214  -2.646  -9.131
  338   1HB   GLU  47          1HB       GLU  47 -12.009  -2.925  -6.339
  339   2HB   GLU  47          2HB       GLU  47 -13.701  -3.071  -6.776
  340   1HG   GLU  47          2HG       GLU  47 -11.484  -4.969  -7.646
  341   2HG   GLU  47          1HG       GLU  47 -12.684  -5.262  -6.418
  342    H    TYR  48           H        TYR  48 -11.014  -0.820  -6.963
  343    HA   TYR  48           HA       TYR  48 -13.074   1.316  -6.789
  344   1HB   TYR  48          2HB       TYR  48 -10.298   1.489  -5.561
  345   2HB   TYR  48          1HB       TYR  48 -11.753   2.435  -5.281
  346    HD1  TYR  48           HD1      TYR  48 -13.703   1.579  -4.202
  347    HD2  TYR  48           HD2      TYR  48  -9.905  -0.317  -4.218
  348    HE1  TYR  48           HE1      TYR  48 -14.532  -0.018  -2.426
  349    HE2  TYR  48           HE2      TYR  48 -10.629  -1.812  -2.300
  350    HH   TYR  48           HH       TYR  48 -13.945  -1.788  -1.005
  351    H    LYS  49           HN       LYS  49 -12.666   1.084  -9.257
  352    HA   LYS  49           HA       LYS  49 -10.746   2.849 -10.473
  353   1HB   LYS  49          2HB       LYS  49 -11.856   1.053 -11.731
  354   2HB   LYS  49          1HB       LYS  49 -13.452   1.711 -11.325
  355   1HG   LYS  49          2HG       LYS  49 -13.043   3.665 -12.756
  356   2HG   LYS  49          1HG       LYS  49 -11.369   3.170 -13.008
  357   1HD   LYS  49          1HD       LYS  49 -12.842   2.634 -14.943
  358   2HD   LYS  49          2HD       LYS  49 -12.050   1.207 -14.264
  359   1HE   LYS  49          2HE       LYS  49 -14.442   0.818 -14.861
  360   2HE   LYS  49          1HE       LYS  49 -14.096   0.491 -13.162
  361   1HZ   LYS  49          1HZ       LYS  49 -15.306   2.955 -14.215
  362   2HZ   LYS  49          2HZ       LYS  49 -16.108   1.737 -13.448
  363   3HZ   LYS  49          3HZ       LYS  49 -15.002   2.639 -12.626
  364    H    ASP  50           HN       ASP  50 -13.728   3.191  -8.721
  365    HA   ASP  50           HA       ASP  50 -14.386   5.920  -9.353
  366   1HB   ASP  50          1HB       ASP  50 -14.748   4.232  -6.816
  367   2HB   ASP  50          2HB       ASP  50 -15.476   5.831  -7.094
  368    H    LYS  51           HN       LYS  51 -13.160   5.032  -6.144
  369    HA   LYS  51           HA       LYS  51 -10.546   5.598  -6.658
  370   1HB   LYS  51          1HB       LYS  51 -11.772   7.751  -4.842
  371   2HB   LYS  51          2HB       LYS  51 -10.079   7.476  -5.057
  372   1HG   LYS  51          2HG       LYS  51 -11.712   8.510  -7.375
  373   2HG   LYS  51          1HG       LYS  51 -10.900   9.492  -6.234
  374   1HD   LYS  51          1HD       LYS  51  -9.665   8.938  -8.428
  375   2HD   LYS  51          2HD       LYS  51  -8.770   8.991  -6.914
  376   1HE   LYS  51          2HE       LYS  51  -8.675   6.522  -6.811
  377   2HE   LYS  51          1HE       LYS  51  -9.622   6.412  -8.319
  378   1HZ   LYS  51          1HZ       LYS  51  -7.322   6.198  -8.703
  379   2HZ   LYS  51          2HZ       LYS  51  -7.002   7.671  -8.037
  380   3HZ   LYS  51          3HZ       LYS  51  -7.886   7.566  -9.426
  381    H    LEU  52           H        LEU  52  -9.856   3.880  -5.590
  382    HA   LEU  52           HA       LEU  52  -9.538   4.774  -2.830
  383   1HB   LEU  52          1HB       LEU  52 -11.653   3.205  -2.847
  384   2HB   LEU  52          2HB       LEU  52 -10.423   1.921  -2.991
  385    HG   LEU  52           HG       LEU  52  -9.653   2.298  -0.828
  386   1HD1  LEU  52          1HD1      LEU  52 -10.437   4.120   0.630
  387   2HD1  LEU  52          2HD1      LEU  52 -11.095   4.934  -0.826
  388   3HD1  LEU  52          3HD1      LEU  52  -9.353   4.655  -0.642
  389   1HD2  LEU  52          1HD2      LEU  52 -11.759   1.135  -0.924
  390   2HD2  LEU  52          2HD2      LEU  52 -12.650   2.664  -0.815
  391   3HD2  LEU  52          3HD2      LEU  52 -11.659   2.102   0.551
  392    H    LYS  53           HN       LYS  53  -8.281   3.430  -1.640
  393    HA   LYS  53           HA       LYS  53  -6.024   3.692  -2.079
  394   1HB   LYS  53          1HB       LYS  53  -5.979   2.682   0.378
  395   2HB   LYS  53          2HB       LYS  53  -7.501   3.392   0.057
  396   1HG   LYS  53          2HG       LYS  53  -6.729   0.695   0.720
  397   2HG   LYS  53          1HG       LYS  53  -8.286   1.475   0.861
  398   1HD   LYS  53          2HD       LYS  53  -9.175   0.236  -0.775
  399   2HD   LYS  53          1HD       LYS  53  -7.842   0.440  -1.894
  400   1HE   LYS  53          2HE       LYS  53  -7.680  -1.425   0.516
  401   2HE   LYS  53          1HE       LYS  53  -8.396  -1.910  -1.023
  402   1HZ   LYS  53          1HZ       LYS  53  -6.353  -1.524  -2.088
  403   2HZ   LYS  53          2HZ       LYS  53  -6.067  -2.486  -0.783
  404   3HZ   LYS  53          3HZ       LYS  53  -5.673  -0.880  -0.742
  405    H    CYS  54           H        CYS  54  -5.337   2.183  -4.098
  406    HA   CYS  54           HA       CYS  54  -3.760  -0.044  -2.773
  407   1HB   CYS  54          1HB       CYS  54  -6.052  -0.469  -4.086
  408   2HB   CYS  54          2HB       CYS  54  -4.967  -0.399  -5.508
  409    HG   CYS  54           HG       CYS  54  -5.419  -2.842  -4.734
  410    H    VAL  55           H        VAL  55  -1.858   0.286  -2.694
  411    HA   VAL  55           HA       VAL  55  -0.350   0.943  -5.104
  412    HB   VAL  55           HB       VAL  55  -0.038   2.395  -2.427
  413   1HG1  VAL  55          1HG1      VAL  55  -0.990   4.439  -3.436
  414   2HG1  VAL  55          2HG1      VAL  55  -2.179   3.159  -3.190
  415   3HG1  VAL  55          3HG1      VAL  55  -1.540   3.481  -4.829
  416   1HG2  VAL  55          1HG2      VAL  55   0.843   3.132  -5.215
  417   2HG2  VAL  55          2HG2      VAL  55   1.248   3.999  -3.712
  418   3HG2  VAL  55          3HG2      VAL  55   1.902   2.386  -3.986
  419    H    LYS  56           HN       LYS  56   1.979   0.526  -4.653
  420    HA   LYS  56           HA       LYS  56   2.570  -1.024  -2.260
  421   1HB   LYS  56          2HB       LYS  56   3.134  -3.063  -3.530
  422   2HB   LYS  56          1HB       LYS  56   1.445  -2.607  -3.655
  423   1HG   LYS  56          2HG       LYS  56   1.829  -1.580  -5.860
  424   2HG   LYS  56          1HG       LYS  56   3.518  -2.108  -5.835
  425   1HD   LYS  56          2HD       LYS  56   2.965  -4.383  -5.994
  426   2HD   LYS  56          1HD       LYS  56   1.309  -4.130  -5.411
  427   1HE   LYS  56          1HE       LYS  56   0.769  -2.802  -7.458
  428   2HE   LYS  56          2HE       LYS  56   2.388  -3.096  -8.079
  429   1HZ   LYS  56          1HZ       LYS  56   1.877  -5.437  -8.123
  430   2HZ   LYS  56          2HZ       LYS  56   0.724  -4.604  -8.960
  431   3HZ   LYS  56          3HZ       LYS  56   0.390  -5.172  -7.461
  432    H    LEU  57           H        LEU  57   4.562  -0.584  -1.605
  433    HA   LEU  57           HA       LEU  57   6.307   1.053  -3.375
  434   1HB   LEU  57          1HB       LEU  57   5.776   2.037  -1.322
  435   2HB   LEU  57          2HB       LEU  57   6.230   0.599  -0.377
  436    HG   LEU  57           HG       LEU  57   7.680   2.536  -0.153
  437   1HD1  LEU  57          1HD1      LEU  57   9.126   3.309  -1.856
  438   2HD1  LEU  57          2HD1      LEU  57   7.534   3.285  -2.573
  439   3HD1  LEU  57          3HD1      LEU  57   8.678   1.984  -2.960
  440   1HD2  LEU  57          1HD2      LEU  57   9.311   0.317  -1.357
  441   2HD2  LEU  57          2HD2      LEU  57   9.667   1.347   0.036
  442   3HD2  LEU  57          3HD2      LEU  57   8.423   0.088   0.140
  443    H    ASN  58           H        ASN  58   7.915   0.169  -4.476
  444    HA   ASN  58           HA       ASN  58   8.717  -2.598  -3.937
  445   1HB   ASN  58          1HB       ASN  58   8.708  -1.662  -6.225
  446   2HB   ASN  58          2HB       ASN  58  10.023  -0.572  -5.780
  447   1HD2  ASN  58          2HD2      ASN  58   9.401  -3.564  -7.180
  448   2HD2  ASN  58          1HD2      ASN  58  10.969  -4.300  -6.901
  449    H    THR  59           H        THR  59   9.801  -3.001  -2.172
  450    HA   THR  59           HA       THR  59  11.236  -1.031  -0.635
  451    HB   THR  59           HB       THR  59  11.216  -4.064  -0.338
  452    HG1  THR  59           HG1      THR  59   9.116  -3.384  -0.457
  453   1HG2  THR  59          1HG2      THR  59  11.512  -1.801   1.685
  454   2HG2  THR  59          2HG2      THR  59  12.802  -2.914   1.172
  455   3HG2  THR  59          3HG2      THR  59  11.407  -3.531   2.074
  456    H    ASP  60           HN       ASP  60  12.165  -3.417  -3.020
  457    HA   ASP  60           HA       ASP  60  14.947  -3.670  -2.293
  458   1HB   ASP  60          1HB       ASP  60  13.276  -5.152  -3.712
  459   2HB   ASP  60          2HB       ASP  60  13.781  -4.135  -5.060
  460    H    GLU  61           HN       GLU  61  13.024  -1.742  -4.489
  461    HA   GLU  61           HA       GLU  61  15.217  -0.160  -5.582
  462   1HB   GLU  61          2HB       GLU  61  13.049  -1.007  -6.738
  463   2HB   GLU  61          1HB       GLU  61  12.217   0.263  -5.827
  464   1HG   GLU  61          1HG       GLU  61  12.647   1.125  -7.977
  465   2HG   GLU  61          2HG       GLU  61  13.830   1.926  -6.946
  466    H    SER  62           H        SER  62  12.832   0.136  -3.011
  467    HA   SER  62           HA       SER  62  13.741   2.913  -2.370
  468   1HB   SER  62          2HB       SER  62  11.444   2.707  -3.304
  469   2HB   SER  62          1HB       SER  62  10.975   1.731  -1.907
  470    HG   SER  62           HG       SER  62  11.570   3.403  -0.564
  471    HA   PRO  63           HA       PRO  63  14.432   0.012   1.322
  472   1HB   PRO  63          1HB       PRO  63  17.134   0.333   1.552
  473   2HB   PRO  63          2HB       PRO  63  16.415  -0.892   0.462
  474   1HG   PRO  63          2HG       PRO  63  17.356   1.903  -0.289
  475   2HG   PRO  63          1HG       PRO  63  17.781   0.376  -1.078
  476   1HD   PRO  63          1HD       PRO  63  15.783   1.882  -2.066
  477   2HD   PRO  63          2HD       PRO  63  15.590   0.111  -1.999
  478    H    ASN  64           H        ASN  64  15.643   3.039   0.084
  479    HA   ASN  64           HA       ASN  64  16.337   4.659   2.151
  480   1HB   ASN  64          2HB       ASN  64  14.477   5.239  -0.200
  481   2HB   ASN  64          1HB       ASN  64  15.041   6.485   0.915
  482   1HD2  ASN  64          1HD2      ASN  64  15.770   7.203  -1.412
  483   2HD2  ASN  64          2HD2      ASN  64  17.414   6.722  -1.840
  484    H    VAL  65           H        VAL  65  12.959   4.843   1.087
  485    HA   VAL  65           HA       VAL  65  11.910   6.138   3.319
  486    HB   VAL  65           HB       VAL  65  10.629   4.181   1.344
  487   1HG1  VAL  65          1HG2      VAL  65   9.173   4.425   3.275
  488   2HG1  VAL  65          2HG2      VAL  65   9.327   6.195   3.205
  489   3HG1  VAL  65          3HG2      VAL  65   8.510   5.296   1.895
  490   1HG2  VAL  65          1HG1      VAL  65   9.872   6.309   0.255
  491   2HG2  VAL  65          2HG1      VAL  65  10.903   7.219   1.377
  492   3HG2  VAL  65          3HG1      VAL  65  11.629   6.091   0.212
  493    H    ALA  66           H        ALA  66  12.053   2.714   2.583
  494    HA   ALA  66           HA       ALA  66  10.700   1.689   4.854
  495   1HB   ALA  66          1HB       ALA  66  11.315   0.349   2.847
  496   2HB   ALA  66          2HB       ALA  66  13.016   0.377   3.354
  497   3HB   ALA  66          3HB       ALA  66  11.811  -0.437   4.359
  498    H    SER  67           H        SER  67  14.145   2.584   4.465
  499    HA   SER  67           HA       SER  67  14.920   1.712   7.113
  500   1HB   SER  67          2HB       SER  67  16.306   3.660   5.215
  501   2HB   SER  67          1HB       SER  67  17.014   2.861   6.629
  502    HG   SER  67           HG       SER  67  15.977   1.585   4.306
  503    H    GLU  68           HN       GLU  68  14.011   4.825   5.640
  504    HA   GLU  68           HA       GLU  68  14.479   6.491   7.899
  505   1HB   GLU  68          1HB       GLU  68  12.366   6.689   5.698
  506   2HB   GLU  68          2HB       GLU  68  12.663   7.942   6.897
  507   1HG   GLU  68          2HG       GLU  68  14.770   6.919   4.935
  508   2HG   GLU  68          1HG       GLU  68  13.812   8.388   4.732
  509    H    TYR  69           H        TYR  69  11.580   4.585   7.005
  510    HA   TYR  69           HA       TYR  69  10.194   5.317   9.478
  511   1HB   TYR  69          2HB       TYR  69   9.733   3.234   7.314
  512   2HB   TYR  69          1HB       TYR  69   8.732   3.328   8.749
  513    HD1  TYR  69           HD1      TYR  69   8.620   4.122   5.450
  514    HD2  TYR  69           HD2      TYR  69   7.988   5.981   9.282
  515    HE1  TYR  69           HE1      TYR  69   7.092   5.797   4.403
  516    HE2  TYR  69           HE2      TYR  69   6.475   7.635   8.238
  517    HH   TYR  69           HH       TYR  69   5.568   8.408   6.271
  518    H    GLY  70           H        GLY  70  12.170   2.555   8.396
  519   1HA   GLY  70          2HA       GLY  70  13.601   1.349   9.822
  520   2HA   GLY  70          1HA       GLY  70  12.642   1.800  11.235
  521    H    ILE  71           H        ILE  71  11.739   0.374   8.070
  522    HA   ILE  71           HA       ILE  71   9.974  -1.571   9.318
  523    HB   ILE  71           HB       ILE  71  10.891  -1.059   6.461
  524   1HG1  ILE  71          2HG1      ILE  71   8.324  -0.482   8.029
  525   2HG1  ILE  71          1HG1      ILE  71   9.525   0.705   7.518
  526   1HG2  ILE  71          1HG2      ILE  71   8.813  -3.039   7.494
  527   2HG2  ILE  71          2HG2      ILE  71  10.330  -3.423   6.650
  528   3HG2  ILE  71          3HG2      ILE  71   9.046  -2.605   5.785
  529   1HD1  ILE  71          1HD1      ILE  71   7.732   0.880   6.007
  530   2HD1  ILE  71          2HD1      ILE  71   9.073   0.087   5.143
  531   3HD1  ILE  71          3HD1      ILE  71   7.676  -0.860   5.694
  532    H    ARG  72           HN       ARG  72  10.444  -3.588   9.942
  533    HA   ARG  72           HA       ARG  72  13.196  -4.444   9.941
  534   1HB   ARG  72          1HB       ARG  72  11.624  -4.736  11.839
  535   2HB   ARG  72          2HB       ARG  72  10.647  -5.843  10.873
  536   1HG   ARG  72          2HG       ARG  72  12.124  -7.005  12.484
  537   2HG   ARG  72          1HG       ARG  72  12.427  -7.496  10.816
  538   1HD   ARG  72          1HD       ARG  72  14.506  -7.170  12.166
  539   2HD   ARG  72          2HD       ARG  72  14.443  -6.181  10.703
  540    HE   ARG  72           HE       ARG  72  13.395  -4.839  13.077
  541   1HH1  ARG  72          1HH1      ARG  72  16.373  -5.607  11.340
  542   2HH1  ARG  72          2HH1      ARG  72  17.240  -4.210  11.918
  543   1HH2  ARG  72          2HH2      ARG  72  14.505  -3.006  13.832
  544   2HH2  ARG  72          1HH2      ARG  72  16.161  -2.716  13.379
  545    H    SER  73           H        SER  73  10.261  -5.458   8.129
  546    HA   SER  73           HA       SER  73  11.798  -6.687   6.086
  547   1HB   SER  73          1HB       SER  73  11.936  -8.551   7.763
  548   2HB   SER  73          2HB       SER  73  10.159  -8.603   7.816
  549    HG   SER  73           HG       SER  73  11.084 -10.124   6.332
  550    H    ILE  74           H        ILE  74   9.851  -8.191   4.935
  551    HA   ILE  74           HA       ILE  74   7.480  -6.418   4.732
  552    HB   ILE  74           HB       ILE  74   7.650  -6.678   2.203
  553   1HG1  ILE  74          1HG1      ILE  74  10.557  -7.288   2.722
  554   2HG1  ILE  74          2HG1      ILE  74   9.353  -8.491   2.214
  555   1HG2  ILE  74          1HG2      ILE  74   9.868  -5.069   3.554
  556   2HG2  ILE  74          2HG2      ILE  74   9.034  -4.691   2.036
  557   3HG2  ILE  74          3HG2      ILE  74   8.159  -4.593   3.558
  558   1HD1  ILE  74          1HD1      ILE  74  10.209  -6.014   0.664
  559   2HD1  ILE  74          2HD1      ILE  74  10.427  -7.707   0.220
  560   3HD1  ILE  74          3HD1      ILE  74   8.804  -7.018   0.236
  561    HA   PRO  75           HA       PRO  75   5.530  -6.754   2.800
  562   1HB   PRO  75          2HB       PRO  75   2.964  -7.273   3.511
  563   2HB   PRO  75          1HB       PRO  75   3.789  -8.103   2.176
  564   1HG   PRO  75          1HG       PRO  75   3.476  -9.065   5.049
  565   2HG   PRO  75          2HG       PRO  75   3.104  -9.984   3.561
  566   1HD   PRO  75          1HD       PRO  75   5.463 -10.279   4.875
  567   2HD   PRO  75          2HD       PRO  75   5.414 -10.301   3.096
  568    H    THR  76           H        THR  76   4.348  -4.919   3.646
  569    HA   THR  76           HA       THR  76   3.766  -4.656   6.397
  570    HB   THR  76           HB       THR  76   6.480  -3.589   5.474
  571    HG1  THR  76           HG1      THR  76   6.140  -5.507   6.837
  572   1HG2  THR  76          1HG2      THR  76   6.583  -2.131   7.481
  573   2HG2  THR  76          2HG2      THR  76   5.393  -1.535   6.315
  574   3HG2  THR  76          3HG2      THR  76   4.869  -2.412   7.777
  575    H    ILE  77           H        ILE  77   2.341  -3.360   6.391
  576    HA   ILE  77           HA       ILE  77   0.934  -2.179   5.118
  577    HB   ILE  77           HB       ILE  77   0.389  -1.625   7.940
  578   1HG1  ILE  77          1HG1      ILE  77   3.197  -0.667   7.589
  579   2HG1  ILE  77          2HG1      ILE  77   1.777   0.177   8.197
  580   1HG2  ILE  77          1HG2      ILE  77   1.363  -3.123   9.345
  581   2HG2  ILE  77          2HG2      ILE  77   2.805  -3.345   8.348
  582   3HG2  ILE  77          3HG2      ILE  77   1.282  -4.041   7.877
  583   1HD1  ILE  77          1HD1      ILE  77   1.956  -1.123  10.325
  584   2HD1  ILE  77          2HD1      ILE  77   3.496  -1.775   9.730
  585   3HD1  ILE  77          3HD1      ILE  77   3.295  -0.042   9.946
  586    H    MET  78           H        MET  78   2.148   0.520   4.455
  587    HA   MET  78           HA       MET  78   0.849   1.957   6.783
  588   1HB   MET  78          1HB       MET  78   2.886   3.027   4.822
  589   2HB   MET  78          2HB       MET  78   2.012   3.999   6.016
  590   1HG   MET  78          1HG       MET  78   2.895   2.604   7.836
  591   2HG   MET  78          2HG       MET  78   3.764   1.600   6.691
  592   1HE   MET  78          1HE       MET  78   6.092   1.957   8.096
  593   2HE   MET  78          2HE       MET  78   4.907   2.671   9.220
  594   3HE   MET  78          3HE       MET  78   6.403   3.542   8.847
  595    H    VAL  79           H        VAL  79  -1.067   2.925   6.535
  596    HA   VAL  79           HA       VAL  79  -2.048   3.354   3.773
  597    HB   VAL  79           HB       VAL  79  -3.652   3.359   6.339
  598   1HG1  VAL  79          1HG1      VAL  79  -3.243   1.098   4.357
  599   2HG1  VAL  79          2HG1      VAL  79  -4.532   1.134   5.570
  600   3HG1  VAL  79          3HG1      VAL  79  -2.835   1.077   6.082
  601   1HG2  VAL  79          1HG2      VAL  79  -5.613   3.135   4.851
  602   2HG2  VAL  79          2HG2      VAL  79  -4.558   3.178   3.432
  603   3HG2  VAL  79          3HG2      VAL  79  -4.717   4.604   4.474
  604    H    PHE  80           H        PHE  80  -2.551   5.429   3.160
  605    HA   PHE  80           HA       PHE  80  -2.160   7.614   5.151
  606   1HB   PHE  80          1HB       PHE  80  -1.194   7.530   2.259
  607   2HB   PHE  80          2HB       PHE  80  -1.018   8.882   3.360
  608    HD1  PHE  80           HD1      PHE  80   1.040   9.129   4.498
  609    HD2  PHE  80           HD2      PHE  80  -0.026   5.285   2.866
  610    HE1  PHE  80           HE1      PHE  80   3.226   8.212   5.215
  611    HE2  PHE  80           HE2      PHE  80   2.233   4.476   3.338
  612    HZ   PHE  80           HZ       PHE  80   3.849   5.875   4.622
  613    H    LYS  81           HN       LYS  81  -3.162   9.627   4.505
  614    HA   LYS  81           HA       LYS  81  -4.753   9.991   2.233
  615   1HB   LYS  81          2HB       LYS  81  -6.955  10.009   2.979
  616   2HB   LYS  81          1HB       LYS  81  -6.374   8.437   3.481
  617   1HG   LYS  81          2HG       LYS  81  -6.619  10.814   5.370
  618   2HG   LYS  81          1HG       LYS  81  -7.899   9.667   5.066
  619   1HD   LYS  81          2HD       LYS  81  -5.151   8.980   6.177
  620   2HD   LYS  81          1HD       LYS  81  -6.626   9.187   7.116
  621   1HE   LYS  81          1HE       LYS  81  -6.074   6.957   5.097
  622   2HE   LYS  81          2HE       LYS  81  -6.262   6.812   6.843
  623   1HZ   LYS  81          1HZ       LYS  81  -8.225   6.152   5.761
  624   2HZ   LYS  81          2HZ       LYS  81  -8.517   7.512   6.641
  625   3HZ   LYS  81          3HZ       LYS  81  -8.382   7.603   5.000
  626    H    GLY  82           H        GLY  82  -5.867  12.223   2.510
  627   1HA   GLY  82          2HA       GLY  82  -5.700  14.433   3.152
  628   2HA   GLY  82          1HA       GLY  82  -5.612  13.788   4.811
  629    H    GLY  83           H        GLY  83  -3.241  13.138   2.249
  630   1HA   GLY  83          2HA       GLY  83  -1.068  13.729   1.980
  631   2HA   GLY  83          1HA       GLY  83  -1.343  15.137   2.996
  632    H    LYS  84           HN       LYS  84  -2.067  12.182   4.748
  633    HA   LYS  84           HA       LYS  84   0.712  11.845   5.662
  634   1HB   LYS  84          2HB       LYS  84  -1.550  12.915   7.400
  635   2HB   LYS  84          1HB       LYS  84  -0.161  12.113   8.110
  636   1HG   LYS  84          2HG       LYS  84  -0.012  14.668   6.481
  637   2HG   LYS  84          1HG       LYS  84   0.053  14.515   8.233
  638   1HD   LYS  84          2HD       LYS  84   2.117  13.072   8.019
  639   2HD   LYS  84          1HD       LYS  84   2.117  13.389   6.273
  640   1HE   LYS  84          1HE       LYS  84   2.265  15.819   6.686
  641   2HE   LYS  84          2HE       LYS  84   2.294  15.526   8.437
  642   1HZ   LYS  84          1HZ       LYS  84   4.311  14.284   8.129
  643   2HZ   LYS  84          2HZ       LYS  84   4.282  14.562   6.504
  644   3HZ   LYS  84          3HZ       LYS  84   4.477  15.818   7.551
  645    H    LYS  85           HN       LYS  85   0.845  10.327   7.431
  646    HA   LYS  85           HA       LYS  85  -0.129   7.730   6.652
  647   1HB   LYS  85          2HB       LYS  85   2.123   8.012   7.526
  648   2HB   LYS  85          1HB       LYS  85   1.522   8.905   8.924
  649   1HG   LYS  85          1HG       LYS  85   2.244   6.795   9.674
  650   2HG   LYS  85          2HG       LYS  85   0.496   6.848   9.843
  651   1HD   LYS  85          2HD       LYS  85   0.463   5.617   7.507
  652   2HD   LYS  85          1HD       LYS  85   2.188   5.366   7.798
  653   1HE   LYS  85          2HE       LYS  85  -0.102   4.496   9.643
  654   2HE   LYS  85          1HE       LYS  85   0.789   3.440   8.550
  655   1HZ   LYS  85          1HZ       LYS  85   2.781   3.943   9.788
  656   2HZ   LYS  85          2HZ       LYS  85   1.620   3.283  10.759
  657   3HZ   LYS  85          3HZ       LYS  85   1.927   4.899  10.825
  658    H    CYS  86           H        CYS  86  -1.567   6.355   7.811
  659    HA   CYS  86           HA       CYS  86  -2.827   7.346  10.300
  660   1HB   CYS  86          2HB       CYS  86  -4.177   7.249   7.631
  661   2HB   CYS  86          1HB       CYS  86  -5.091   6.622   9.023
  662    HG   CYS  86           HG       CYS  86  -3.550   9.514   8.971
  663    H    GLU  87           HN       GLU  87  -3.775   4.747   7.937
  664    HA   GLU  87           HA       GLU  87  -3.953   2.966  10.297
  665   1HB   GLU  87          2HB       GLU  87  -4.829   1.992   7.632
  666   2HB   GLU  87          1HB       GLU  87  -5.560   1.802   9.205
  667   1HG   GLU  87          2HG       GLU  87  -5.699   4.338   7.483
  668   2HG   GLU  87          1HG       GLU  87  -6.929   3.115   7.634
  669    H    THR  88           H        THR  88  -3.461   0.567   9.759
  670    HA   THR  88           HA       THR  88  -0.849   0.291   8.332
  671    HB   THR  88           HB       THR  88  -0.221  -1.055  10.404
  672    HG1  THR  88           HG1      THR  88  -2.397  -1.174  11.159
  673   1HG2  THR  88          1HG2      THR  88   0.443   0.888  11.721
  674   2HG2  THR  88          2HG2      THR  88   0.616   1.295  10.002
  675   3HG2  THR  88          3HG2      THR  88  -0.768   1.911  10.933
  676    H    ILE  89           H        ILE  89  -1.265  -1.450   6.839
  677    HA   ILE  89           HA       ILE  89  -2.786  -3.869   7.797
  678    HB   ILE  89           HB       ILE  89  -2.551  -2.436   5.161
  679   1HG1  ILE  89          2HG1      ILE  89  -5.038  -3.575   6.557
  680   2HG1  ILE  89          1HG1      ILE  89  -4.366  -2.044   7.110
  681   1HG2  ILE  89          1HG2      ILE  89  -3.477  -5.295   5.650
  682   2HG2  ILE  89          2HG2      ILE  89  -2.247  -4.734   4.496
  683   3HG2  ILE  89          3HG2      ILE  89  -3.939  -4.357   4.212
  684   1HD1  ILE  89          1HD1      ILE  89  -6.214  -1.705   5.546
  685   2HD1  ILE  89          2HD1      ILE  89  -4.690  -1.000   4.987
  686   3HD1  ILE  89          3HD1      ILE  89  -5.276  -2.503   4.265
  687    H    ILE  90           H        ILE  90  -1.575  -5.725   8.015
  688    HA   ILE  90           HA       ILE  90   1.165  -5.882   6.779
  689    HB   ILE  90           HB       ILE  90  -0.384  -7.792   8.598
  690   1HG1  ILE  90          2HG1      ILE  90   1.920  -5.906   9.294
  691   2HG1  ILE  90          1HG1      ILE  90   0.220  -5.570   9.660
  692   1HG2  ILE  90          1HG2      ILE  90   2.538  -7.766   7.685
  693   2HG2  ILE  90          2HG2      ILE  90   1.873  -8.853   8.919
  694   3HG2  ILE  90          3HG2      ILE  90   1.315  -8.990   7.272
  695   1HD1  ILE  90          1HD1      ILE  90   1.893  -7.803  10.842
  696   2HD1  ILE  90          2HD1      ILE  90   0.124  -7.675  11.015
  697   3HD1  ILE  90          3HD1      ILE  90   1.184  -6.400  11.644
  698    H    GLY  91           H        GLY  91   1.599  -7.705   5.307
  699   1HA   GLY  91          2HA       GLY  91  -0.600  -8.283   3.450
  700   2HA   GLY  91          1HA       GLY  91   1.070  -8.844   3.335
  701    H    ALA  92           H        ALA  92   0.181 -11.027   2.847
  702    HA   ALA  92           HA       ALA  92  -0.351 -13.148   3.333
  703   1HB   ALA  92          1HB       ALA  92   1.482 -12.802   4.993
  704   2HB   ALA  92          2HB       ALA  92   0.309 -14.042   5.471
  705   3HB   ALA  92          3HB       ALA  92   0.265 -12.449   6.239
  706    H    VAL  93           H        VAL  93  -2.302 -10.768   5.004
  707    HA   VAL  93           HA       VAL  93  -4.256 -12.581   6.041
  708    HB   VAL  93           HB       VAL  93  -5.552 -10.163   5.307
  709   1HG1  VAL  93          1HG1      VAL  93  -4.234  -8.434   6.404
  710   2HG1  VAL  93          2HG1      VAL  93  -3.307  -9.099   5.057
  711   3HG1  VAL  93          3HG1      VAL  93  -2.924  -9.578   6.733
  712   1HG2  VAL  93          1HG2      VAL  93  -4.612 -11.064   7.992
  713   2HG2  VAL  93          2HG2      VAL  93  -5.784  -9.766   7.625
  714   3HG2  VAL  93          3HG2      VAL  93  -6.164 -11.437   7.196
  715    HA   PRO  94           HA       PRO  94  -6.531 -13.143   2.163
  716   1HB   PRO  94          1HB       PRO  94  -9.086 -13.296   3.567
  717   2HB   PRO  94          2HB       PRO  94  -8.264 -14.556   2.617
  718   1HG   PRO  94          2HG       PRO  94  -8.442 -14.740   5.394
  719   2HG   PRO  94          1HG       PRO  94  -7.013 -15.321   4.488
  720   1HD   PRO  94          2HD       PRO  94  -7.391 -12.644   5.829
  721   2HD   PRO  94          1HD       PRO  94  -6.005 -13.730   6.005
  722    H    LYS  95           HN       LYS  95  -7.346 -11.556   0.919
  723    HA   LYS  95           HA       LYS  95  -7.232  -8.982   1.948
  724   1HB   LYS  95          2HB       LYS  95  -8.104 -10.202  -0.696
  725   2HB   LYS  95          1HB       LYS  95  -8.506  -8.512  -0.438
  726   1HG   LYS  95          2HG       LYS  95  -5.677  -9.595  -0.074
  727   2HG   LYS  95          1HG       LYS  95  -6.288  -8.972  -1.614
  728   1HD   LYS  95          2HD       LYS  95  -6.875  -6.796  -0.477
  729   2HD   LYS  95          1HD       LYS  95  -6.049  -7.367   0.962
  730   1HE   LYS  95          1HE       LYS  95  -4.754  -7.112  -1.778
  731   2HE   LYS  95          2HE       LYS  95  -4.636  -5.908  -0.483
  732   1HZ   LYS  95          1HZ       LYS  95  -3.706  -8.682  -0.284
  733   2HZ   LYS  95          2HZ       LYS  95  -2.752  -7.357  -0.503
  734   3HZ   LYS  95          3HZ       LYS  95  -3.599  -7.540   0.898
  735    H    ALA  96           H        ALA  96 -10.128 -10.941   1.589
  736    HA   ALA  96           HA       ALA  96 -12.155  -9.028   1.782
  737   1HB   ALA  96          1HB       ALA  96 -12.566 -11.463   1.709
  738   2HB   ALA  96          2HB       ALA  96 -13.417 -10.718   3.078
  739   3HB   ALA  96          3HB       ALA  96 -11.920 -11.634   3.358
  740    H    THR  97           H        THR  97  -9.897 -10.121   4.306
  741    HA   THR  97           HA       THR  97 -11.027  -8.814   6.560
  742    HB   THR  97           HB       THR  97  -8.055  -9.313   6.036
  743    HG1  THR  97           HG1      THR  97  -8.852 -11.186   5.462
  744   1HG2  THR  97          1HG2      THR  97  -8.590  -8.296   8.216
  745   2HG2  THR  97          2HG2      THR  97  -9.771  -9.596   8.538
  746   3HG2  THR  97          3HG2      THR  97  -8.046  -9.974   8.407
  747    H    ILE  98           H        ILE  98  -8.549  -7.883   4.187
  748    HA   ILE  98           HA       ILE  98  -7.867  -5.317   5.285
  749    HB   ILE  98           HB       ILE  98  -7.398  -6.799   2.670
  750   1HG1  ILE  98          2HG1      ILE  98  -5.599  -5.742   4.876
  751   2HG1  ILE  98          1HG1      ILE  98  -6.221  -7.383   4.822
  752   1HG2  ILE  98          1HG2      ILE  98  -5.906  -4.858   2.004
  753   2HG2  ILE  98          2HG2      ILE  98  -6.647  -3.925   3.317
  754   3HG2  ILE  98          3HG2      ILE  98  -7.617  -4.489   1.948
  755   1HD1  ILE  98          1HD1      ILE  98  -4.412  -6.272   2.638
  756   2HD1  ILE  98          2HD1      ILE  98  -3.879  -7.196   4.032
  757   3HD1  ILE  98          3HD1      ILE  98  -4.973  -7.948   2.866
  758    H    VAL  99           H        VAL  99 -10.035  -6.317   2.623
  759    HA   VAL  99           HA       VAL  99 -10.895  -3.778   1.788
  760    HB   VAL  99           HB       VAL  99 -12.295  -6.481   1.881
  761   1HG1  VAL  99          1HG2      VAL  99 -13.863  -5.528   0.176
  762   2HG1  VAL  99          2HG2      VAL  99 -13.207  -3.915   0.521
  763   3HG1  VAL  99          3HG2      VAL  99 -14.078  -4.823   1.780
  764   1HG2  VAL  99          1HG1      VAL  99 -11.755  -6.522  -0.516
  765   2HG2  VAL  99          2HG1      VAL  99 -10.265  -6.251   0.396
  766   3HG2  VAL  99          3HG1      VAL  99 -11.057  -4.894  -0.419
  767    H    GLN 100           H        GLN 100 -12.421  -5.935   4.280
  768    HA   GLN 100           HA       GLN 100 -14.358  -4.023   5.124
  769   1HB   GLN 100          2HB       GLN 100 -12.967  -6.317   6.560
  770   2HB   GLN 100          1HB       GLN 100 -14.289  -5.388   7.284
  771   1HG   GLN 100          1HG       GLN 100 -15.844  -6.032   5.599
  772   2HG   GLN 100          2HG       GLN 100 -14.592  -6.728   4.564
  773   1HE2  GLN 100          1HE2      GLN 100 -13.336  -8.565   5.454
  774   2HE2  GLN 100          2HE2      GLN 100 -14.189  -9.727   6.482
  775    H    THR 101           H        THR 101 -11.073  -4.685   6.397
  776    HA   THR 101           HA       THR 101 -11.131  -2.864   8.551
  777    HB   THR 101           HB       THR 101  -8.748  -3.742   6.862
  778    HG1  THR 101           HG1      THR 101  -9.884  -5.469   7.798
  779   1HG2  THR 101          1HG2      THR 101  -8.891  -2.607   9.689
  780   2HG2  THR 101          2HG2      THR 101  -8.108  -1.840   8.288
  781   3HG2  THR 101          3HG2      THR 101  -7.453  -3.343   8.954
  782    H    VAL 102           H        VAL 102 -10.222  -2.246   5.101
  783    HA   VAL 102           HA       VAL 102  -9.523   0.511   5.788
  784    HB   VAL 102           HB       VAL 102  -8.563  -1.047   3.987
  785   1HG1  VAL 102          1HG2      VAL 102  -7.667   0.876   2.861
  786   2HG1  VAL 102          2HG2      VAL 102  -9.119   1.853   3.205
  787   3HG1  VAL 102          3HG2      VAL 102  -7.987   1.410   4.498
  788   1HG2  VAL 102          1HG1      VAL 102  -9.344  -0.686   1.713
  789   2HG2  VAL 102          2HG1      VAL 102 -10.765   0.177   2.289
  790   3HG2  VAL 102          3HG1      VAL 102 -10.530  -1.547   2.678
  791    H    GLU 103           HN       GLU 103 -12.192  -1.112   4.105
  792    HA   GLU 103           HA       GLU 103 -13.678   1.171   3.374
  793   1HB   GLU 103          1HB       GLU 103 -14.500  -1.673   4.083
  794   2HB   GLU 103          2HB       GLU 103 -15.668  -0.438   3.641
  795   1HG   GLU 103          2HG       GLU 103 -14.486   0.005   1.510
  796   2HG   GLU 103          1HG       GLU 103 -13.301  -1.250   1.886
  797    H    LYS 104           HN       LYS 104 -13.562  -0.502   6.491
  798    HA   LYS 104           HA       LYS 104 -15.487   0.805   8.004
  799   1HB   LYS 104          2HB       LYS 104 -13.857  -0.792   8.955
  800   2HB   LYS 104          1HB       LYS 104 -12.551   0.339   8.592
  801   1HG   LYS 104          2HG       LYS 104 -13.702   1.986  10.243
  802   2HG   LYS 104          1HG       LYS 104 -14.610   0.558  10.778
  803   1HD   LYS 104          2HD       LYS 104 -12.310  -0.587  11.024
  804   2HD   LYS 104          1HD       LYS 104 -11.585   0.982  10.665
  805   1HE   LYS 104          1HE       LYS 104 -13.411   0.345  13.035
  806   2HE   LYS 104          2HE       LYS 104 -11.655   0.573  13.095
  807   1HZ   LYS 104          1HZ       LYS 104 -12.786   2.540  13.751
  808   2HZ   LYS 104          2HZ       LYS 104 -13.624   2.613  12.334
  809   3HZ   LYS 104          3HZ       LYS 104 -11.989   2.820  12.337
  810    H    TYR 105           H        TYR 105 -12.284   2.090   6.996
  811    HA   TYR 105           HA       TYR 105 -12.754   4.690   8.289
  812   1HB   TYR 105          1HB       TYR 105 -10.426   3.663   6.620
  813   2HB   TYR 105          2HB       TYR 105 -10.479   5.114   7.607
  814    HD1  TYR 105           HD1      TYR 105  -9.327   1.820   7.582
  815    HD2  TYR 105           HD2      TYR 105 -11.037   4.807  10.163
  816    HE1  TYR 105           HE1      TYR 105  -8.294   0.710   9.529
  817    HE2  TYR 105           HE2      TYR 105  -9.944   3.730  12.119
  818    HH   TYR 105           HH       TYR 105  -7.928   0.808  11.816
  819    H    LEU 106           H        LEU 106 -14.748   4.377   6.523
  820    HA   LEU 106           HA       LEU 106 -14.366   6.550   4.694
  821   1HB   LEU 106          2HB       LEU 106 -14.804   3.744   3.608
  822   2HB   LEU 106          1HB       LEU 106 -15.523   5.152   2.833
  823    HG   LEU 106           HG       LEU 106 -12.565   4.549   3.098
  824   1HD1  LEU 106          1HD2      LEU 106 -13.960   7.115   2.196
  825   2HD1  LEU 106          2HD2      LEU 106 -12.657   6.960   3.400
  826   3HD1  LEU 106          3HD2      LEU 106 -12.315   6.681   1.699
  827   1HD2  LEU 106          1HD1      LEU 106 -14.479   4.989   0.754
  828   2HD2  LEU 106          2HD1      LEU 106 -12.757   4.629   0.633
  829   3HD2  LEU 106          3HD1      LEU 106 -13.859   3.417   1.313
  830    H    ASN 107           H        ASN 107 -15.890   7.648   5.567
  831    HA   ASN 107           HA       ASN 107 -18.643   7.060   5.329
  832   1HB   ASN 107          2HB       ASN 107 -17.897   5.804   7.514
  833   2HB   ASN 107          1HB       ASN 107 -17.656   7.415   8.194
  834   1HD2  ASN 107          2HD2      ASN 107 -19.927   8.766   7.071
  835   2HD2  ASN 107          1HD2      ASN 107 -21.377   8.022   7.765
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1  -7.444   3.610  -6.465
    2   2H    MET   1          2H        MET   1  -7.973   4.372  -7.828
    3   3H    MET   1          3H        MET   1  -7.458   5.244  -6.505
    4    HA   MET   1           HA       MET   1  -5.873   5.043  -8.442
    5   1HB   MET   1          2HB       MET   1  -5.207   5.887  -6.237
    6   2HB   MET   1          1HB       MET   1  -5.096   4.244  -5.596
    7   1HG   MET   1          2HG       MET   1  -2.885   5.293  -6.126
    8   2HG   MET   1          1HG       MET   1  -3.168   3.748  -6.904
    9   1HE   MET   1          1HE       MET   1  -4.524   7.347  -8.052
   10   2HE   MET   1          2HE       MET   1  -3.143   7.824  -9.062
   11   3HE   MET   1          3HE       MET   1  -2.920   7.593  -7.313
   12    H    GLU   2           HN       GLU   2  -4.591   3.615  -9.644
   13    HA   GLU   2           HA       GLU   2  -5.268   0.759  -9.534
   14   1HB   GLU   2          2HB       GLU   2  -3.881   0.634 -11.566
   15   2HB   GLU   2          1HB       GLU   2  -5.150   1.855 -11.704
   16   1HG   GLU   2          2HG       GLU   2  -3.495   3.659 -11.289
   17   2HG   GLU   2          1HG       GLU   2  -2.224   2.456 -11.031
   18    H    ALA   3           H        ALA   3  -3.413  -0.889  -9.537
   19    HA   ALA   3           HA       ALA   3  -1.738  -0.428  -7.235
   20   1HB   ALA   3          1HB       ALA   3  -0.923  -2.734  -7.761
   21   2HB   ALA   3          2HB       ALA   3  -2.671  -2.614  -7.607
   22   3HB   ALA   3          3HB       ALA   3  -1.931  -2.721  -9.223
   23    H    GLY   4           H        GLY   4  -0.747   1.556  -8.396
   24   1HA   GLY   4          1HA       GLY   4   1.221   1.180 -10.432
   25   2HA   GLY   4          2HA       GLY   4   1.124   2.543  -9.301
   26    H    ALA   5           H        ALA   5   3.416   0.730 -10.307
   27    HA   ALA   5           HA       ALA   5   4.463  -0.390  -7.795
   28   1HB   ALA   5          1HB       ALA   5   5.053  -1.502  -9.844
   29   2HB   ALA   5          2HB       ALA   5   5.759   0.010 -10.499
   30   3HB   ALA   5          3HB       ALA   5   6.488  -0.777  -9.074
   31    H    VAL   6           H        VAL   6   4.627   1.244  -6.443
   32    HA   VAL   6           HA       VAL   6   5.668   3.919  -7.264
   33    HB   VAL   6           HB       VAL   6   5.218   4.532  -4.829
   34   1HG1  VAL   6          1HG1      VAL   6   3.531   3.245  -3.615
   35   2HG1  VAL   6          2HG1      VAL   6   3.517   2.007  -4.865
   36   3HG1  VAL   6          3HG1      VAL   6   4.971   2.273  -3.864
   37   1HG2  VAL   6          1HG2      VAL   6   2.923   3.764  -6.656
   38   2HG2  VAL   6          2HG2      VAL   6   3.799   5.316  -6.605
   39   3HG2  VAL   6          3HG2      VAL   6   2.789   4.819  -5.242
   40    H    ASN   7           H        ASN   7   7.383   4.900  -5.975
   41    HA   ASN   7           HA       ASN   7   9.169   3.270  -4.391
   42   1HB   ASN   7          1HB       ASN   7   9.795   3.932  -7.312
   43   2HB   ASN   7          2HB       ASN   7  11.105   3.886  -6.147
   44   1HD2  ASN   7          2HD2      ASN   7  10.900   1.954  -4.560
   45   2HD2  ASN   7          1HD2      ASN   7  10.672   0.375  -5.238
   46    H    ASP   8           HN       ASP   8  11.230   4.851  -4.203
   47    HA   ASP   8           HA       ASP   8  10.618   6.768  -2.492
   48   1HB   ASP   8          2HB       ASP   8  12.914   5.978  -3.264
   49   2HB   ASP   8          1HB       ASP   8  12.868   7.221  -4.508
   50    H    ASP   9           HN       ASP   9  11.165   7.632  -5.876
   51    HA   ASP   9           HA       ASP   9  10.444  10.389  -5.655
   52   1HB   ASP   9          1HB       ASP   9  11.709   9.557  -7.550
   53   2HB   ASP   9          2HB       ASP   9  10.410   8.484  -8.049
   54    H    THR  10           H        THR  10   8.550   7.900  -7.366
   55    HA   THR  10           HA       THR  10   6.227   9.368  -7.747
   56    HB   THR  10           HB       THR  10   5.184   7.000  -7.920
   57    HG1  THR  10           HG1      THR  10   6.995   5.432  -8.089
   58   1HG2  THR  10          1HG2      THR  10   7.723   7.644  -9.498
   59   2HG2  THR  10          2HG2      THR  10   6.096   8.251  -9.853
   60   3HG2  THR  10          3HG2      THR  10   6.441   6.520  -9.994
   61    H    PHE  11           H        PHE  11   7.052   7.291  -5.016
   62    HA   PHE  11           HA       PHE  11   4.808   7.027  -3.527
   63   1HB   PHE  11          2HB       PHE  11   7.107   6.304  -2.972
   64   2HB   PHE  11          1HB       PHE  11   7.523   7.929  -2.490
   65    HD1  PHE  11           HD1      PHE  11   7.117   8.607  -0.251
   66    HD2  PHE  11           HD2      PHE  11   5.307   5.010  -1.774
   67    HE1  PHE  11           HE1      PHE  11   6.606   7.885   2.066
   68    HE2  PHE  11           HE2      PHE  11   4.780   4.298   0.538
   69    HZ   PHE  11           HZ       PHE  11   5.347   5.767   2.459
   70    H    LYS  12           HN       LYS  12   6.858   9.858  -3.545
   71    HA   LYS  12           HA       LYS  12   5.648  11.454  -1.549
   72   1HB   LYS  12          2HB       LYS  12   6.849  12.440  -4.175
   73   2HB   LYS  12          1HB       LYS  12   6.633  13.384  -2.709
   74   1HG   LYS  12          1HG       LYS  12   8.451  10.943  -2.987
   75   2HG   LYS  12          2HG       LYS  12   8.968  12.622  -3.066
   76   1HD   LYS  12          1HD       LYS  12   8.159  12.962  -0.721
   77   2HD   LYS  12          2HD       LYS  12   7.745  11.238  -0.631
   78   1HE   LYS  12          2HE       LYS  12  10.544  12.313  -1.209
   79   2HE   LYS  12          1HE       LYS  12   9.974  11.782   0.381
   80   1HZ   LYS  12          1HZ       LYS  12  11.190  10.081  -0.788
   81   2HZ   LYS  12          2HZ       LYS  12  10.091  10.067  -2.006
   82   3HZ   LYS  12          3HZ       LYS  12   9.640   9.608  -0.492
   83    H    ASN  13           H        ASN  13   4.909  11.320  -5.013
   84    HA   ASN  13           HA       ASN  13   2.724  13.273  -4.835
   85   1HB   ASN  13          2HB       ASN  13   3.951  11.520  -7.007
   86   2HB   ASN  13          1HB       ASN  13   2.441  12.355  -7.291
   87   1HD2  ASN  13          2HD2      ASN  13   2.669  14.896  -6.464
   88   2HD2  ASN  13          1HD2      ASN  13   4.172  15.640  -6.990
   89    H    VAL  14           H        VAL  14   3.052   9.876  -5.705
   90    HA   VAL  14           HA       VAL  14   0.253   9.473  -6.175
   91    HB   VAL  14           HB       VAL  14   2.640   7.577  -5.975
   92   1HG1  VAL  14          1HG1      VAL  14   2.958   9.292  -7.758
   93   2HG1  VAL  14          2HG1      VAL  14   2.622   7.713  -8.464
   94   3HG1  VAL  14          3HG1      VAL  14   1.339   8.934  -8.385
   95   1HG2  VAL  14          1HG2      VAL  14   0.571   6.316  -5.805
   96   2HG2  VAL  14          2HG2      VAL  14  -0.106   7.194  -7.204
   97   3HG2  VAL  14          3HG2      VAL  14   1.282   6.094  -7.414
   98    H    VAL  15           H        VAL  15   2.341   8.885  -3.347
   99    HA   VAL  15           HA       VAL  15   0.129   7.327  -2.065
  100    HB   VAL  15           HB       VAL  15   3.083   7.315  -1.379
  101   1HG1  VAL  15          1HG1      VAL  15   1.614   6.651   0.459
  102   2HG1  VAL  15          2HG1      VAL  15   2.486   5.266  -0.201
  103   3HG1  VAL  15          3HG1      VAL  15   0.770   5.496  -0.601
  104   1HG2  VAL  15          1HG2      VAL  15   1.496   5.360  -3.074
  105   2HG2  VAL  15          2HG2      VAL  15   2.760   6.438  -3.669
  106   3HG2  VAL  15          3HG2      VAL  15   3.171   5.164  -2.520
  107    H    LEU  16           H        LEU  16   2.743   9.726  -1.241
  108    HA   LEU  16           HA       LEU  16   1.512  10.184   1.358
  109   1HB   LEU  16          2HB       LEU  16   3.641  11.769  -0.145
  110   2HB   LEU  16          1HB       LEU  16   3.136  12.049   1.506
  111    HG   LEU  16           HG       LEU  16   4.535   9.593   0.360
  112   1HD1  LEU  16          1HD1      LEU  16   5.361  11.611   2.492
  113   2HD1  LEU  16          2HD1      LEU  16   5.878  11.670   0.798
  114   3HD1  LEU  16          3HD1      LEU  16   6.364  10.306   1.823
  115   1HD2  LEU  16          1HD2      LEU  16   3.069   8.688   2.021
  116   2HD2  LEU  16          2HD2      LEU  16   4.629   8.871   2.826
  117   3HD2  LEU  16          3HD2      LEU  16   3.354  10.058   3.128
  118    H    GLU  17           HN       GLU  17   2.097  12.622  -1.210
  119    HA   GLU  17           HA       GLU  17  -0.018  14.299  -0.080
  120   1HB   GLU  17          1HB       GLU  17   1.667  14.685  -2.589
  121   2HB   GLU  17          2HB       GLU  17   0.743  15.920  -1.721
  122   1HG   GLU  17          1HG       GLU  17   3.229  14.454  -0.714
  123   2HG   GLU  17          2HG       GLU  17   3.087  16.154  -1.153
  124    H    SER  18           H        SER  18  -1.249  11.998  -0.811
  125    HA   SER  18           HA       SER  18  -2.551  12.375  -3.427
  126   1HB   SER  18          1HB       SER  18  -3.020  10.254  -1.288
  127   2HB   SER  18          2HB       SER  18  -3.489  10.193  -2.999
  128    HG   SER  18           HG       SER  18  -1.541   9.204  -3.079
  129    H    SER  19           H        SER  19  -4.871  12.684  -3.611
  130    HA   SER  19           HA       SER  19  -6.085  14.340  -1.544
  131   1HB   SER  19          2HB       SER  19  -7.974  14.161  -3.324
  132   2HB   SER  19          1HB       SER  19  -6.460  14.948  -3.821
  133    HG   SER  19           HG       SER  19  -7.124  13.352  -5.351
  134    H    VAL  20           H        VAL  20  -6.871  11.389  -3.282
  135    HA   VAL  20           HA       VAL  20  -8.689  10.340  -1.245
  136    HB   VAL  20           HB       VAL  20  -8.649   8.288  -2.662
  137   1HG1  VAL  20          1HG1      VAL  20  -6.636   9.844  -4.377
  138   2HG1  VAL  20          2HG1      VAL  20  -7.541   8.461  -4.941
  139   3HG1  VAL  20          3HG1      VAL  20  -6.415   8.268  -3.593
  140   1HG2  VAL  20          1HG2      VAL  20  -9.801   9.205  -4.597
  141   2HG2  VAL  20          2HG2      VAL  20  -9.147  10.822  -4.265
  142   3HG2  VAL  20          3HG2      VAL  20 -10.283  10.059  -3.124
  143    HA   PRO  21           HA       PRO  21  -5.414   8.356   1.015
  144   1HB   PRO  21          1HB       PRO  21  -6.655   6.238   2.262
  145   2HB   PRO  21          2HB       PRO  21  -6.943   7.939   2.729
  146   1HG   PRO  21          1HG       PRO  21  -8.594   6.161   0.928
  147   2HG   PRO  21          2HG       PRO  21  -9.142   7.249   2.229
  148   1HD   PRO  21          1HD       PRO  21  -9.168   7.897  -0.477
  149   2HD   PRO  21          2HD       PRO  21  -8.992   9.141   0.783
  150    H    VAL  22           H        VAL  22  -4.238   6.279   1.151
  151    HA   VAL  22           HA       VAL  22  -4.876   4.362  -0.891
  152    HB   VAL  22           HB       VAL  22  -2.205   4.952  -1.643
  153   1HG1  VAL  22          1HG2      VAL  22  -3.368   5.593  -3.792
  154   2HG1  VAL  22          2HG2      VAL  22  -4.910   5.626  -2.937
  155   3HG1  VAL  22          3HG2      VAL  22  -4.016   4.102  -3.088
  156   1HG2  VAL  22          1HG1      VAL  22  -2.178   7.216  -2.348
  157   2HG2  VAL  22          2HG1      VAL  22  -3.759   7.552  -1.656
  158   3HG2  VAL  22          3HG1      VAL  22  -2.380   7.174  -0.591
  159    H    LEU  23           H        LEU  23  -4.146   2.319  -0.693
  160    HA   LEU  23           HA       LEU  23  -2.685   1.665   1.761
  161   1HB   LEU  23          2HB       LEU  23  -4.932   0.720   1.050
  162   2HB   LEU  23          1HB       LEU  23  -4.105  -0.091  -0.257
  163    HG   LEU  23           HG       LEU  23  -2.885  -0.620   2.357
  164   1HD1  LEU  23          1HD1      LEU  23  -3.863  -2.268  -0.046
  165   2HD1  LEU  23          2HD1      LEU  23  -3.089  -2.999   1.351
  166   3HD1  LEU  23          3HD1      LEU  23  -2.180  -1.861   0.341
  167   1HD2  LEU  23          1HD2      LEU  23  -5.303  -0.540   2.986
  168   2HD2  LEU  23          2HD2      LEU  23  -5.650  -1.727   1.713
  169   3HD2  LEU  23          3HD2      LEU  23  -4.611  -2.159   3.095
  170    H    VAL  24           H        VAL  24  -0.461   1.825   1.299
  171    HA   VAL  24           HA       VAL  24   0.487   0.677  -1.299
  172    HB   VAL  24           HB       VAL  24   1.360   2.801  -1.044
  173   1HG1  VAL  24          1HG2      VAL  24   2.022   2.028   1.804
  174   2HG1  VAL  24          2HG2      VAL  24   2.697   3.439   0.985
  175   3HG1  VAL  24          3HG2      VAL  24   0.943   3.315   1.215
  176   1HG2  VAL  24          1HG1      VAL  24   2.959   1.015  -1.752
  177   2HG2  VAL  24          2HG1      VAL  24   3.734   2.417  -0.992
  178   3HG2  VAL  24          3HG1      VAL  24   3.549   0.912  -0.075
  179    H    ASP  25           HN       ASP  25   1.246  -1.333  -1.313
  180    HA   ASP  25           HA       ASP  25   1.900  -2.678   1.277
  181   1HB   ASP  25          1HB       ASP  25   0.410  -3.953  -0.167
  182   2HB   ASP  25          2HB       ASP  25   1.533  -3.784  -1.526
  183    H    PHE  26           H        PHE  26   4.025  -2.714   1.858
  184    HA   PHE  26           HA       PHE  26   6.122  -1.868  -0.081
  185   1HB   PHE  26          2HB       PHE  26   6.179  -2.688   2.849
  186   2HB   PHE  26          1HB       PHE  26   7.603  -2.323   1.886
  187    HD1  PHE  26           HD1      PHE  26   8.513  -0.185   2.168
  188    HD2  PHE  26           HD2      PHE  26   4.232  -0.649   2.609
  189    HE1  PHE  26           HE1      PHE  26   8.328   2.115   3.021
  190    HE2  PHE  26           HE2      PHE  26   4.065   1.670   3.341
  191    HZ   PHE  26           HZ       PHE  26   6.099   3.011   3.748
  192    H    TRP  27           H        TRP  27   6.685  -3.402  -1.525
  193    HA   TRP  27           HA       TRP  27   6.557  -6.285  -0.690
  194   1HB   TRP  27          2HB       TRP  27   5.557  -6.882  -2.717
  195   2HB   TRP  27          1HB       TRP  27   4.620  -5.525  -2.134
  196    HD1  TRP  27           HD1      TRP  27   5.401  -3.106  -3.346
  197    HE1  TRP  27           HE1      TRP  27   6.345  -2.594  -5.709
  198    HE3  TRP  27           HE3      TRP  27   6.405  -7.885  -4.858
  199    HZ2  TRP  27           HZ2      TRP  27   7.631  -4.097  -7.824
  200    HZ3  TRP  27           HZ3      TRP  27   7.259  -8.306  -7.130
  201    HH2  TRP  27           HH2      TRP  27   7.914  -6.427  -8.605
  202    H    ALA  28           H        ALA  28   7.529  -7.511  -2.759
  203    HA   ALA  28           HA       ALA  28   9.571  -6.290  -4.257
  204   1HB   ALA  28          1HB       ALA  28  11.534  -7.517  -3.336
  205   2HB   ALA  28          2HB       ALA  28  10.544  -8.071  -1.972
  206   3HB   ALA  28          3HB       ALA  28  10.917  -6.339  -2.170
  207    HA   PRO  29           HA       PRO  29   8.450 -10.039  -6.452
  208   1HB   PRO  29          1HB       PRO  29  10.881 -10.842  -7.582
  209   2HB   PRO  29          2HB       PRO  29   9.750  -9.608  -8.230
  210   1HG   PRO  29          1HG       PRO  29  12.215  -9.144  -6.521
  211   2HG   PRO  29          2HG       PRO  29  11.735  -8.285  -8.016
  212   1HD   PRO  29          2HD       PRO  29  11.157  -7.123  -5.666
  213   2HD   PRO  29          1HD       PRO  29   9.901  -7.223  -6.887
  214    H    TRP  30           H        TRP  30  11.431 -10.288  -4.469
  215    HA   TRP  30           HA       TRP  30  11.152 -13.148  -4.084
  216   1HB   TRP  30          1HB       TRP  30  12.904 -12.773  -2.362
  217   2HB   TRP  30          2HB       TRP  30  13.310 -12.169  -3.960
  218    HD1  TRP  30           HD1      TRP  30  14.111  -9.764  -4.136
  219    HE1  TRP  30           HE1      TRP  30  14.397  -7.772  -2.514
  220    HE3  TRP  30           HE3      TRP  30  11.674 -11.649  -0.030
  221    HZ2  TRP  30           HZ2      TRP  30  13.617  -7.071   0.138
  222    HZ3  TRP  30           HZ3      TRP  30  11.428 -10.274   2.003
  223    HH2  TRP  30           HH2      TRP  30  12.371  -7.983   2.096
  224    H    CYS  31           H        CYS  31   9.311 -10.545  -2.802
  225    HA   CYS  31           HA       CYS  31   9.087 -11.567  -0.070
  226   1HB   CYS  31          1HB       CYS  31   8.754  -9.164  -0.554
  227   2HB   CYS  31          2HB       CYS  31   7.389  -9.574  -1.574
  228    H    GLY  32           H        GLY  32   8.565 -13.778  -0.590
  229   1HA   GLY  32          2HA       GLY  32   6.697 -15.088  -1.851
  230   2HA   GLY  32          1HA       GLY  32   6.865 -15.374  -0.120
  231    HA   PRO  33           HA       PRO  33   2.753 -14.220   0.728
  232   1HB   PRO  33          1HB       PRO  33   2.631 -12.170   2.526
  233   2HB   PRO  33          2HB       PRO  33   3.135 -13.835   2.937
  234   1HG   PRO  33          2HG       PRO  33   4.899 -11.514   2.194
  235   2HG   PRO  33          1HG       PRO  33   5.049 -12.549   3.649
  236   1HD   PRO  33          2HD       PRO  33   6.568 -13.010   1.482
  237   2HD   PRO  33          1HD       PRO  33   5.786 -14.391   2.292
  238    H    CYS  34           H        CYS  34   4.680 -11.270   0.101
  239    HA   CYS  34           HA       CYS  34   2.598  -9.529  -0.706
  240   1HB   CYS  34          1HB       CYS  34   5.245  -9.478  -2.024
  241   2HB   CYS  34          2HB       CYS  34   4.081  -8.229  -1.708
  242    H    ARG  35           HN       ARG  35   4.711 -11.815  -2.447
  243    HA   ARG  35           HA       ARG  35   3.952 -11.311  -5.101
  244   1HB   ARG  35          2HB       ARG  35   5.898 -12.718  -4.082
  245   2HB   ARG  35          1HB       ARG  35   4.750 -14.056  -4.062
  246   1HG   ARG  35          1HG       ARG  35   4.385 -13.709  -6.532
  247   2HG   ARG  35          2HG       ARG  35   5.636 -12.450  -6.497
  248   1HD   ARG  35          2HD       ARG  35   7.275 -14.157  -5.630
  249   2HD   ARG  35          1HD       ARG  35   6.007 -15.376  -5.725
  250    HE   ARG  35           HE       ARG  35   6.125 -15.450  -8.018
  251   1HH1  ARG  35          1HH1      ARG  35   8.277 -12.864  -6.836
  252   2HH1  ARG  35          2HH1      ARG  35   8.975 -12.582  -8.405
  253   1HH2  ARG  35          1HH2      ARG  35   7.084 -15.090 -10.029
  254   2HH2  ARG  35          2HH2      ARG  35   8.318 -13.878 -10.234
  255    H    ILE  36           H        ILE  36   2.746 -13.813  -2.826
  256    HA   ILE  36           HA       ILE  36   0.797 -14.753  -4.754
  257    HB   ILE  36           HB       ILE  36  -0.194 -16.032  -2.926
  258   1HG1  ILE  36          1HG1      ILE  36   1.956 -14.897  -1.129
  259   2HG1  ILE  36          2HG1      ILE  36   0.290 -14.272  -1.113
  260   1HG2  ILE  36          1HG2      ILE  36   1.802 -16.797  -4.228
  261   2HG2  ILE  36          2HG2      ILE  36   1.790 -17.461  -2.589
  262   3HG2  ILE  36          3HG2      ILE  36   2.869 -16.113  -2.992
  263   1HD1  ILE  36          1HD1      ILE  36  -0.575 -16.479  -0.555
  264   2HD1  ILE  36          2HD1      ILE  36   1.097 -17.098  -0.437
  265   3HD1  ILE  36          3HD1      ILE  36   0.535 -15.822   0.667
  266    H    ILE  37           H        ILE  37   0.470 -12.316  -2.076
  267    HA   ILE  37           HA       ILE  37  -2.355 -11.988  -2.770
  268    HB   ILE  37           HB       ILE  37  -2.416 -10.091  -1.326
  269   1HG1  ILE  37          1HG1      ILE  37   0.588 -10.318  -1.064
  270   2HG1  ILE  37          2HG1      ILE  37  -0.261  -9.023  -1.904
  271   1HG2  ILE  37          1HG2      ILE  37  -0.689 -12.245  -0.030
  272   2HG2  ILE  37          2HG2      ILE  37  -1.923 -11.231   0.739
  273   3HG2  ILE  37          3HG2      ILE  37  -2.402 -12.455  -0.435
  274   1HD1  ILE  37          1HD1      ILE  37  -0.350  -9.610   1.075
  275   2HD1  ILE  37          2HD1      ILE  37   0.365  -8.214   0.256
  276   3HD1  ILE  37          3HD1      ILE  37  -1.398  -8.427   0.251
  277    H    ALA  38           H        ALA  38   0.615 -10.539  -4.070
  278    HA   ALA  38           HA       ALA  38  -0.054  -8.200  -5.105
  279   1HB   ALA  38          1HB       ALA  38   1.243 -10.395  -6.775
  280   2HB   ALA  38          2HB       ALA  38   2.067  -9.370  -5.579
  281   3HB   ALA  38          3HB       ALA  38   1.373  -8.657  -7.041
  282    HA   PRO  39           HA       PRO  39  -2.512  -9.761  -8.955
  283   1HB   PRO  39          1HB       PRO  39  -3.868 -12.247  -8.030
  284   2HB   PRO  39          2HB       PRO  39  -3.031 -11.944  -9.574
  285   1HG   PRO  39          1HG       PRO  39  -1.929 -13.574  -7.664
  286   2HG   PRO  39          2HG       PRO  39  -0.901 -12.443  -8.602
  287   1HD   PRO  39          2HD       PRO  39  -2.175 -11.953  -5.897
  288   2HD   PRO  39          1HD       PRO  39  -0.487 -11.825  -6.249
  289    H    VAL  40           H        VAL  40  -3.594 -10.572  -5.697
  290    HA   VAL  40           HA       VAL  40  -6.380  -9.763  -6.001
  291    HB   VAL  40           HB       VAL  40  -4.846 -11.408  -4.284
  292   1HG1  VAL  40          1HG1      VAL  40  -5.138 -10.718  -2.095
  293   2HG1  VAL  40          2HG1      VAL  40  -5.942  -9.201  -2.600
  294   3HG1  VAL  40          3HG1      VAL  40  -4.226  -9.458  -2.900
  295   1HG2  VAL  40          1HG2      VAL  40  -7.026 -11.874  -3.225
  296   2HG2  VAL  40          2HG2      VAL  40  -7.715 -10.415  -3.971
  297   3HG2  VAL  40          3HG2      VAL  40  -7.194 -11.777  -4.987
  298    H    VAL  41           H        VAL  41  -3.320  -8.391  -4.811
  299    HA   VAL  41           HA       VAL  41  -4.427  -5.917  -3.888
  300    HB   VAL  41           HB       VAL  41  -1.684  -6.454  -5.128
  301   1HG1  VAL  41          1HG1      VAL  41  -2.418  -6.350  -2.176
  302   2HG1  VAL  41          2HG1      VAL  41  -2.165  -7.847  -3.068
  303   3HG1  VAL  41          3HG1      VAL  41  -0.834  -6.706  -2.881
  304   1HG2  VAL  41          1HG2      VAL  41  -2.559  -4.154  -3.353
  305   2HG2  VAL  41          2HG2      VAL  41  -0.908  -4.493  -3.864
  306   3HG2  VAL  41          3HG2      VAL  41  -2.108  -4.051  -5.078
  307    H    ASP  42           HN       ASP  42  -3.095  -6.906  -7.071
  308    HA   ASP  42           HA       ASP  42  -3.653  -4.523  -8.467
  309   1HB   ASP  42          1HB       ASP  42  -3.673  -7.357  -9.583
  310   2HB   ASP  42          2HB       ASP  42  -3.547  -5.845 -10.499
  311    H    GLU  43           HN       GLU  43  -5.754  -7.507  -8.319
  312    HA   GLU  43           HA       GLU  43  -7.727  -6.377  -9.977
  313   1HB   GLU  43          1HB       GLU  43  -9.015  -8.188  -9.527
  314   2HB   GLU  43          2HB       GLU  43  -7.404  -8.814  -9.191
  315   1HG   GLU  43          2HG       GLU  43  -7.943  -8.290  -6.696
  316   2HG   GLU  43          1HG       GLU  43  -9.602  -8.021  -7.224
  317    H    ILE  44           H        ILE  44  -7.384  -6.185  -6.404
  318    HA   ILE  44           HA       ILE  44  -9.834  -4.709  -6.012
  319    HB   ILE  44           HB       ILE  44  -7.307  -5.228  -4.457
  320   1HG1  ILE  44          2HG1      ILE  44  -9.584  -6.527  -4.603
  321   2HG1  ILE  44          1HG1      ILE  44  -8.775  -6.351  -3.039
  322   1HG2  ILE  44          1HG2      ILE  44  -7.425  -2.891  -4.008
  323   2HG2  ILE  44          2HG2      ILE  44  -9.185  -2.950  -3.786
  324   3HG2  ILE  44          3HG2      ILE  44  -8.110  -3.725  -2.612
  325   1HD1  ILE  44          1HD1      ILE  44 -10.346  -4.561  -2.441
  326   2HD1  ILE  44          2HD1      ILE  44 -11.092  -4.633  -4.053
  327   3HD1  ILE  44          3HD1      ILE  44 -11.227  -6.008  -2.943
  328    H    ALA  45           H        ALA  45  -6.464  -3.709  -6.756
  329    HA   ALA  45           HA       ALA  45  -7.001  -0.917  -6.720
  330   1HB   ALA  45          1HB       ALA  45  -4.984  -0.670  -7.725
  331   2HB   ALA  45          2HB       ALA  45  -4.767  -2.296  -7.070
  332   3HB   ALA  45          3HB       ALA  45  -5.142  -2.096  -8.787
  333    H    GLY  46           H        GLY  46  -7.496  -3.395  -9.255
  334   1HA   GLY  46          2HA       GLY  46  -8.321  -1.693 -11.371
  335   2HA   GLY  46          1HA       GLY  46  -8.809  -3.384 -11.130
  336    H    GLU  47           HN       GLU  47 -10.270  -3.461  -8.871
  337    HA   GLU  47           HA       GLU  47 -12.797  -2.525  -9.544
  338   1HB   GLU  47          1HB       GLU  47 -11.556  -3.224  -6.854
  339   2HB   GLU  47          2HB       GLU  47 -13.253  -2.840  -7.037
  340   1HG   GLU  47          2HG       GLU  47 -11.883  -5.058  -8.627
  341   2HG   GLU  47          1HG       GLU  47 -12.678  -5.309  -7.074
  342    H    TYR  48           H        TYR  48 -10.554  -0.983  -7.220
  343    HA   TYR  48           HA       TYR  48 -12.320   1.450  -7.386
  344   1HB   TYR  48          2HB       TYR  48 -10.123   1.170  -5.345
  345   2HB   TYR  48          1HB       TYR  48 -11.545   2.202  -5.454
  346    HD1  TYR  48           HD1      TYR  48 -10.325  -1.167  -4.637
  347    HD2  TYR  48           HD2      TYR  48 -13.664   1.535  -4.555
  348    HE1  TYR  48           HE1      TYR  48 -11.305  -2.439  -2.741
  349    HE2  TYR  48           HE2      TYR  48 -14.565   0.355  -2.568
  350    HH   TYR  48           HH       TYR  48 -13.995  -1.134  -0.827
  351    H    LYS  49           HN       LYS  49 -10.336   0.758  -9.515
  352    HA   LYS  49           HA       LYS  49  -8.040   2.274  -9.400
  353   1HB   LYS  49          2HB       LYS  49  -8.212   2.420 -11.892
  354   2HB   LYS  49          1HB       LYS  49  -8.645   0.837 -11.235
  355   1HG   LYS  49          2HG       LYS  49 -11.079   1.480 -11.422
  356   2HG   LYS  49          1HG       LYS  49 -10.568   2.883 -12.385
  357   1HD   LYS  49          1HD       LYS  49  -9.594   1.475 -14.074
  358   2HD   LYS  49          2HD       LYS  49  -9.734   0.030 -13.061
  359   1HE   LYS  49          1HE       LYS  49 -12.110   1.594 -14.161
  360   2HE   LYS  49          2HE       LYS  49 -11.461   0.079 -14.812
  361   1HZ   LYS  49          1HZ       LYS  49 -13.254  -0.444 -13.427
  362   2HZ   LYS  49          2HZ       LYS  49 -11.888  -0.899 -12.613
  363   3HZ   LYS  49          3HZ       LYS  49 -12.686   0.463 -12.177
  364    H    ASP  50           HN       ASP  50 -11.184   3.242 -10.243
  365    HA   ASP  50           HA       ASP  50 -11.333   5.805 -10.953
  366   1HB   ASP  50          2HB       ASP  50 -13.472   5.867  -9.990
  367   2HB   ASP  50          1HB       ASP  50 -13.165   4.128 -10.221
  368    H    LYS  51           HN       LYS  51 -11.020   4.878  -7.567
  369    HA   LYS  51           HA       LYS  51  -9.843   7.518  -6.825
  370   1HB   LYS  51          2HB       LYS  51 -12.311   6.037  -5.830
  371   2HB   LYS  51          1HB       LYS  51 -11.489   7.228  -4.856
  372   1HG   LYS  51          1HG       LYS  51 -11.869   8.877  -6.819
  373   2HG   LYS  51          2HG       LYS  51 -12.953   7.649  -7.489
  374   1HD   LYS  51          1HD       LYS  51 -13.198   9.069  -4.798
  375   2HD   LYS  51          2HD       LYS  51 -14.255   9.245  -6.207
  376   1HE   LYS  51          2HE       LYS  51 -14.917   6.814  -5.946
  377   2HE   LYS  51          1HE       LYS  51 -13.963   6.742  -4.457
  378   1HZ   LYS  51          1HZ       LYS  51 -15.337   8.466  -3.560
  379   2HZ   LYS  51          2HZ       LYS  51 -16.240   7.165  -4.016
  380   3HZ   LYS  51          3HZ       LYS  51 -16.234   8.527  -4.943
  381    H    LEU  52           H        LEU  52 -10.773   4.287  -5.617
  382    HA   LEU  52           HA       LEU  52  -9.491   5.198  -3.118
  383   1HB   LEU  52          1HB       LEU  52 -11.748   4.191  -3.144
  384   2HB   LEU  52          2HB       LEU  52 -11.007   2.608  -3.512
  385    HG   LEU  52           HG       LEU  52 -10.053   2.500  -1.392
  386   1HD1  LEU  52          1HD1      LEU  52 -11.160   5.318  -0.985
  387   2HD1  LEU  52          2HD1      LEU  52  -9.453   4.897  -0.908
  388   3HD1  LEU  52          3HD1      LEU  52 -10.540   4.300   0.341
  389   1HD2  LEU  52          1HD2      LEU  52 -12.089   2.472  -0.011
  390   2HD2  LEU  52          2HD2      LEU  52 -12.934   3.422  -1.252
  391   3HD2  LEU  52          3HD2      LEU  52 -12.339   1.791  -1.619
  392    H    LYS  53           HN       LYS  53  -8.354   3.679  -1.732
  393    HA   LYS  53           HA       LYS  53  -6.022   3.731  -2.358
  394   1HB   LYS  53          2HB       LYS  53  -5.902   2.602   0.083
  395   2HB   LYS  53          1HB       LYS  53  -6.990   3.938  -0.116
  396   1HG   LYS  53          2HG       LYS  53  -7.611   1.878   1.250
  397   2HG   LYS  53          1HG       LYS  53  -8.814   2.684   0.295
  398   1HD   LYS  53          1HD       LYS  53  -8.355   0.795  -1.487
  399   2HD   LYS  53          2HD       LYS  53  -7.497  -0.018  -0.161
  400   1HE   LYS  53          2HE       LYS  53  -9.501  -0.231   1.128
  401   2HE   LYS  53          1HE       LYS  53 -10.420   0.778   0.007
  402   1HZ   LYS  53          1HZ       LYS  53 -10.000  -0.896  -1.654
  403   2HZ   LYS  53          2HZ       LYS  53  -9.209  -1.829  -0.550
  404   3HZ   LYS  53          3HZ       LYS  53 -10.816  -1.504  -0.359
  405    H    CYS  54           H        CYS  54  -4.978   2.394  -4.052
  406    HA   CYS  54           HA       CYS  54  -3.835   0.009  -2.695
  407   1HB   CYS  54          1HB       CYS  54  -5.886  -0.800  -3.885
  408   2HB   CYS  54          2HB       CYS  54  -5.176  -0.199  -5.406
  409    HG   CYS  54           HG       CYS  54  -4.861  -2.803  -5.096
  410    H    VAL  55           H        VAL  55  -1.664   0.167  -2.852
  411    HA   VAL  55           HA       VAL  55  -0.490   0.578  -5.511
  412    HB   VAL  55           HB       VAL  55   1.089   2.230  -3.793
  413   1HG1  VAL  55          1HG1      VAL  55  -1.776   3.238  -3.762
  414   2HG1  VAL  55          2HG1      VAL  55  -0.333   4.069  -3.187
  415   3HG1  VAL  55          3HG1      VAL  55  -0.891   2.625  -2.338
  416   1HG2  VAL  55          1HG2      VAL  55   0.520   3.943  -5.470
  417   2HG2  VAL  55          2HG2      VAL  55   0.900   2.388  -6.214
  418   3HG2  VAL  55          3HG2      VAL  55  -0.788   2.906  -6.088
  419    H    LYS  56           HN       LYS  56   2.014   0.321  -5.371
  420    HA   LYS  56           HA       LYS  56   2.736  -1.568  -3.185
  421   1HB   LYS  56          1HB       LYS  56   2.083  -2.116  -5.990
  422   2HB   LYS  56          2HB       LYS  56   3.711  -2.654  -5.608
  423   1HG   LYS  56          2HG       LYS  56   2.836  -3.871  -3.599
  424   2HG   LYS  56          1HG       LYS  56   1.196  -3.378  -4.042
  425   1HD   LYS  56          1HD       LYS  56   3.073  -5.127  -5.715
  426   2HD   LYS  56          2HD       LYS  56   1.723  -5.697  -4.719
  427   1HE   LYS  56          1HE       LYS  56   0.171  -4.254  -6.136
  428   2HE   LYS  56          2HE       LYS  56   1.540  -3.950  -7.220
  429   1HZ   LYS  56          1HZ       LYS  56   1.696  -6.308  -7.569
  430   2HZ   LYS  56          2HZ       LYS  56   0.206  -5.730  -7.979
  431   3HZ   LYS  56          3HZ       LYS  56   0.397  -6.573  -6.583
  432    H    LEU  57           H        LEU  57   4.624  -0.889  -2.286
  433    HA   LEU  57           HA       LEU  57   6.485   0.740  -3.957
  434   1HB   LEU  57          2HB       LEU  57   5.885   1.562  -1.652
  435   2HB   LEU  57          1HB       LEU  57   6.746   0.169  -1.030
  436    HG   LEU  57           HG       LEU  57   8.625   1.287  -2.739
  437   1HD1  LEU  57          1HD2      LEU  57   8.144   1.756   0.231
  438   2HD1  LEU  57          2HD2      LEU  57   9.036   0.387  -0.474
  439   3HD1  LEU  57          3HD2      LEU  57   9.680   2.035  -0.585
  440   1HD2  LEU  57          1HD1      LEU  57   7.196   3.503  -1.214
  441   2HD2  LEU  57          2HD1      LEU  57   7.153   3.316  -2.981
  442   3HD2  LEU  57          3HD1      LEU  57   8.684   3.678  -2.149
  443    H    ASN  58           H        ASN  58   8.131  -0.279  -5.010
  444    HA   ASN  58           HA       ASN  58   8.860  -3.019  -4.164
  445   1HB   ASN  58          1HB       ASN  58   8.948  -2.480  -6.539
  446   2HB   ASN  58          2HB       ASN  58  10.173  -1.251  -6.259
  447   1HD2  ASN  58          2HD2      ASN  58   9.858  -4.372  -7.302
  448   2HD2  ASN  58          1HD2      ASN  58  11.426  -4.986  -6.804
  449    H    THR  59           H        THR  59   9.829  -3.291  -2.386
  450    HA   THR  59           HA       THR  59  11.009  -1.256  -0.797
  451    HB   THR  59           HB       THR  59  11.112  -4.305  -0.667
  452    HG1  THR  59           HG1      THR  59   9.038  -3.588  -0.608
  453   1HG2  THR  59          1HG2      THR  59  12.835  -3.401   0.762
  454   2HG2  THR  59          2HG2      THR  59  11.696  -2.212   1.444
  455   3HG2  THR  59          3HG2      THR  59  11.478  -3.960   1.747
  456    H    ASP  60           HN       ASP  60  12.381  -3.704  -2.968
  457    HA   ASP  60           HA       ASP  60  15.123  -3.438  -2.038
  458   1HB   ASP  60          2HB       ASP  60  14.367  -5.465  -3.025
  459   2HB   ASP  60          1HB       ASP  60  13.696  -4.635  -4.409
  460    H    GLU  61           HN       GLU  61  13.084  -1.954  -4.510
  461    HA   GLU  61           HA       GLU  61  15.240  -0.242  -5.546
  462   1HB   GLU  61          2HB       GLU  61  13.603  -1.267  -7.005
  463   2HB   GLU  61          1HB       GLU  61  12.274  -0.475  -6.159
  464   1HG   GLU  61          2HG       GLU  61  13.060   1.734  -6.904
  465   2HG   GLU  61          1HG       GLU  61  14.497   0.991  -7.617
  466    H    SER  62           H        SER  62  12.875  -0.057  -2.961
  467    HA   SER  62           HA       SER  62  13.818   2.745  -2.437
  468   1HB   SER  62          1HB       SER  62  10.926   1.862  -2.458
  469   2HB   SER  62          2HB       SER  62  11.596   3.341  -1.726
  470    HG   SER  62           HG       SER  62  12.705   3.015  -4.151
  471    HA   PRO  63           HA       PRO  63  14.248   0.098   1.353
  472   1HB   PRO  63          1HB       PRO  63  16.951   0.434   1.668
  473   2HB   PRO  63          2HB       PRO  63  16.242  -0.872   0.667
  474   1HG   PRO  63          1HG       PRO  63  17.316   1.807  -0.261
  475   2HG   PRO  63          2HG       PRO  63  17.652   0.191  -0.947
  476   1HD   PRO  63          1HD       PRO  63  15.772   1.803  -2.054
  477   2HD   PRO  63          2HD       PRO  63  15.481   0.063  -1.916
  478    H    ASN  64           H        ASN  64  15.362   3.157   0.080
  479    HA   ASN  64           HA       ASN  64  16.041   4.730   2.252
  480   1HB   ASN  64          2HB       ASN  64  14.388   5.307  -0.246
  481   2HB   ASN  64          1HB       ASN  64  14.742   6.555   0.946
  482   1HD2  ASN  64          1HD2      ASN  64  15.567   7.245  -1.382
  483   2HD2  ASN  64          2HD2      ASN  64  17.302   6.989  -1.618
  484    H    VAL  65           H        VAL  65  12.780   4.756   0.894
  485    HA   VAL  65           HA       VAL  65  11.425   6.070   2.939
  486    HB   VAL  65           HB       VAL  65  10.487   3.945   0.947
  487   1HG1  VAL  65          1HG2      VAL  65   8.266   4.925   1.189
  488   2HG1  VAL  65          2HG2      VAL  65   8.820   4.279   2.735
  489   3HG1  VAL  65          3HG2      VAL  65   8.878   6.032   2.449
  490   1HG2  VAL  65          1HG1      VAL  65  10.580   6.993   0.792
  491   2HG2  VAL  65          2HG1      VAL  65   9.773   5.935  -0.385
  492   3HG2  VAL  65          3HG1      VAL  65  11.528   5.866  -0.196
  493    H    ALA  66           H        ALA  66  11.805   2.632   2.351
  494    HA   ALA  66           HA       ALA  66  10.367   1.593   4.554
  495   1HB   ALA  66          1HB       ALA  66  11.670  -0.463   4.243
  496   2HB   ALA  66          2HB       ALA  66  11.225   0.218   2.667
  497   3HB   ALA  66          3HB       ALA  66  12.877   0.405   3.288
  498    H    SER  67           H        SER  67  13.821   2.584   4.398
  499    HA   SER  67           HA       SER  67  14.407   1.879   7.127
  500   1HB   SER  67          2HB       SER  67  15.844   3.819   5.257
  501   2HB   SER  67          1HB       SER  67  16.477   3.133   6.764
  502    HG   SER  67           HG       SER  67  15.732   1.711   4.418
  503    H    GLU  68           HN       GLU  68  13.436   4.890   5.502
  504    HA   GLU  68           HA       GLU  68  13.701   6.678   7.698
  505   1HB   GLU  68          1HB       GLU  68  11.745   6.638   5.360
  506   2HB   GLU  68          2HB       GLU  68  11.854   7.963   6.513
  507   1HG   GLU  68          1HG       GLU  68  14.090   8.507   5.874
  508   2HG   GLU  68          2HG       GLU  68  14.307   7.001   4.983
  509    H    TYR  69           H        TYR  69  10.969   4.562   6.732
  510    HA   TYR  69           HA       TYR  69   9.406   5.287   9.105
  511   1HB   TYR  69          2HB       TYR  69   9.176   3.175   6.934
  512   2HB   TYR  69          1HB       TYR  69   8.128   3.164   8.339
  513    HD1  TYR  69           HD1      TYR  69   8.355   4.314   5.027
  514    HD2  TYR  69           HD2      TYR  69   6.969   5.522   8.921
  515    HE1  TYR  69           HE1      TYR  69   7.133   6.224   4.010
  516    HE2  TYR  69           HE2      TYR  69   5.734   7.410   7.901
  517    HH   TYR  69           HH       TYR  69   5.533   8.710   5.978
  518    H    GLY  70           H        GLY  70  11.652   2.690   8.249
  519   1HA   GLY  70          1HA       GLY  70  13.035   1.590   9.817
  520   2HA   GLY  70          2HA       GLY  70  11.909   1.963  11.129
  521    H    ILE  71           H        ILE  71  11.153   0.625   7.911
  522    HA   ILE  71           HA       ILE  71   9.619  -1.574   9.063
  523    HB   ILE  71           HB       ILE  71  10.375  -0.842   6.206
  524   1HG1  ILE  71          2HG1      ILE  71   7.815  -0.460   7.846
  525   2HG1  ILE  71          1HG1      ILE  71   8.950   0.813   7.387
  526   1HG2  ILE  71          1HG2      ILE  71   9.904  -3.265   6.408
  527   2HG2  ILE  71          2HG2      ILE  71   8.605  -2.457   5.548
  528   3HG2  ILE  71          3HG2      ILE  71   8.383  -2.904   7.253
  529   1HD1  ILE  71          1HD1      ILE  71   7.191   0.991   5.844
  530   2HD1  ILE  71          2HD1      ILE  71   7.151  -0.749   5.519
  531   3HD1  ILE  71          3HD1      ILE  71   8.538   0.221   4.980
  532    H    ARG  72           HN       ARG  72  10.807  -3.085  10.070
  533    HA   ARG  72           HA       ARG  72  13.519  -3.721   9.358
  534   1HB   ARG  72          2HB       ARG  72  12.608  -3.785  11.640
  535   2HB   ARG  72          1HB       ARG  72  11.521  -5.112  11.197
  536   1HG   ARG  72          2HG       ARG  72  13.421  -6.600  10.767
  537   2HG   ARG  72          1HG       ARG  72  14.568  -5.280  11.071
  538   1HD   ARG  72          2HD       ARG  72  12.581  -6.423  13.084
  539   2HD   ARG  72          1HD       ARG  72  14.309  -6.830  12.997
  540    HE   ARG  72           HE       ARG  72  14.164  -4.037  13.187
  541   1HH1  ARG  72          1HH1      ARG  72  13.347  -6.844  15.160
  542   2HH1  ARG  72          2HH1      ARG  72  13.558  -6.024  16.683
  543   1HH2  ARG  72          1HH2      ARG  72  14.442  -2.938  15.165
  544   2HH2  ARG  72          2HH2      ARG  72  14.200  -3.758  16.682
  545    H    SER  73           H        SER  73  10.379  -5.093   8.401
  546    HA   SER  73           HA       SER  73  11.691  -6.782   6.457
  547   1HB   SER  73          2HB       SER  73   9.881  -8.103   8.531
  548   2HB   SER  73          1HB       SER  73  10.735  -8.887   7.194
  549    HG   SER  73           HG       SER  73  12.649  -7.755   8.442
  550    H    ILE  74           H        ILE  74   9.953  -7.732   5.025
  551    HA   ILE  74           HA       ILE  74   7.503  -6.066   5.031
  552    HB   ILE  74           HB       ILE  74   7.617  -6.290   2.518
  553   1HG1  ILE  74          1HG1      ILE  74  10.556  -6.849   2.837
  554   2HG1  ILE  74          2HG1      ILE  74   9.376  -8.146   2.557
  555   1HG2  ILE  74          1HG2      ILE  74   9.081  -4.342   2.312
  556   2HG2  ILE  74          2HG2      ILE  74   8.165  -4.223   3.809
  557   3HG2  ILE  74          3HG2      ILE  74   9.869  -4.719   3.854
  558   1HD1  ILE  74          1HD1      ILE  74   9.838  -5.770   0.726
  559   2HD1  ILE  74          2HD1      ILE  74   8.553  -6.977   0.527
  560   3HD1  ILE  74          3HD1      ILE  74  10.249  -7.456   0.406
  561    HA   PRO  75           HA       PRO  75   5.548  -6.582   3.094
  562   1HB   PRO  75          1HB       PRO  75   3.014  -7.275   3.826
  563   2HB   PRO  75          2HB       PRO  75   3.884  -8.022   2.477
  564   1HG   PRO  75          1HG       PRO  75   3.670  -9.090   5.306
  565   2HG   PRO  75          2HG       PRO  75   3.386  -9.976   3.774
  566   1HD   PRO  75          2HD       PRO  75   5.755 -10.164   5.064
  567   2HD   PRO  75          1HD       PRO  75   5.772  -9.971   3.306
  568    H    THR  76           H        THR  76   4.244  -4.864   3.760
  569    HA   THR  76           HA       THR  76   3.410  -4.364   6.449
  570    HB   THR  76           HB       THR  76   5.841  -2.881   5.346
  571    HG1  THR  76           HG1      THR  76   5.908  -4.825   6.846
  572   1HG2  THR  76          1HG2      THR  76   3.945  -2.093   7.608
  573   2HG2  THR  76          2HG2      THR  76   4.287  -1.162   6.128
  574   3HG2  THR  76          3HG2      THR  76   5.549  -1.385   7.351
  575    H    ILE  77           H        ILE  77   1.549  -3.258   6.067
  576    HA   ILE  77           HA       ILE  77   1.104  -2.068   3.364
  577    HB   ILE  77           HB       ILE  77  -0.680  -3.665   5.245
  578   1HG1  ILE  77          2HG1      ILE  77   0.312  -4.174   2.397
  579   2HG1  ILE  77          1HG1      ILE  77   0.983  -4.925   3.845
  580   1HG2  ILE  77          1HG2      ILE  77  -2.418  -3.376   3.507
  581   2HG2  ILE  77          2HG2      ILE  77  -1.310  -2.272   2.637
  582   3HG2  ILE  77          3HG2      ILE  77  -1.984  -1.834   4.226
  583   1HD1  ILE  77          1HD1      ILE  77  -1.313  -5.896   4.315
  584   2HD1  ILE  77          2HD1      ILE  77  -0.469  -6.520   2.881
  585   3HD1  ILE  77          3HD1      ILE  77  -1.778  -5.353   2.680
  586    H    MET  78           H        MET  78   1.172   0.102   3.574
  587    HA   MET  78           HA       MET  78   0.152   1.350   6.121
  588   1HB   MET  78          1HB       MET  78   2.057   2.413   4.030
  589   2HB   MET  78          2HB       MET  78   1.404   3.350   5.382
  590   1HG   MET  78          1HG       MET  78   2.393   1.754   6.972
  591   2HG   MET  78          2HG       MET  78   3.113   0.858   5.634
  592   1HE   MET  78          1HE       MET  78   5.213   1.113   7.341
  593   2HE   MET  78          2HE       MET  78   5.962   2.675   7.734
  594   3HE   MET  78          3HE       MET  78   4.368   2.270   8.400
  595    H    VAL  79           H        VAL  79  -1.581   2.628   6.064
  596    HA   VAL  79           HA       VAL  79  -2.832   3.270   3.412
  597    HB   VAL  79           HB       VAL  79  -4.065   3.192   6.178
  598   1HG1  VAL  79          1HG1      VAL  79  -5.462   1.405   5.191
  599   2HG1  VAL  79          2HG1      VAL  79  -3.748   0.955   5.106
  600   3HG1  VAL  79          3HG1      VAL  79  -4.579   1.560   3.657
  601   1HG2  VAL  79          1HG2      VAL  79  -5.256   4.030   3.500
  602   2HG2  VAL  79          2HG2      VAL  79  -6.177   3.757   4.995
  603   3HG2  VAL  79          3HG2      VAL  79  -5.017   5.077   4.906
  604    H    PHE  80           H        PHE  80  -2.123   5.240   2.765
  605    HA   PHE  80           HA       PHE  80  -1.545   7.357   4.804
  606   1HB   PHE  80          1HB       PHE  80  -0.949   7.130   1.837
  607   2HB   PHE  80          2HB       PHE  80  -0.744   8.610   2.760
  608    HD1  PHE  80           HD1      PHE  80   0.459   5.116   2.417
  609    HD2  PHE  80           HD2      PHE  80   1.009   8.873   4.431
  610    HE1  PHE  80           HE1      PHE  80   2.727   4.392   3.163
  611    HE2  PHE  80           HE2      PHE  80   3.222   8.129   5.234
  612    HZ   PHE  80           HZ       PHE  80   4.077   5.851   4.620
  613    H    LYS  81           HN       LYS  81  -2.783   9.221   4.899
  614    HA   LYS  81           HA       LYS  81  -5.076   9.493   3.006
  615   1HB   LYS  81          2HB       LYS  81  -6.723   9.527   4.633
  616   2HB   LYS  81          1HB       LYS  81  -5.733   8.136   5.050
  617   1HG   LYS  81          2HG       LYS  81  -6.091  10.755   6.493
  618   2HG   LYS  81          1HG       LYS  81  -6.293   9.122   7.089
  619   1HD   LYS  81          1HD       LYS  81  -3.776   8.807   6.886
  620   2HD   LYS  81          2HD       LYS  81  -3.648  10.524   6.476
  621   1HE   LYS  81          2HE       LYS  81  -4.755   9.414   9.089
  622   2HE   LYS  81          1HE       LYS  81  -3.191  10.208   8.848
  623   1HZ   LYS  81          1HZ       LYS  81  -4.753  11.726   9.717
  624   2HZ   LYS  81          2HZ       LYS  81  -4.351  12.184   8.185
  625   3HZ   LYS  81          3HZ       LYS  81  -5.805  11.467   8.477
  626    H    GLY  82           H        GLY  82  -2.911  10.917   2.656
  627   1HA   GLY  82          2HA       GLY  82  -2.804  13.246   2.082
  628   2HA   GLY  82          1HA       GLY  82  -3.755  13.640   3.526
  629    H    GLY  83           H        GLY  83  -0.594  12.385   2.458
  630   1HA   GLY  83          2HA       GLY  83   1.508  12.799   3.256
  631   2HA   GLY  83          1HA       GLY  83   0.847  13.966   4.399
  632    H    LYS  84           HN       LYS  84  -0.624  12.693   6.094
  633    HA   LYS  84           HA       LYS  84   1.266  10.983   7.568
  634   1HB   LYS  84          1HB       LYS  84  -1.499  11.992   8.335
  635   2HB   LYS  84          2HB       LYS  84  -0.300  11.293   9.428
  636   1HG   LYS  84          2HG       LYS  84  -0.030  13.932   7.903
  637   2HG   LYS  84          1HG       LYS  84  -0.379  13.729   9.623
  638   1HD   LYS  84          1HD       LYS  84   1.844  12.557   9.891
  639   2HD   LYS  84          2HD       LYS  84   2.206  12.943   8.194
  640   1HE   LYS  84          1HE       LYS  84   1.948  15.364   8.684
  641   2HE   LYS  84          2HE       LYS  84   1.616  14.983  10.385
  642   1HZ   LYS  84          1HZ       LYS  84   3.886  15.581  10.037
  643   2HZ   LYS  84          2HZ       LYS  84   3.790  14.011  10.526
  644   3HZ   LYS  84          3HZ       LYS  84   4.099  14.365   8.946
  645    H    LYS  85           HN       LYS  85   0.466   9.107   8.737
  646    HA   LYS  85           HA       LYS  85  -0.863   7.219   6.898
  647   1HB   LYS  85          2HB       LYS  85   0.572   6.797   9.535
  648   2HB   LYS  85          1HB       LYS  85  -0.094   5.523   8.492
  649   1HG   LYS  85          2HG       LYS  85   1.386   6.355   6.636
  650   2HG   LYS  85          1HG       LYS  85   2.212   7.394   7.811
  651   1HD   LYS  85          2HD       LYS  85   2.047   4.355   7.689
  652   2HD   LYS  85          1HD       LYS  85   3.496   5.358   7.598
  653   1HE   LYS  85          1HE       LYS  85   1.727   4.878  10.045
  654   2HE   LYS  85          2HE       LYS  85   3.348   4.235   9.771
  655   1HZ   LYS  85          1HZ       LYS  85   4.197   6.465   9.798
  656   2HZ   LYS  85          2HZ       LYS  85   2.690   7.082  10.058
  657   3HZ   LYS  85          3HZ       LYS  85   3.400   6.132  11.202
  658    H    CYS  86           H        CYS  86  -2.535   5.953   7.566
  659    HA   CYS  86           HA       CYS  86  -4.283   6.942   9.797
  660   1HB   CYS  86          1HB       CYS  86  -5.230   7.113   7.479
  661   2HB   CYS  86          2HB       CYS  86  -5.037   5.385   7.273
  662    HG   CYS  86           HG       CYS  86  -6.320   5.050   9.799
  663    H    GLU  87           HN       GLU  87  -3.382   4.086   7.887
  664    HA   GLU  87           HA       GLU  87  -3.468   2.368  10.335
  665   1HB   GLU  87          1HB       GLU  87  -4.262   1.455   7.550
  666   2HB   GLU  87          2HB       GLU  87  -4.358   0.549   9.052
  667   1HG   GLU  87          1HG       GLU  87  -6.002   3.038   8.391
  668   2HG   GLU  87          2HG       GLU  87  -6.569   1.384   8.331
  669    H    THR  88           H        THR  88  -2.043   0.525  10.184
  670    HA   THR  88           HA       THR  88  -0.046   0.293   8.077
  671    HB   THR  88           HB       THR  88   0.727   1.100  10.905
  672    HG1  THR  88           HG1      THR  88   0.297   2.538   8.835
  673   1HG2  THR  88          1HG2      THR  88   3.082   0.819  10.097
  674   2HG2  THR  88          2HG2      THR  88   2.227  -0.724  10.217
  675   3HG2  THR  88          3HG2      THR  88   2.467   0.031   8.628
  676    H    ILE  89           H        ILE  89  -0.842  -1.700   7.697
  677    HA   ILE  89           HA       ILE  89  -1.345  -3.571   9.961
  678    HB   ILE  89           HB       ILE  89  -2.311  -3.813   7.085
  679   1HG1  ILE  89          2HG1      ILE  89  -3.748  -2.392   9.378
  680   2HG1  ILE  89          1HG1      ILE  89  -3.124  -1.623   7.908
  681   1HG2  ILE  89          1HG2      ILE  89  -2.418  -5.818   8.642
  682   2HG2  ILE  89          2HG2      ILE  89  -3.470  -4.874   9.708
  683   3HG2  ILE  89          3HG2      ILE  89  -3.988  -5.299   8.062
  684   1HD1  ILE  89          1HD1      ILE  89  -5.418  -3.581   8.021
  685   2HD1  ILE  89          2HD1      ILE  89  -4.635  -3.012   6.523
  686   3HD1  ILE  89          3HD1      ILE  89  -5.440  -1.861   7.607
  687    H    ILE  90           H        ILE  90  -0.451  -5.694   9.811
  688    HA   ILE  90           HA       ILE  90   2.032  -5.894   8.223
  689    HB   ILE  90           HB       ILE  90   0.710  -7.771  10.250
  690   1HG1  ILE  90          2HG1      ILE  90   2.805  -7.179  11.578
  691   2HG1  ILE  90          1HG1      ILE  90   3.091  -5.857  10.442
  692   1HG2  ILE  90          1HG2      ILE  90   3.400  -7.953   8.823
  693   2HG2  ILE  90          2HG2      ILE  90   2.910  -8.962  10.197
  694   3HG2  ILE  90          3HG2      ILE  90   2.040  -9.092   8.678
  695   1HD1  ILE  90          1HD1      ILE  90   1.124  -4.688  11.252
  696   2HD1  ILE  90          2HD1      ILE  90   0.535  -6.152  12.087
  697   3HD1  ILE  90          3HD1      ILE  90   1.978  -5.300  12.664
  698    H    GLY  91           H        GLY  91   2.270  -7.622   6.609
  699   1HA   GLY  91          1HA       GLY  91  -0.162  -8.027   5.040
  700   2HA   GLY  91          2HA       GLY  91   1.443  -8.632   4.662
  701    H    ALA  92           H        ALA  92   0.423 -10.631   4.049
  702    HA   ALA  92           HA       ALA  92  -0.303 -12.765   4.317
  703   1HB   ALA  92          1HB       ALA  92   0.516 -14.020   6.225
  704   2HB   ALA  92          2HB       ALA  92   1.780 -12.902   5.683
  705   3HB   ALA  92          3HB       ALA  92   0.835 -12.543   7.146
  706    H    VAL  93           H        VAL  93  -2.274 -10.985   4.441
  707    HA   VAL  93           HA       VAL  93  -4.226 -12.107   6.369
  708    HB   VAL  93           HB       VAL  93  -5.028  -9.522   5.449
  709   1HG1  VAL  93          1HG1      VAL  93  -3.504  -8.035   6.699
  710   2HG1  VAL  93          2HG1      VAL  93  -2.594  -8.873   5.438
  711   3HG1  VAL  93          3HG1      VAL  93  -2.480  -9.414   7.132
  712   1HG2  VAL  93          1HG2      VAL  93  -4.555 -10.449   8.246
  713   2HG2  VAL  93          2HG2      VAL  93  -5.471  -9.012   7.707
  714   3HG2  VAL  93          3HG2      VAL  93  -6.043 -10.625   7.285
  715    HA   PRO  94           HA       PRO  94  -6.222 -12.497   2.318
  716   1HB   PRO  94          2HB       PRO  94  -8.881 -12.186   3.542
  717   2HB   PRO  94          1HB       PRO  94  -8.235 -13.584   2.663
  718   1HG   PRO  94          2HG       PRO  94  -8.625 -13.651   5.418
  719   2HG   PRO  94          1HG       PRO  94  -7.214 -14.459   4.665
  720   1HD   PRO  94          1HD       PRO  94  -7.341 -11.668   5.832
  721   2HD   PRO  94          2HD       PRO  94  -6.159 -12.920   6.244
  722    H    LYS  95           HN       LYS  95  -6.900 -10.820   0.886
  723    HA   LYS  95           HA       LYS  95  -6.798  -8.209   2.059
  724   1HB   LYS  95          2HB       LYS  95  -5.927  -8.558  -0.173
  725   2HB   LYS  95          1HB       LYS  95  -7.510  -9.067  -0.793
  726   1HG   LYS  95          1HG       LYS  95  -8.357  -6.935  -0.836
  727   2HG   LYS  95          2HG       LYS  95  -7.398  -6.362   0.516
  728   1HD   LYS  95          1HD       LYS  95  -6.198  -6.832  -2.239
  729   2HD   LYS  95          2HD       LYS  95  -6.847  -5.303  -1.637
  730   1HE   LYS  95          2HE       LYS  95  -5.251  -5.644   0.414
  731   2HE   LYS  95          1HE       LYS  95  -4.396  -6.771  -0.650
  732   1HZ   LYS  95          1HZ       LYS  95  -4.182  -4.941  -2.211
  733   2HZ   LYS  95          2HZ       LYS  95  -4.990  -3.936  -1.190
  734   3HZ   LYS  95          3HZ       LYS  95  -3.528  -4.553  -0.753
  735    H    ALA  96           H        ALA  96  -9.442 -10.436   1.578
  736    HA   ALA  96           HA       ALA  96 -11.632  -8.624   1.443
  737   1HB   ALA  96          1HB       ALA  96 -11.393 -11.255   2.983
  738   2HB   ALA  96          2HB       ALA  96 -11.891 -11.073   1.286
  739   3HB   ALA  96          3HB       ALA  96 -12.907 -10.415   2.584
  740    H    THR  97           H        THR  97  -9.821  -9.903   4.284
  741    HA   THR  97           HA       THR  97 -11.144  -8.516   6.335
  742    HB   THR  97           HB       THR  97  -8.198  -9.304   6.111
  743    HG1  THR  97           HG1      THR  97 -10.490 -10.845   6.786
  744   1HG2  THR  97          1HG2      THR  97  -8.685  -8.083   8.182
  745   2HG2  THR  97          2HG2      THR  97 -10.038  -9.187   8.535
  746   3HG2  THR  97          3HG2      THR  97  -8.368  -9.796   8.504
  747    H    ILE  98           H        ILE  98  -8.299  -7.640   4.343
  748    HA   ILE  98           HA       ILE  98  -7.720  -5.160   5.617
  749    HB   ILE  98           HB       ILE  98  -7.169  -6.134   2.781
  750   1HG1  ILE  98          2HG1      ILE  98  -5.492  -6.110   5.335
  751   2HG1  ILE  98          1HG1      ILE  98  -6.186  -7.536   4.556
  752   1HG2  ILE  98          1HG2      ILE  98  -5.470  -4.358   2.686
  753   2HG2  ILE  98          2HG2      ILE  98  -5.947  -3.796   4.307
  754   3HG2  ILE  98          3HG2      ILE  98  -7.052  -3.643   2.924
  755   1HD1  ILE  98          1HD1      ILE  98  -4.793  -7.015   2.505
  756   2HD1  ILE  98          2HD1      ILE  98  -3.892  -7.481   3.957
  757   3HD1  ILE  98          3HD1      ILE  98  -3.963  -5.782   3.485
  758    H    VAL  99           H        VAL  99  -9.773  -5.873   2.720
  759    HA   VAL  99           HA       VAL  99 -10.539  -3.224   2.150
  760    HB   VAL  99           HB       VAL  99 -12.014  -5.874   1.794
  761   1HG1  VAL  99          1HG2      VAL  99 -13.753  -4.152   1.833
  762   2HG1  VAL  99          2HG2      VAL  99 -12.770  -3.093   0.804
  763   3HG1  VAL  99          3HG2      VAL  99 -13.443  -4.602   0.155
  764   1HG2  VAL  99          1HG1      VAL  99 -10.683  -4.017  -0.210
  765   2HG2  VAL  99          2HG1      VAL  99  -9.881  -5.435   0.478
  766   3HG2  VAL  99          3HG1      VAL  99 -11.338  -5.649  -0.505
  767    H    GLN 100           H        GLN 100 -12.240  -5.656   4.238
  768    HA   GLN 100           HA       GLN 100 -14.265  -3.878   5.160
  769   1HB   GLN 100          2HB       GLN 100 -12.860  -6.159   6.633
  770   2HB   GLN 100          1HB       GLN 100 -14.354  -5.384   7.154
  771   1HG   GLN 100          2HG       GLN 100 -13.970  -6.968   4.564
  772   2HG   GLN 100          1HG       GLN 100 -14.791  -7.522   6.022
  773   1HE2  GLN 100          1HE2      GLN 100 -14.921  -5.182   3.341
  774   2HE2  GLN 100          2HE2      GLN 100 -16.668  -4.961   3.408
  775    H    THR 101           H        THR 101 -11.014  -4.442   6.426
  776    HA   THR 101           HA       THR 101 -11.218  -2.666   8.665
  777    HB   THR 101           HB       THR 101  -8.718  -3.462   7.094
  778    HG1  THR 101           HG1      THR 101  -9.869  -5.260   7.856
  779   1HG2  THR 101          1HG2      THR 101  -9.102  -2.432   9.936
  780   2HG2  THR 101          2HG2      THR 101  -8.211  -1.633   8.618
  781   3HG2  THR 101          3HG2      THR 101  -7.602  -3.143   9.310
  782    H    VAL 102           H        VAL 102 -10.487  -1.984   5.187
  783    HA   VAL 102           HA       VAL 102  -9.844   0.811   5.848
  784    HB   VAL 102           HB       VAL 102 -10.497  -0.560   3.241
  785   1HG1  VAL 102          1HG1      VAL 102  -8.077  -0.132   2.760
  786   2HG1  VAL 102          2HG1      VAL 102  -7.898   0.568   4.373
  787   3HG1  VAL 102          3HG1      VAL 102  -8.288  -1.159   4.179
  788   1HG2  VAL 102          1HG2      VAL 102  -9.605   1.684   2.285
  789   2HG2  VAL 102          2HG2      VAL 102  -9.797   2.345   3.904
  790   3HG2  VAL 102          3HG2      VAL 102 -11.206   1.754   2.991
  791    H    GLU 103           HN       GLU 103 -12.668  -0.949   4.547
  792    HA   GLU 103           HA       GLU 103 -14.311   1.198   3.958
  793   1HB   GLU 103          1HB       GLU 103 -15.015  -1.564   5.011
  794   2HB   GLU 103          2HB       GLU 103 -16.198  -0.418   4.399
  795   1HG   GLU 103          2HG       GLU 103 -13.869  -1.484   2.738
  796   2HG   GLU 103          1HG       GLU 103 -15.510  -2.131   2.711
  797    H    LYS 104           HN       LYS 104 -13.989  -0.414   7.127
  798    HA   LYS 104           HA       LYS 104 -15.914   1.115   8.516
  799   1HB   LYS 104          1HB       LYS 104 -14.546   0.674  10.568
  800   2HB   LYS 104          2HB       LYS 104 -14.900  -0.758   9.597
  801   1HG   LYS 104          1HG       LYS 104 -12.704  -0.886   8.800
  802   2HG   LYS 104          2HG       LYS 104 -12.289   0.766   9.291
  803   1HD   LYS 104          2HD       LYS 104 -11.208  -0.811  10.747
  804   2HD   LYS 104          1HD       LYS 104 -12.397   0.134  11.655
  805   1HE   LYS 104          2HE       LYS 104 -13.992  -1.751  11.591
  806   2HE   LYS 104          1HE       LYS 104 -12.896  -2.678  10.548
  807   1HZ   LYS 104          1HZ       LYS 104 -11.309  -2.685  12.328
  808   2HZ   LYS 104          2HZ       LYS 104 -12.737  -3.341  12.823
  809   3HZ   LYS 104          3HZ       LYS 104 -12.324  -1.818  13.295
  810    H    TYR 105           H        TYR 105 -12.772   2.233   7.353
  811    HA   TYR 105           HA       TYR 105 -12.979   4.784   8.877
  812   1HB   TYR 105          2HB       TYR 105 -10.761   3.843   7.006
  813   2HB   TYR 105          1HB       TYR 105 -10.719   5.165   8.160
  814    HD1  TYR 105           HD1      TYR 105 -11.504   4.286  10.698
  815    HD2  TYR 105           HD2      TYR 105  -9.281   2.118   7.707
  816    HE1  TYR 105           HE1      TYR 105 -10.558   2.817  12.459
  817    HE2  TYR 105           HE2      TYR 105  -8.481   0.568   9.446
  818    HH   TYR 105           HH       TYR 105  -7.920   0.620  11.764
  819    H    LEU 106           H        LEU 106 -13.879   3.444   5.818
  820    HA   LEU 106           HA       LEU 106 -14.140   6.088   4.593
  821   1HB   LEU 106          1HB       LEU 106 -11.712   5.291   4.396
  822   2HB   LEU 106          2HB       LEU 106 -12.278   3.970   3.398
  823    HG   LEU 106           HG       LEU 106 -11.225   5.837   2.296
  824   1HD1  LEU 106          1HD2      LEU 106 -13.679   7.537   2.898
  825   2HD1  LEU 106          2HD2      LEU 106 -12.240   8.014   1.984
  826   3HD1  LEU 106          3HD2      LEU 106 -12.108   7.679   3.721
  827   1HD2  LEU 106          1HD1      LEU 106 -14.123   5.575   1.329
  828   2HD2  LEU 106          2HD1      LEU 106 -12.741   6.093   0.368
  829   3HD2  LEU 106          3HD1      LEU 106 -12.815   4.435   0.986
  830    H    ASN 107           H        ASN 107 -16.402   5.521   4.545
  831    HA   ASN 107           HA       ASN 107 -17.250   4.032   2.267
  832   1HB   ASN 107          2HB       ASN 107 -16.977   2.263   4.093
  833   2HB   ASN 107          1HB       ASN 107 -18.175   3.145   5.045
  834   1HD2  ASN 107          2HD2      ASN 107 -19.870   3.754   2.573
  835   2HD2  ASN 107          1HD2      ASN 107 -20.589   2.191   2.164
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1  -0.599  -2.338 -10.902
    2   2H    MET   1          2H        MET   1  -1.106  -3.872 -10.677
    3   3H    MET   1          3H        MET   1   0.193  -3.588 -11.678
    4    HA   MET   1           HA       MET   1  -1.306  -2.369 -13.163
    5   1HB   MET   1          1HB       MET   1  -0.881  -4.695 -13.714
    6   2HB   MET   1          2HB       MET   1  -2.010  -5.268 -12.479
    7   1HG   MET   1          2HG       MET   1  -2.880  -5.358 -14.848
    8   2HG   MET   1          1HG       MET   1  -3.909  -4.523 -13.693
    9   1HE   MET   1          1HE       MET   1  -1.571  -4.225 -16.772
   10   2HE   MET   1          2HE       MET   1  -1.483  -2.470 -17.039
   11   3HE   MET   1          3HE       MET   1  -0.662  -3.192 -15.639
   12    H    GLU   2           HN       GLU   2  -3.118  -1.065 -13.061
   13    HA   GLU   2           HA       GLU   2  -4.920   0.009 -12.201
   14   1HB   GLU   2          2HB       GLU   2  -5.630  -2.512 -10.607
   15   2HB   GLU   2          1HB       GLU   2  -6.608  -1.066 -10.832
   16   1HG   GLU   2          1HG       GLU   2  -6.671  -1.475 -13.278
   17   2HG   GLU   2          2HG       GLU   2  -5.713  -2.948 -13.056
   18    H    ALA   3           H        ALA   3  -3.614  -2.063  -9.619
   19    HA   ALA   3           HA       ALA   3  -3.096   0.096  -7.766
   20   1HB   ALA   3          1HB       ALA   3  -3.200  -2.308  -7.050
   21   2HB   ALA   3          2HB       ALA   3  -1.772  -2.644  -8.039
   22   3HB   ALA   3          3HB       ALA   3  -1.647  -1.555  -6.641
   23    H    GLY   4           H        GLY   4  -1.368   1.531  -7.879
   24   1HA   GLY   4          2HA       GLY   4   0.407   1.453 -10.217
   25   2HA   GLY   4          1HA       GLY   4   0.355   2.678  -8.941
   26    H    ALA   5           H        ALA   5   2.827   2.082  -9.671
   27    HA   ALA   5           HA       ALA   5   3.921   0.308  -7.543
   28   1HB   ALA   5          1HB       ALA   5   4.267  -0.751  -9.736
   29   2HB   ALA   5          2HB       ALA   5   5.801  -0.168  -9.056
   30   3HB   ALA   5          3HB       ALA   5   5.002   0.745 -10.355
   31    H    VAL   6           H        VAL   6   5.472   1.413  -6.258
   32    HA   VAL   6           HA       VAL   6   6.412   4.060  -7.260
   33    HB   VAL   6           HB       VAL   6   5.994   4.969  -4.898
   34   1HG1  VAL   6          1HG1      VAL   6   5.475   2.914  -3.740
   35   2HG1  VAL   6          2HG1      VAL   6   4.022   2.651  -4.731
   36   3HG1  VAL   6          3HG1      VAL   6   4.123   4.037  -3.631
   37   1HG2  VAL   6          1HG2      VAL   6   4.742   5.802  -6.761
   38   2HG2  VAL   6          2HG2      VAL   6   3.615   4.435  -6.676
   39   3HG2  VAL   6          3HG2      VAL   6   3.702   5.611  -5.342
   40    H    ASN   7           H        ASN   7   7.997   5.067  -5.964
   41    HA   ASN   7           HA       ASN   7   9.693   3.461  -4.256
   42   1HB   ASN   7          2HB       ASN   7  11.035   3.006  -6.216
   43   2HB   ASN   7          1HB       ASN   7  10.429   4.490  -6.971
   44   1HD2  ASN   7          1HD2      ASN   7  13.209   3.330  -4.973
   45   2HD2  ASN   7          2HD2      ASN   7  13.803   4.973  -4.827
   46    H    ASP   8           HN       ASP   8  11.324   5.103  -3.407
   47    HA   ASP   8           HA       ASP   8  10.209   7.076  -1.918
   48   1HB   ASP   8          1HB       ASP   8  12.368   7.999  -1.558
   49   2HB   ASP   8          2HB       ASP   8  12.571   6.253  -1.823
   50    H    ASP   9           HN       ASP   9  11.615   7.650  -5.056
   51    HA   ASP   9           HA       ASP   9  11.193  10.411  -5.358
   52   1HB   ASP   9          2HB       ASP   9  12.452   9.045  -6.955
   53   2HB   ASP   9          1HB       ASP   9  10.998   8.218  -7.485
   54    H    THR  10           H        THR  10   9.052   7.919  -6.764
   55    HA   THR  10           HA       THR  10   6.968   9.765  -7.468
   56    HB   THR  10           HB       THR  10   5.765   7.550  -7.932
   57    HG1  THR  10           HG1      THR  10   7.331   5.779  -7.951
   58   1HG2  THR  10          1HG2      THR  10   7.091   8.787  -9.637
   59   2HG2  THR  10          2HG2      THR  10   8.553   7.925  -9.124
   60   3HG2  THR  10          3HG2      THR  10   7.206   7.032  -9.857
   61    H    PHE  11           H        PHE  11   7.410   7.492  -4.860
   62    HA   PHE  11           HA       PHE  11   5.093   7.244  -3.512
   63   1HB   PHE  11          1HB       PHE  11   7.249   6.337  -2.815
   64   2HB   PHE  11          2HB       PHE  11   7.826   7.915  -2.374
   65    HD1  PHE  11           HD1      PHE  11   7.359   8.865  -0.202
   66    HD2  PHE  11           HD2      PHE  11   5.408   5.240  -1.479
   67    HE1  PHE  11           HE1      PHE  11   6.609   8.447   2.113
   68    HE2  PHE  11           HE2      PHE  11   4.702   4.798   0.851
   69    HZ   PHE  11           HZ       PHE  11   5.238   6.434   2.644
   70    H    LYS  12           HN       LYS  12   7.293   9.961  -3.214
   71    HA   LYS  12           HA       LYS  12   6.089  11.621  -1.352
   72   1HB   LYS  12          1HB       LYS  12   7.353  12.291  -4.038
   73   2HB   LYS  12          2HB       LYS  12   6.787  13.541  -2.938
   74   1HG   LYS  12          1HG       LYS  12   8.249  12.595  -1.129
   75   2HG   LYS  12          2HG       LYS  12   8.736  11.291  -2.218
   76   1HD   LYS  12          2HD       LYS  12   9.682  13.055  -3.793
   77   2HD   LYS  12          1HD       LYS  12   9.342  14.255  -2.529
   78   1HE   LYS  12          2HE       LYS  12  11.632  13.616  -2.218
   79   2HE   LYS  12          1HE       LYS  12  10.733  12.785  -0.938
   80   1HZ   LYS  12          1HZ       LYS  12  10.746  10.815  -2.377
   81   2HZ   LYS  12          2HZ       LYS  12  11.644  11.627  -3.486
   82   3HZ   LYS  12          3HZ       LYS  12  12.271  11.317  -1.997
   83    H    ASN  13           H        ASN  13   5.265  11.900  -4.844
   84    HA   ASN  13           HA       ASN  13   2.939  13.565  -4.201
   85   1HB   ASN  13          2HB       ASN  13   4.515  12.827  -6.562
   86   2HB   ASN  13          1HB       ASN  13   2.817  12.518  -6.880
   87   1HD2  ASN  13          2HD2      ASN  13   4.379  15.106  -4.806
   88   2HD2  ASN  13          1HD2      ASN  13   3.806  16.417  -5.813
   89    H    VAL  14           H        VAL  14   3.545  10.264  -5.166
   90    HA   VAL  14           HA       VAL  14   0.744   9.677  -5.697
   91    HB   VAL  14           HB       VAL  14   3.218   7.917  -5.447
   92   1HG1  VAL  14          1HG1      VAL  14   3.148   7.940  -7.923
   93   2HG1  VAL  14          2HG1      VAL  14   1.737   9.014  -7.887
   94   3HG1  VAL  14          3HG1      VAL  14   3.313   9.590  -7.319
   95   1HG2  VAL  14          1HG2      VAL  14   1.817   6.323  -6.858
   96   2HG2  VAL  14          2HG2      VAL  14   1.321   6.470  -5.163
   97   3HG2  VAL  14          3HG2      VAL  14   0.409   7.318  -6.433
   98    H    VAL  15           H        VAL  15   2.605   9.656  -2.768
   99    HA   VAL  15           HA       VAL  15   0.406   8.230  -1.355
  100    HB   VAL  15           HB       VAL  15   3.362   8.041  -0.689
  101   1HG1  VAL  15          1HG1      VAL  15   2.657   6.239   0.775
  102   2HG1  VAL  15          2HG1      VAL  15   0.963   6.482   0.318
  103   3HG1  VAL  15          3HG1      VAL  15   1.858   7.738   1.210
  104   1HG2  VAL  15          1HG2      VAL  15   1.601   6.128  -2.268
  105   2HG2  VAL  15          2HG2      VAL  15   3.149   5.686  -1.544
  106   3HG2  VAL  15          3HG2      VAL  15   3.077   6.919  -2.809
  107    H    LEU  16           H        LEU  16   3.117  10.569  -0.914
  108    HA   LEU  16           HA       LEU  16   1.932  11.355   1.666
  109   1HB   LEU  16          1HB       LEU  16   4.218  12.684   0.187
  110   2HB   LEU  16          2HB       LEU  16   3.709  12.950   1.844
  111    HG   LEU  16           HG       LEU  16   4.827  10.344   0.712
  112   1HD1  LEU  16          1HD1      LEU  16   6.468  12.198   0.920
  113   2HD1  LEU  16          2HD1      LEU  16   6.020  12.396   2.624
  114   3HD1  LEU  16          3HD1      LEU  16   6.796  10.895   2.074
  115   1HD2  LEU  16          1HD2      LEU  16   3.300   9.780   2.519
  116   2HD2  LEU  16          2HD2      LEU  16   4.939   9.696   3.162
  117   3HD2  LEU  16          3HD2      LEU  16   3.928  11.102   3.533
  118    H    GLU  17           HN       GLU  17   2.645  13.377  -1.266
  119    HA   GLU  17           HA       GLU  17   0.691  15.340  -0.284
  120   1HB   GLU  17          1HB       GLU  17   2.127  15.366  -2.966
  121   2HB   GLU  17          2HB       GLU  17   1.370  16.695  -2.107
  122   1HG   GLU  17          2HG       GLU  17   3.506  17.173  -1.537
  123   2HG   GLU  17          1HG       GLU  17   3.150  16.079  -0.199
  124    H    SER  18           H        SER  18  -0.620  12.891  -0.774
  125    HA   SER  18           HA       SER  18  -2.029  13.121  -3.353
  126   1HB   SER  18          1HB       SER  18  -2.318  11.062  -1.143
  127   2HB   SER  18          2HB       SER  18  -2.835  10.921  -2.835
  128    HG   SER  18           HG       SER  18  -0.393  11.414  -3.197
  129    H    SER  19           H        SER  19  -4.156  13.753  -3.550
  130    HA   SER  19           HA       SER  19  -5.420  15.236  -1.406
  131   1HB   SER  19          2HB       SER  19  -7.154  15.404  -3.346
  132   2HB   SER  19          1HB       SER  19  -5.550  16.126  -3.606
  133    HG   SER  19           HG       SER  19  -6.163  14.776  -5.373
  134    H    VAL  20           H        VAL  20  -6.271  12.461  -3.477
  135    HA   VAL  20           HA       VAL  20  -8.384  11.536  -1.646
  136    HB   VAL  20           HB       VAL  20  -8.279   9.455  -3.135
  137   1HG1  VAL  20          1HG1      VAL  20  -6.554  11.158  -4.972
  138   2HG1  VAL  20          2HG1      VAL  20  -5.959   9.783  -4.013
  139   3HG1  VAL  20          3HG1      VAL  20  -7.187   9.533  -5.261
  140   1HG2  VAL  20          1HG2      VAL  20  -9.457  10.508  -5.004
  141   2HG2  VAL  20          2HG2      VAL  20  -9.999  11.118  -3.437
  142   3HG2  VAL  20          3HG2      VAL  20  -8.916  12.106  -4.455
  143    HA   PRO  21           HA       PRO  21  -5.626   9.171   0.841
  144   1HB   PRO  21          1HB       PRO  21  -7.026   6.908   1.560
  145   2HB   PRO  21          2HB       PRO  21  -7.433   8.536   2.174
  146   1HG   PRO  21          1HG       PRO  21  -8.697   7.090  -0.168
  147   2HG   PRO  21          2HG       PRO  21  -9.506   7.894   1.204
  148   1HD   PRO  21          1HD       PRO  21  -9.182   9.113  -1.199
  149   2HD   PRO  21          2HD       PRO  21  -9.017  10.061   0.291
  150    H    VAL  22           H        VAL  22  -4.512   7.084   0.923
  151    HA   VAL  22           HA       VAL  22  -4.174   5.758  -1.704
  152    HB   VAL  22           HB       VAL  22  -2.033   6.878   0.157
  153   1HG1  VAL  22          1HG1      VAL  22  -0.435   6.333  -1.547
  154   2HG1  VAL  22          2HG1      VAL  22  -1.294   4.872  -1.150
  155   3HG1  VAL  22          3HG1      VAL  22  -1.668   5.762  -2.642
  156   1HG2  VAL  22          1HG2      VAL  22  -3.210   8.015  -2.397
  157   2HG2  VAL  22          2HG2      VAL  22  -1.643   8.509  -1.773
  158   3HG2  VAL  22          3HG2      VAL  22  -3.082   8.777  -0.803
  159    H    LEU  23           H        LEU  23  -3.446   3.622  -1.554
  160    HA   LEU  23           HA       LEU  23  -3.106   2.359   1.139
  161   1HB   LEU  23          2HB       LEU  23  -5.311   1.916   0.090
  162   2HB   LEU  23          1HB       LEU  23  -4.560   1.192  -1.299
  163    HG   LEU  23           HG       LEU  23  -3.854   0.120   1.446
  164   1HD1  LEU  23          1HD2      LEU  23  -2.683  -0.899  -0.475
  165   2HD1  LEU  23          2HD2      LEU  23  -3.854  -2.057   0.154
  166   3HD1  LEU  23          3HD2      LEU  23  -4.226  -1.148  -1.316
  167   1HD2  LEU  23          1HD1      LEU  23  -6.297   0.300   1.505
  168   2HD2  LEU  23          2HD1      LEU  23  -6.413  -0.549  -0.057
  169   3HD2  LEU  23          3HD1      LEU  23  -5.797  -1.393   1.381
  170    H    VAL  24           H        VAL  24  -0.813   2.182   1.025
  171    HA   VAL  24           HA       VAL  24   0.333   1.192  -1.571
  172    HB   VAL  24           HB       VAL  24   1.153   3.311  -1.247
  173   1HG1  VAL  24          1HG2      VAL  24   2.299   4.034   0.860
  174   2HG1  VAL  24          2HG2      VAL  24   0.538   3.876   0.966
  175   3HG1  VAL  24          3HG2      VAL  24   1.592   2.620   1.657
  176   1HG2  VAL  24          1HG1      VAL  24   3.305   1.509  -0.071
  177   2HG2  VAL  24          2HG1      VAL  24   2.871   1.590  -1.795
  178   3HG2  VAL  24          3HG1      VAL  24   3.520   3.019  -0.971
  179    H    ASP  25           HN       ASP  25   0.935  -0.851  -1.586
  180    HA   ASP  25           HA       ASP  25   1.442  -2.319   0.942
  181   1HB   ASP  25          2HB       ASP  25  -0.024  -3.407  -0.665
  182   2HB   ASP  25          1HB       ASP  25   1.204  -3.247  -1.921
  183    H    PHE  26           H        PHE  26   3.486  -2.368   1.722
  184    HA   PHE  26           HA       PHE  26   5.790  -1.696  -0.008
  185   1HB   PHE  26          1HB       PHE  26   5.465  -2.461   2.920
  186   2HB   PHE  26          2HB       PHE  26   7.017  -2.254   2.138
  187    HD1  PHE  26           HD1      PHE  26   3.751  -0.273   2.357
  188    HD2  PHE  26           HD2      PHE  26   8.075  -0.210   2.455
  189    HE1  PHE  26           HE1      PHE  26   3.715   2.115   2.869
  190    HE2  PHE  26           HE2      PHE  26   8.005   2.158   3.132
  191    HZ   PHE  26           HZ       PHE  26   5.785   3.274   3.541
  192    H    TRP  27           H        TRP  27   6.429  -3.268  -1.398
  193    HA   TRP  27           HA       TRP  27   6.292  -6.127  -0.519
  194   1HB   TRP  27          2HB       TRP  27   5.448  -6.764  -2.659
  195   2HB   TRP  27          1HB       TRP  27   4.427  -5.451  -2.120
  196    HD1  TRP  27           HD1      TRP  27   5.294  -2.966  -3.213
  197    HE1  TRP  27           HE1      TRP  27   6.383  -2.400  -5.493
  198    HE3  TRP  27           HE3      TRP  27   6.406  -7.710  -4.780
  199    HZ2  TRP  27           HZ2      TRP  27   7.798  -3.836  -7.557
  200    HZ3  TRP  27           HZ3      TRP  27   7.536  -8.066  -6.931
  201    HH2  TRP  27           HH2      TRP  27   8.212  -6.146  -8.346
  202    H    ALA  28           H        ALA  28   7.426  -7.401  -2.479
  203    HA   ALA  28           HA       ALA  28   9.539  -6.090  -3.831
  204   1HB   ALA  28          1HB       ALA  28  10.699  -6.122  -1.629
  205   2HB   ALA  28          2HB       ALA  28  11.470  -7.231  -2.775
  206   3HB   ALA  28          3HB       ALA  28  10.405  -7.879  -1.513
  207    HA   PRO  29           HA       PRO  29   8.732  -9.811  -6.181
  208   1HB   PRO  29          1HB       PRO  29  11.249 -10.394  -7.250
  209   2HB   PRO  29          2HB       PRO  29  10.073  -9.204  -7.890
  210   1HG   PRO  29          2HG       PRO  29  12.428  -8.676  -6.053
  211   2HG   PRO  29          1HG       PRO  29  11.956  -7.773  -7.524
  212   1HD   PRO  29          2HD       PRO  29  11.228  -6.778  -5.144
  213   2HD   PRO  29          1HD       PRO  29  10.030  -6.867  -6.421
  214    H    TRP  30           H        TRP  30  11.734  -9.983  -4.186
  215    HA   TRP  30           HA       TRP  30  11.618 -12.852  -3.930
  216   1HB   TRP  30          2HB       TRP  30  13.246 -12.487  -2.100
  217   2HB   TRP  30          1HB       TRP  30  13.692 -11.711  -3.613
  218    HD1  TRP  30           HD1      TRP  30  14.274  -9.243  -3.539
  219    HE1  TRP  30           HE1      TRP  30  14.274  -7.378  -1.790
  220    HE3  TRP  30           HE3      TRP  30  11.847 -11.688   0.267
  221    HZ2  TRP  30           HZ2      TRP  30  13.188  -6.930   0.843
  222    HZ3  TRP  30           HZ3      TRP  30  11.276 -10.484   2.345
  223    HH2  TRP  30           HH2      TRP  30  11.857  -8.086   2.612
  224    H    CYS  31           H        CYS  31   9.639 -10.374  -2.481
  225    HA   CYS  31           HA       CYS  31   9.322 -11.810   0.082
  226   1HB   CYS  31          2HB       CYS  31   9.203  -9.427   0.168
  227   2HB   CYS  31          1HB       CYS  31   7.928  -9.388  -1.056
  228    H    GLY  32           H        GLY  32   8.749 -13.834  -0.881
  229   1HA   GLY  32          1HA       GLY  32   6.716 -14.688  -2.397
  230   2HA   GLY  32          2HA       GLY  32   7.041 -15.443  -0.831
  231    HA   PRO  33           HA       PRO  33   3.122 -14.270   0.686
  232   1HB   PRO  33          1HB       PRO  33   3.263 -12.771   2.942
  233   2HB   PRO  33          2HB       PRO  33   3.725 -14.499   2.867
  234   1HG   PRO  33          1HG       PRO  33   5.470 -12.077   2.633
  235   2HG   PRO  33          2HG       PRO  33   5.757 -13.490   3.695
  236   1HD   PRO  33          1HD       PRO  33   7.029 -13.325   1.335
  237   2HD   PRO  33          2HD       PRO  33   6.327 -14.891   1.821
  238    H    CYS  34           H        CYS  34   5.171 -11.568  -0.231
  239    HA   CYS  34           HA       CYS  34   2.968  -9.605  -0.236
  240   1HB   CYS  34          2HB       CYS  34   5.652  -9.351  -1.624
  241   2HB   CYS  34          1HB       CYS  34   4.445  -8.129  -1.254
  242    H    ARG  35           HN       ARG  35   5.001 -11.517  -2.435
  243    HA   ARG  35           HA       ARG  35   4.012 -10.786  -4.928
  244   1HB   ARG  35          1HB       ARG  35   5.971 -12.390  -4.104
  245   2HB   ARG  35          2HB       ARG  35   4.782 -13.662  -4.367
  246   1HG   ARG  35          1HG       ARG  35   5.787 -11.601  -6.391
  247   2HG   ARG  35          2HG       ARG  35   6.289 -13.288  -6.290
  248   1HD   ARG  35          2HD       ARG  35   3.528 -12.261  -7.053
  249   2HD   ARG  35          1HD       ARG  35   4.714 -12.995  -8.108
  250    HE   ARG  35           HE       ARG  35   4.558 -15.056  -6.633
  251   1HH1  ARG  35          2HH1      ARG  35   1.680 -12.993  -6.868
  252   2HH1  ARG  35          1HH1      ARG  35   0.621 -14.306  -7.293
  253   1HH2  ARG  35          1HH2      ARG  35   3.124 -16.777  -6.902
  254   2HH2  ARG  35          2HH2      ARG  35   1.419 -16.495  -7.115
  255    H    ILE  36           H        ILE  36   2.883 -13.464  -2.828
  256    HA   ILE  36           HA       ILE  36   0.805 -14.284  -4.607
  257    HB   ILE  36           HB       ILE  36  -0.129 -15.514  -2.723
  258   1HG1  ILE  36          1HG1      ILE  36   1.911 -13.985  -1.074
  259   2HG1  ILE  36          2HG1      ILE  36   0.152 -13.815  -0.962
  260   1HG2  ILE  36          1HG2      ILE  36   2.929 -15.616  -2.777
  261   2HG2  ILE  36          2HG2      ILE  36   1.821 -16.941  -2.387
  262   3HG2  ILE  36          3HG2      ILE  36   1.877 -16.284  -4.027
  263   1HD1  ILE  36          1HD1      ILE  36   0.830 -15.140   0.858
  264   2HD1  ILE  36          2HD1      ILE  36  -0.049 -16.175  -0.289
  265   3HD1  ILE  36          3HD1      ILE  36   1.735 -16.258  -0.187
  266    H    ILE  37           H        ILE  37   0.663 -11.781  -2.000
  267    HA   ILE  37           HA       ILE  37  -2.205 -11.438  -2.513
  268    HB   ILE  37           HB       ILE  37  -2.132  -9.553  -1.013
  269   1HG1  ILE  37          2HG1      ILE  37   0.828 -10.068  -0.656
  270   2HG1  ILE  37          1HG1      ILE  37   0.172  -8.713  -1.594
  271   1HG2  ILE  37          1HG2      ILE  37  -1.709 -10.820   0.999
  272   2HG2  ILE  37          2HG2      ILE  37  -0.568 -11.891   0.166
  273   3HG2  ILE  37          3HG2      ILE  37  -2.300 -11.949  -0.218
  274   1HD1  ILE  37          1HD1      ILE  37  -0.191  -9.184   1.384
  275   2HD1  ILE  37          2HD1      ILE  37  -1.008  -7.909   0.445
  276   3HD1  ILE  37          3HD1      ILE  37   0.761  -7.919   0.589
  277    H    ALA  38           H        ALA  38   0.737  -9.936  -3.816
  278    HA   ALA  38           HA       ALA  38  -0.018  -7.606  -4.816
  279   1HB   ALA  38          1HB       ALA  38   2.134  -8.724  -5.295
  280   2HB   ALA  38          2HB       ALA  38   1.371  -9.669  -6.587
  281   3HB   ALA  38          3HB       ALA  38   1.450  -7.914  -6.711
  282    HA   PRO  39           HA       PRO  39  -2.664  -9.161  -8.574
  283   1HB   PRO  39          2HB       PRO  39  -3.758 -11.747  -7.538
  284   2HB   PRO  39          1HB       PRO  39  -3.257 -11.326  -9.198
  285   1HG   PRO  39          1HG       PRO  39  -1.699 -12.939  -7.657
  286   2HG   PRO  39          2HG       PRO  39  -0.940 -11.650  -8.648
  287   1HD   PRO  39          1HD       PRO  39  -1.775 -11.485  -5.740
  288   2HD   PRO  39          2HD       PRO  39  -0.165 -11.171  -6.405
  289    H    VAL  40           H        VAL  40  -3.394 -10.143  -5.258
  290    HA   VAL  40           HA       VAL  40  -6.199  -9.497  -5.213
  291    HB   VAL  40           HB       VAL  40  -4.292 -10.634  -3.402
  292   1HG1  VAL  40          1HG2      VAL  40  -5.850  -8.345  -2.133
  293   2HG1  VAL  40          2HG2      VAL  40  -4.080  -8.447  -2.228
  294   3HG1  VAL  40          3HG2      VAL  40  -4.974  -9.624  -1.276
  295   1HG2  VAL  40          1HG1      VAL  40  -7.264 -10.184  -3.198
  296   2HG2  VAL  40          2HG1      VAL  40  -6.459 -11.546  -4.001
  297   3HG2  VAL  40          3HG1      VAL  40  -6.308 -11.339  -2.243
  298    H    VAL  41           H        VAL  41  -3.163  -7.770  -4.404
  299    HA   VAL  41           HA       VAL  41  -4.420  -5.376  -3.600
  300    HB   VAL  41           HB       VAL  41  -1.659  -5.655  -4.908
  301   1HG1  VAL  41          1HG1      VAL  41  -2.410  -5.824  -1.961
  302   2HG1  VAL  41          2HG1      VAL  41  -0.759  -5.772  -2.620
  303   3HG1  VAL  41          3HG1      VAL  41  -1.788  -7.148  -2.952
  304   1HG2  VAL  41          1HG2      VAL  41  -2.331  -3.319  -4.802
  305   2HG2  VAL  41          2HG2      VAL  41  -2.841  -3.499  -3.106
  306   3HG2  VAL  41          3HG2      VAL  41  -1.131  -3.617  -3.545
  307    H    ASP  42           HN       ASP  42  -3.321  -6.493  -6.814
  308    HA   ASP  42           HA       ASP  42  -3.940  -4.161  -8.317
  309   1HB   ASP  42          1HB       ASP  42  -4.072  -7.082  -9.189
  310   2HB   ASP  42          2HB       ASP  42  -4.169  -5.700 -10.259
  311    H    GLU  43           HN       GLU  43  -6.115  -7.090  -7.799
  312    HA   GLU  43           HA       GLU  43  -8.292  -5.782  -9.106
  313   1HB   GLU  43          1HB       GLU  43  -9.693  -7.475  -8.110
  314   2HB   GLU  43          2HB       GLU  43  -8.256  -8.185  -8.848
  315   1HG   GLU  43          1HG       GLU  43  -7.223  -8.430  -6.688
  316   2HG   GLU  43          2HG       GLU  43  -8.580  -7.664  -5.847
  317    H    ILE  44           H        ILE  44  -7.312  -5.781  -5.605
  318    HA   ILE  44           HA       ILE  44  -9.555  -4.371  -4.637
  319    HB   ILE  44           HB       ILE  44  -6.618  -4.370  -3.834
  320   1HG1  ILE  44          2HG1      ILE  44  -9.164  -5.469  -2.561
  321   2HG1  ILE  44          1HG1      ILE  44  -8.064  -6.424  -3.522
  322   1HG2  ILE  44          1HG2      ILE  44  -7.223  -3.169  -1.779
  323   2HG2  ILE  44          2HG2      ILE  44  -8.899  -3.009  -2.338
  324   3HG2  ILE  44          3HG2      ILE  44  -7.573  -2.157  -3.161
  325   1HD1  ILE  44          1HD1      ILE  44  -7.471  -5.146  -0.837
  326   2HD1  ILE  44          2HD1      ILE  44  -7.522  -6.864  -1.232
  327   3HD1  ILE  44          3HD1      ILE  44  -6.212  -5.857  -1.876
  328    H    ALA  45           H        ALA  45  -6.572  -3.119  -6.258
  329    HA   ALA  45           HA       ALA  45  -7.339  -0.376  -6.152
  330   1HB   ALA  45          1HB       ALA  45  -5.957  -1.711  -8.504
  331   2HB   ALA  45          2HB       ALA  45  -5.142  -1.342  -6.990
  332   3HB   ALA  45          3HB       ALA  45  -5.840  -0.032  -7.980
  333    H    GLY  46           H        GLY  46  -7.981  -2.883  -8.663
  334   1HA   GLY  46          1HA       GLY  46  -9.561  -1.458 -10.444
  335   2HA   GLY  46          2HA       GLY  46  -9.820  -3.167 -10.035
  336    H    GLU  47           HN       GLU  47 -10.644  -2.954  -7.359
  337    HA   GLU  47           HA       GLU  47 -13.393  -2.138  -7.640
  338   1HB   GLU  47          2HB       GLU  47 -11.747  -2.971  -5.221
  339   2HB   GLU  47          1HB       GLU  47 -13.503  -2.767  -5.215
  340   1HG   GLU  47          1HG       GLU  47 -13.776  -4.522  -6.882
  341   2HG   GLU  47          2HG       GLU  47 -12.037  -4.723  -7.054
  342    H    TYR  48           H        TYR  48 -10.747  -0.808  -5.637
  343    HA   TYR  48           HA       TYR  48 -12.493   1.446  -4.792
  344   1HB   TYR  48          2HB       TYR  48  -9.775   0.486  -3.850
  345   2HB   TYR  48          1HB       TYR  48 -10.634   1.889  -3.219
  346    HD1  TYR  48           HD1      TYR  48 -10.746  -1.820  -3.331
  347    HD2  TYR  48           HD2      TYR  48 -12.452   1.793  -1.716
  348    HE1  TYR  48           HE1      TYR  48 -11.851  -3.137  -1.550
  349    HE2  TYR  48           HE2      TYR  48 -13.532   0.482   0.072
  350    HH   TYR  48           HH       TYR  48 -13.891  -1.603   0.955
  351    H    LYS  49           HN       LYS  49 -10.610   1.104  -7.451
  352    HA   LYS  49           HA       LYS  49  -8.906   3.118  -7.774
  353   1HB   LYS  49          1HB       LYS  49  -9.668   3.286 -10.142
  354   2HB   LYS  49          2HB       LYS  49  -9.514   1.620  -9.589
  355   1HG   LYS  49          1HG       LYS  49 -11.989   1.555  -9.181
  356   2HG   LYS  49          2HG       LYS  49 -12.124   3.191  -9.848
  357   1HD   LYS  49          1HD       LYS  49 -11.117   2.370 -11.992
  358   2HD   LYS  49          2HD       LYS  49 -11.066   0.733 -11.314
  359   1HE   LYS  49          2HE       LYS  49 -13.574   2.404 -11.826
  360   2HE   LYS  49          1HE       LYS  49 -13.030   0.990 -12.745
  361   1HZ   LYS  49          1HZ       LYS  49 -13.917   1.026  -9.950
  362   2HZ   LYS  49          2HZ       LYS  49 -14.679   0.319 -11.229
  363   3HZ   LYS  49          3HZ       LYS  49 -13.238  -0.279 -10.676
  364    H    ASP  50           HN       ASP  50  -8.872   5.288  -8.350
  365    HA   ASP  50           HA       ASP  50  -9.445   7.466  -8.535
  366   1HB   ASP  50          2HB       ASP  50 -11.488   6.634  -9.798
  367   2HB   ASP  50          1HB       ASP  50 -12.403   6.724  -8.298
  368    H    LYS  51           HN       LYS  51 -11.587   5.798  -6.292
  369    HA   LYS  51           HA       LYS  51 -11.798   7.956  -4.406
  370   1HB   LYS  51          2HB       LYS  51 -12.309   4.984  -4.033
  371   2HB   LYS  51          1HB       LYS  51 -12.963   6.307  -3.062
  372   1HG   LYS  51          1HG       LYS  51 -14.297   7.114  -4.932
  373   2HG   LYS  51          2HG       LYS  51 -13.596   5.956  -6.053
  374   1HD   LYS  51          1HD       LYS  51 -15.285   5.237  -3.628
  375   2HD   LYS  51          2HD       LYS  51 -15.849   5.293  -5.300
  376   1HE   LYS  51          2HE       LYS  51 -13.783   3.351  -4.162
  377   2HE   LYS  51          1HE       LYS  51 -15.439   2.989  -4.638
  378   1HZ   LYS  51          1HZ       LYS  51 -13.293   3.835  -6.460
  379   2HZ   LYS  51          2HZ       LYS  51 -13.945   2.327  -6.328
  380   3HZ   LYS  51          3HZ       LYS  51 -14.862   3.574  -6.891
  381    H    LEU  52           H        LEU  52  -9.679   5.170  -4.732
  382    HA   LEU  52           HA       LEU  52  -8.069   6.018  -2.380
  383   1HB   LEU  52          1HB       LEU  52  -9.702   4.193  -1.771
  384   2HB   LEU  52          2HB       LEU  52  -8.986   3.218  -3.063
  385    HG   LEU  52           HG       LEU  52  -6.827   3.158  -1.857
  386   1HD1  LEU  52          1HD2      LEU  52  -8.391   4.603   0.339
  387   2HD1  LEU  52          2HD2      LEU  52  -6.977   5.228  -0.538
  388   3HD1  LEU  52          3HD2      LEU  52  -6.797   3.847   0.546
  389   1HD2  LEU  52          1HD1      LEU  52  -8.491   1.368  -1.604
  390   2HD2  LEU  52          2HD1      LEU  52  -7.682   1.645  -0.051
  391   3HD2  LEU  52          3HD1      LEU  52  -9.316   2.275  -0.319
  392    H    LYS  53           HN       LYS  53  -5.990   6.288  -3.113
  393    HA   LYS  53           HA       LYS  53  -5.249   5.245  -5.730
  394   1HB   LYS  53          2HB       LYS  53  -4.523   7.456  -4.176
  395   2HB   LYS  53          1HB       LYS  53  -3.095   6.444  -4.096
  396   1HG   LYS  53          1HG       LYS  53  -4.453   7.216  -6.695
  397   2HG   LYS  53          2HG       LYS  53  -3.026   7.998  -5.992
  398   1HD   LYS  53          1HD       LYS  53  -1.705   5.962  -6.164
  399   2HD   LYS  53          2HD       LYS  53  -3.100   5.005  -6.657
  400   1HE   LYS  53          2HE       LYS  53  -1.702   5.532  -8.591
  401   2HE   LYS  53          1HE       LYS  53  -3.321   6.228  -8.752
  402   1HZ   LYS  53          1HZ       LYS  53  -0.914   7.689  -7.916
  403   2HZ   LYS  53          2HZ       LYS  53  -2.422   8.332  -8.078
  404   3HZ   LYS  53          3HZ       LYS  53  -1.623   7.760  -9.399
  405    H    CYS  54           H        CYS  54  -5.245   2.986  -5.544
  406    HA   CYS  54           HA       CYS  54  -3.766   1.692  -3.392
  407   1HB   CYS  54          1HB       CYS  54  -5.737   0.624  -4.388
  408   2HB   CYS  54          2HB       CYS  54  -4.896   0.600  -5.959
  409    HG   CYS  54           HG       CYS  54  -4.799  -1.824  -4.972
  410    H    VAL  55           H        VAL  55  -1.644   1.023  -3.400
  411    HA   VAL  55           HA       VAL  55  -0.117   1.096  -5.929
  412    HB   VAL  55           HB       VAL  55   1.429   2.450  -3.861
  413   1HG1  VAL  55          1HG1      VAL  55  -0.712   3.321  -2.978
  414   2HG1  VAL  55          2HG1      VAL  55  -1.073   3.993  -4.593
  415   3HG1  VAL  55          3HG1      VAL  55   0.328   4.564  -3.678
  416   1HG2  VAL  55          1HG2      VAL  55   1.941   2.540  -6.241
  417   2HG2  VAL  55          2HG2      VAL  55   0.387   3.355  -6.570
  418   3HG2  VAL  55          3HG2      VAL  55   1.636   4.164  -5.608
  419    H    LYS  56           HN       LYS  56   2.094   0.344  -5.699
  420    HA   LYS  56           HA       LYS  56   2.611  -1.410  -3.357
  421   1HB   LYS  56          1HB       LYS  56   2.335  -2.016  -6.248
  422   2HB   LYS  56          2HB       LYS  56   3.770  -2.711  -5.511
  423   1HG   LYS  56          2HG       LYS  56   2.492  -3.764  -3.753
  424   2HG   LYS  56          1HG       LYS  56   0.995  -2.986  -4.303
  425   1HD   LYS  56          2HD       LYS  56   2.618  -4.979  -5.952
  426   2HD   LYS  56          1HD       LYS  56   1.247  -5.404  -4.910
  427   1HE   LYS  56          2HE       LYS  56  -0.201  -3.805  -6.230
  428   2HE   LYS  56          1HE       LYS  56   1.148  -3.583  -7.359
  429   1HZ   LYS  56          1HZ       LYS  56  -0.245  -6.104  -6.775
  430   2HZ   LYS  56          2HZ       LYS  56   1.074  -5.956  -7.761
  431   3HZ   LYS  56          3HZ       LYS  56  -0.343  -5.209  -8.146
  432    H    LEU  57           H        LEU  57   4.378  -0.669  -2.310
  433    HA   LEU  57           HA       LEU  57   6.365   0.939  -3.833
  434   1HB   LEU  57          1HB       LEU  57   5.568   1.924  -1.751
  435   2HB   LEU  57          2HB       LEU  57   6.177   0.542  -0.831
  436    HG   LEU  57           HG       LEU  57   8.203   1.765  -2.650
  437   1HD1  LEU  57          1HD2      LEU  57   8.832   0.129  -0.926
  438   2HD1  LEU  57          2HD2      LEU  57   9.541   1.703  -0.544
  439   3HD1  LEU  57          3HD2      LEU  57   8.117   1.162   0.329
  440   1HD2  LEU  57          1HD1      LEU  57   7.051   3.422  -0.390
  441   2HD2  LEU  57          2HD1      LEU  57   8.573   3.753  -1.247
  442   3HD2  LEU  57          3HD1      LEU  57   7.048   3.811  -2.134
  443    H    ASN  58           H        ASN  58   8.081   0.027  -4.641
  444    HA   ASN  58           HA       ASN  58   8.741  -2.740  -3.965
  445   1HB   ASN  58          2HB       ASN  58   9.029  -1.893  -6.261
  446   2HB   ASN  58          1HB       ASN  58  10.256  -0.750  -5.693
  447   1HD2  ASN  58          2HD2      ASN  58   9.810  -3.910  -6.941
  448   2HD2  ASN  58          1HD2      ASN  58  11.375  -4.546  -6.469
  449    H    THR  59           H        THR  59   9.428  -3.049  -2.009
  450    HA   THR  59           HA       THR  59  11.173  -1.172  -0.580
  451    HB   THR  59           HB       THR  59   9.931  -3.803   0.305
  452    HG1  THR  59           HG1      THR  59   8.411  -2.171  -0.497
  453   1HG2  THR  59          1HG2      THR  59  11.616  -3.039   1.901
  454   2HG2  THR  59          2HG2      THR  59  11.037  -1.368   1.766
  455   3HG2  THR  59          3HG2      THR  59  10.035  -2.601   2.559
  456    H    ASP  60           HN       ASP  60  12.484  -2.013  -2.701
  457    HA   ASP  60           HA       ASP  60  14.808  -3.408  -1.513
  458   1HB   ASP  60          1HB       ASP  60  13.304  -5.057  -2.764
  459   2HB   ASP  60          2HB       ASP  60  13.741  -4.216  -4.261
  460    H    GLU  61           HN       GLU  61  13.329  -1.905  -4.319
  461    HA   GLU  61           HA       GLU  61  15.553  -0.263  -5.143
  462   1HB   GLU  61          2HB       GLU  61  13.659  -1.188  -6.593
  463   2HB   GLU  61          1HB       GLU  61  12.568  -0.068  -5.748
  464   1HG   GLU  61          1HG       GLU  61  13.184   0.827  -7.887
  465   2HG   GLU  61          2HG       GLU  61  13.826   1.865  -6.623
  466    H    SER  62           H        SER  62  12.803   0.047  -2.907
  467    HA   SER  62           HA       SER  62  13.698   2.790  -2.236
  468   1HB   SER  62          2HB       SER  62  11.638   2.661  -3.697
  469   2HB   SER  62          1HB       SER  62  10.809   1.758  -2.426
  470    HG   SER  62           HG       SER  62  11.124   3.507  -1.043
  471    HA   PRO  63           HA       PRO  63  13.395   0.290   1.689
  472   1HB   PRO  63          1HB       PRO  63  16.047   0.344   2.347
  473   2HB   PRO  63          2HB       PRO  63  15.348  -0.930   1.296
  474   1HG   PRO  63          1HG       PRO  63  16.852   1.571   0.483
  475   2HG   PRO  63          2HG       PRO  63  17.053  -0.088  -0.152
  476   1HD   PRO  63          2HD       PRO  63  15.547   1.784  -1.469
  477   2HD   PRO  63          1HD       PRO  63  15.032   0.103  -1.429
  478    H    ASN  64           H        ASN  64  14.973   3.161   0.457
  479    HA   ASN  64           HA       ASN  64  15.607   4.740   2.583
  480   1HB   ASN  64          1HB       ASN  64  13.919   5.691   0.218
  481   2HB   ASN  64          2HB       ASN  64  14.975   6.670   1.237
  482   1HD2  ASN  64          1HD2      ASN  64  16.690   7.301  -0.065
  483   2HD2  ASN  64          2HD2      ASN  64  17.535   6.208  -1.148
  484    H    VAL  65           H        VAL  65  12.352   4.535   1.165
  485    HA   VAL  65           HA       VAL  65  10.988   6.093   3.093
  486    HB   VAL  65           HB       VAL  65  10.009   3.845   1.268
  487   1HG1  VAL  65          1HG2      VAL  65   8.444   6.075   2.621
  488   2HG1  VAL  65          2HG2      VAL  65   7.810   4.839   1.502
  489   3HG1  VAL  65          3HG2      VAL  65   8.388   4.370   3.102
  490   1HG2  VAL  65          1HG1      VAL  65  11.074   5.661   0.002
  491   2HG2  VAL  65          2HG1      VAL  65  10.165   6.876   0.921
  492   3HG2  VAL  65          3HG1      VAL  65   9.317   5.769  -0.179
  493    H    ALA  66           H        ALA  66  11.289   2.569   2.752
  494    HA   ALA  66           HA       ALA  66   9.804   1.821   5.040
  495   1HB   ALA  66          1HB       ALA  66  12.261   0.430   3.878
  496   2HB   ALA  66          2HB       ALA  66  10.577   0.230   3.338
  497   3HB   ALA  66          3HB       ALA  66  11.063  -0.298   4.959
  498    H    SER  67           H        SER  67  13.219   2.793   4.799
  499    HA   SER  67           HA       SER  67  13.876   2.278   7.554
  500   1HB   SER  67          1HB       SER  67  15.243   4.163   5.580
  501   2HB   SER  67          2HB       SER  67  15.926   3.472   7.060
  502    HG   SER  67           HG       SER  67  15.069   2.037   4.751
  503    H    GLU  68           HN       GLU  68  12.993   5.209   5.731
  504    HA   GLU  68           HA       GLU  68  13.192   7.120   7.814
  505   1HB   GLU  68          2HB       GLU  68  11.368   6.943   5.384
  506   2HB   GLU  68          1HB       GLU  68  11.440   8.363   6.426
  507   1HG   GLU  68          2HG       GLU  68  13.641   8.903   5.819
  508   2HG   GLU  68          1HG       GLU  68  14.008   7.284   5.232
  509    H    TYR  69           H        TYR  69  10.411   5.064   6.833
  510    HA   TYR  69           HA       TYR  69   8.749   6.084   9.030
  511   1HB   TYR  69          2HB       TYR  69   8.448   3.985   6.868
  512   2HB   TYR  69          1HB       TYR  69   7.362   4.008   8.244
  513    HD1  TYR  69           HD1      TYR  69   8.390   5.840   5.199
  514    HD2  TYR  69           HD2      TYR  69   5.873   5.948   8.695
  515    HE1  TYR  69           HE1      TYR  69   7.426   7.993   4.444
  516    HE2  TYR  69           HE2      TYR  69   4.905   8.093   7.931
  517    HH   TYR  69           HH       TYR  69   5.180   9.877   6.461
  518    H    GLY  70           H        GLY  70  10.835   3.257   8.494
  519   1HA   GLY  70          2HA       GLY  70  11.998   2.141  10.187
  520   2HA   GLY  70          1HA       GLY  70  10.916   2.802  11.420
  521    H    ILE  71           H        ILE  71  10.429   0.963   8.385
  522    HA   ILE  71           HA       ILE  71   8.353  -0.695   9.608
  523    HB   ILE  71           HB       ILE  71   9.653  -0.634   6.855
  524   1HG1  ILE  71          2HG1      ILE  71   6.996   0.355   8.001
  525   2HG1  ILE  71          1HG1      ILE  71   8.334   1.353   7.412
  526   1HG2  ILE  71          1HG2      ILE  71   7.799  -2.130   6.137
  527   2HG2  ILE  71          2HG2      ILE  71   8.863  -2.894   7.296
  528   3HG2  ILE  71          3HG2      ILE  71   7.276  -2.284   7.830
  529   1HD1  ILE  71          1HD1      ILE  71   8.017   0.247   5.149
  530   2HD1  ILE  71          2HD1      ILE  71   6.758   1.384   5.686
  531   3HD1  ILE  71          3HD1      ILE  71   6.458  -0.359   5.760
  532    H    ARG  72           HN       ARG  72   8.499  -2.790  10.256
  533    HA   ARG  72           HA       ARG  72  11.140  -3.772  10.949
  534   1HB   ARG  72          2HB       ARG  72   9.255  -3.935  12.465
  535   2HB   ARG  72          1HB       ARG  72   8.348  -4.954  11.339
  536   1HG   ARG  72          1HG       ARG  72  11.110  -5.852  12.187
  537   2HG   ARG  72          2HG       ARG  72   9.812  -5.944  13.369
  538   1HD   ARG  72          1HD       ARG  72   8.457  -7.364  12.055
  539   2HD   ARG  72          2HD       ARG  72   9.494  -7.237  10.648
  540    HE   ARG  72           HE       ARG  72   9.813  -8.960  12.926
  541   1HH1  ARG  72          1HH1      ARG  72  11.740  -7.190  10.494
  542   2HH1  ARG  72          2HH1      ARG  72  13.041  -8.339  10.534
  543   1HH2  ARG  72          2HH2      ARG  72  11.537 -10.421  12.970
  544   2HH2  ARG  72          1HH2      ARG  72  12.940 -10.183  11.965
  545    H    SER  73           H        SER  73   8.616  -4.754   8.555
  546    HA   SER  73           HA       SER  73  10.518  -5.998   6.884
  547   1HB   SER  73          1HB       SER  73  10.314  -7.829   8.686
  548   2HB   SER  73          2HB       SER  73   8.609  -7.973   8.221
  549    HG   SER  73           HG       SER  73  10.941  -8.477   6.685
  550    H    ILE  74           H        ILE  74   8.823  -7.667   5.496
  551    HA   ILE  74           HA       ILE  74   6.475  -6.006   4.772
  552    HB   ILE  74           HB       ILE  74   7.078  -6.378   2.336
  553   1HG1  ILE  74          1HG1      ILE  74   9.853  -7.016   3.376
  554   2HG1  ILE  74          2HG1      ILE  74   8.734  -8.159   2.613
  555   1HG2  ILE  74          1HG2      ILE  74   8.423  -4.388   2.244
  556   2HG2  ILE  74          2HG2      ILE  74   7.376  -4.221   3.651
  557   3HG2  ILE  74          3HG2      ILE  74   9.079  -4.669   3.872
  558   1HD1  ILE  74          1HD1      ILE  74   8.633  -6.477   0.639
  559   2HD1  ILE  74          2HD1      ILE  74  10.094  -5.763   1.371
  560   3HD1  ILE  74          3HD1      ILE  74  10.095  -7.436   0.822
  561    HA   PRO  75           HA       PRO  75   4.897  -6.462   2.803
  562   1HB   PRO  75          1HB       PRO  75   2.286  -7.146   2.955
  563   2HB   PRO  75          2HB       PRO  75   3.394  -7.881   1.793
  564   1HG   PRO  75          1HG       PRO  75   2.615  -9.009   4.514
  565   2HG   PRO  75          2HG       PRO  75   2.625  -9.862   2.930
  566   1HD   PRO  75          1HD       PRO  75   4.667 -10.056   4.722
  567   2HD   PRO  75          2HD       PRO  75   4.970  -9.988   2.967
  568    H    THR  76           H        THR  76   3.598  -4.732   3.370
  569    HA   THR  76           HA       THR  76   2.280  -4.435   5.912
  570    HB   THR  76           HB       THR  76   5.001  -3.148   5.478
  571    HG1  THR  76           HG1      THR  76   4.518  -5.156   6.764
  572   1HG2  THR  76          1HG2      THR  76   3.488  -1.285   6.056
  573   2HG2  THR  76          2HG2      THR  76   2.799  -2.245   7.389
  574   3HG2  THR  76          3HG2      THR  76   4.491  -1.715   7.449
  575    H    ILE  77           H        ILE  77   0.541  -3.442   5.200
  576    HA   ILE  77           HA       ILE  77   0.573  -1.794   2.740
  577    HB   ILE  77           HB       ILE  77  -1.663  -3.111   4.319
  578   1HG1  ILE  77          1HG1      ILE  77  -0.590  -3.839   1.560
  579   2HG1  ILE  77          2HG1      ILE  77  -0.082  -4.664   3.036
  580   1HG2  ILE  77          1HG2      ILE  77  -3.096  -2.448   2.405
  581   2HG2  ILE  77          2HG2      ILE  77  -2.402  -1.029   3.174
  582   3HG2  ILE  77          3HG2      ILE  77  -1.707  -1.626   1.654
  583   1HD1  ILE  77          1HD1      ILE  77  -2.910  -4.620   1.941
  584   2HD1  ILE  77          2HD1      ILE  77  -2.420  -5.289   3.519
  585   3HD1  ILE  77          3HD1      ILE  77  -1.784  -5.982   2.014
  586    H    MET  78           H        MET  78   0.903   0.368   3.204
  587    HA   MET  78           HA       MET  78  -0.123   1.416   5.832
  588   1HB   MET  78          1HB       MET  78   1.823   2.592   3.858
  589   2HB   MET  78          2HB       MET  78   1.216   3.399   5.312
  590   1HG   MET  78          1HG       MET  78   2.164   1.538   6.679
  591   2HG   MET  78          2HG       MET  78   2.902   0.885   5.223
  592   1HE   MET  78          1HE       MET  78   5.572   2.496   7.799
  593   2HE   MET  78          2HE       MET  78   3.906   2.202   8.343
  594   3HE   MET  78          3HE       MET  78   4.736   0.993   7.335
  595    H    VAL  79           H        VAL  79  -1.612   3.046   5.854
  596    HA   VAL  79           HA       VAL  79  -2.871   3.740   3.242
  597    HB   VAL  79           HB       VAL  79  -4.041   3.805   6.030
  598   1HG1  VAL  79          1HG1      VAL  79  -5.514   1.966   5.142
  599   2HG1  VAL  79          2HG1      VAL  79  -4.532   1.927   3.666
  600   3HG1  VAL  79          3HG1      VAL  79  -3.815   1.484   5.230
  601   1HG2  VAL  79          1HG2      VAL  79  -5.001   5.570   4.568
  602   2HG2  VAL  79          2HG2      VAL  79  -6.181   4.286   4.859
  603   3HG2  VAL  79          3HG2      VAL  79  -5.320   4.357   3.312
  604    H    PHE  80           H        PHE  80  -2.726   5.901   2.653
  605    HA   PHE  80           HA       PHE  80  -1.782   7.901   4.666
  606   1HB   PHE  80          1HB       PHE  80  -0.581   7.306   1.938
  607   2HB   PHE  80          2HB       PHE  80  -0.349   8.834   2.749
  608    HD1  PHE  80           HD1      PHE  80   1.259   9.165   4.445
  609    HD2  PHE  80           HD2      PHE  80   0.503   5.223   2.888
  610    HE1  PHE  80           HE1      PHE  80   3.381   8.383   5.414
  611    HE2  PHE  80           HE2      PHE  80   2.791   4.539   3.601
  612    HZ   PHE  80           HZ       PHE  80   4.160   6.041   5.002
  613    H    LYS  81           HN       LYS  81  -2.113  10.126   3.991
  614    HA   LYS  81           HA       LYS  81  -3.574  10.811   1.636
  615   1HB   LYS  81          2HB       LYS  81  -5.694  11.358   2.475
  616   2HB   LYS  81          1HB       LYS  81  -5.424   9.721   3.052
  617   1HG   LYS  81          2HG       LYS  81  -5.318  12.288   4.684
  618   2HG   LYS  81          1HG       LYS  81  -6.515  10.992   4.732
  619   1HD   LYS  81          1HD       LYS  81  -4.540   9.442   5.383
  620   2HD   LYS  81          2HD       LYS  81  -3.655  10.926   5.754
  621   1HE   LYS  81          2HE       LYS  81  -6.295  10.062   7.010
  622   2HE   LYS  81          1HE       LYS  81  -4.697  10.034   7.772
  623   1HZ   LYS  81          1HZ       LYS  81  -5.916  11.956   8.414
  624   2HZ   LYS  81          2HZ       LYS  81  -4.596  12.405   7.536
  625   3HZ   LYS  81          3HZ       LYS  81  -6.094  12.442   6.850
  626    H    GLY  82           H        GLY  82  -3.642  13.213   1.489
  627   1HA   GLY  82          2HA       GLY  82  -2.997  15.348   2.051
  628   2HA   GLY  82          1HA       GLY  82  -3.717  14.884   3.613
  629    H    GLY  83           H        GLY  83  -0.613  13.726   2.202
  630   1HA   GLY  83          2HA       GLY  83   1.550  14.044   2.874
  631   2HA   GLY  83          1HA       GLY  83   1.028  15.442   3.805
  632    H    LYS  84           HN       LYS  84  -0.718  12.611   4.815
  633    HA   LYS  84           HA       LYS  84   1.325  11.925   6.866
  634   1HB   LYS  84          2HB       LYS  84  -1.583  12.644   7.398
  635   2HB   LYS  84          1HB       LYS  84  -0.457  12.051   8.602
  636   1HG   LYS  84          2HG       LYS  84  -0.243  14.690   7.089
  637   2HG   LYS  84          1HG       LYS  84  -0.858  14.523   8.719
  638   1HD   LYS  84          1HD       LYS  84   1.988  13.617   8.088
  639   2HD   LYS  84          2HD       LYS  84   1.601  15.311   8.288
  640   1HE   LYS  84          2HE       LYS  84   2.409  14.430  10.380
  641   2HE   LYS  84          1HE       LYS  84   0.717  14.916  10.555
  642   1HZ   LYS  84          1HZ       LYS  84   1.649  12.162  10.120
  643   2HZ   LYS  84          2HZ       LYS  84   1.231  12.804  11.580
  644   3HZ   LYS  84          3HZ       LYS  84   0.094  12.638  10.404
  645    H    LYS  85           HN       LYS  85   0.689  10.048   8.124
  646    HA   LYS  85           HA       LYS  85  -0.434   7.949   6.366
  647   1HB   LYS  85          1HB       LYS  85   1.859   7.772   7.587
  648   2HB   LYS  85          2HB       LYS  85   0.884   7.506   9.042
  649   1HG   LYS  85          1HG       LYS  85  -0.261   5.581   7.793
  650   2HG   LYS  85          2HG       LYS  85   0.780   5.928   6.420
  651   1HD   LYS  85          2HD       LYS  85   1.722   4.067   7.571
  652   2HD   LYS  85          1HD       LYS  85   2.791   5.447   7.815
  653   1HE   LYS  85          2HE       LYS  85   2.527   4.163   9.893
  654   2HE   LYS  85          1HE       LYS  85   1.815   5.768  10.099
  655   1HZ   LYS  85          1HZ       LYS  85   0.310   3.332   9.464
  656   2HZ   LYS  85          2HZ       LYS  85  -0.327   4.827   9.738
  657   3HZ   LYS  85          3HZ       LYS  85   0.430   4.023  10.959
  658    H    CYS  86           H        CYS  86  -2.153   6.668   7.147
  659    HA   CYS  86           HA       CYS  86  -3.905   7.974   9.189
  660   1HB   CYS  86          2HB       CYS  86  -4.757   7.575   6.845
  661   2HB   CYS  86          1HB       CYS  86  -4.603   5.841   7.120
  662    HG   CYS  86           HG       CYS  86  -6.932   5.927   7.679
  663    H    GLU  87           HN       GLU  87  -3.019   4.708   8.030
  664    HA   GLU  87           HA       GLU  87  -2.237   3.660  10.557
  665   1HB   GLU  87          1HB       GLU  87  -4.235   1.852  10.436
  666   2HB   GLU  87          2HB       GLU  87  -4.301   3.321  11.385
  667   1HG   GLU  87          2HG       GLU  87  -6.386   2.822  10.185
  668   2HG   GLU  87          1HG       GLU  87  -5.740   4.416   9.863
  669    H    THR  88           H        THR  88  -2.576   0.881   9.939
  670    HA   THR  88           HA       THR  88  -1.682   0.498   7.229
  671    HB   THR  88           HB       THR  88   0.387   1.282   8.359
  672    HG1  THR  88           HG1      THR  88   0.393  -0.535   6.826
  673   1HG2  THR  88          1HG2      THR  88  -0.131   0.607  10.697
  674   2HG2  THR  88          2HG2      THR  88   1.431  -0.030  10.159
  675   3HG2  THR  88          3HG2      THR  88   0.025  -1.104  10.236
  676    H    ILE  89           H        ILE  89  -1.111  -1.979   7.002
  677    HA   ILE  89           HA       ILE  89  -2.557  -3.704   8.907
  678    HB   ILE  89           HB       ILE  89  -3.085  -3.972   5.917
  679   1HG1  ILE  89          2HG1      ILE  89  -4.947  -2.564   7.849
  680   2HG1  ILE  89          1HG1      ILE  89  -3.980  -1.730   6.613
  681   1HG2  ILE  89          1HG2      ILE  89  -4.561  -4.951   8.411
  682   2HG2  ILE  89          2HG2      ILE  89  -4.973  -5.366   6.740
  683   3HG2  ILE  89          3HG2      ILE  89  -3.462  -5.930   7.425
  684   1HD1  ILE  89          1HD1      ILE  89  -5.076  -3.020   4.823
  685   2HD1  ILE  89          2HD1      ILE  89  -6.195  -3.708   6.019
  686   3HD1  ILE  89          3HD1      ILE  89  -6.171  -1.965   5.734
  687    H    ILE  90           H        ILE  90  -1.605  -5.825   8.894
  688    HA   ILE  90           HA       ILE  90   1.005  -6.031   7.531
  689    HB   ILE  90           HB       ILE  90  -0.476  -7.971   9.361
  690   1HG1  ILE  90          1HG1      ILE  90   1.781  -5.981   9.924
  691   2HG1  ILE  90          2HG1      ILE  90   0.112  -5.839  10.489
  692   1HG2  ILE  90          1HG2      ILE  90   1.183  -9.088   7.865
  693   2HG2  ILE  90          2HG2      ILE  90   1.718  -9.113   9.531
  694   3HG2  ILE  90          3HG2      ILE  90   2.429  -7.942   8.399
  695   1HD1  ILE  90          1HD1      ILE  90   0.392  -7.996  11.749
  696   2HD1  ILE  90          2HD1      ILE  90   2.132  -7.923  11.367
  697   3HD1  ILE  90          3HD1      ILE  90   1.382  -6.638  12.319
  698    H    GLY  91           H        GLY  91   1.358  -7.442   5.756
  699   1HA   GLY  91          1HA       GLY  91  -1.049  -8.157   4.216
  700   2HA   GLY  91          2HA       GLY  91   0.606  -8.317   3.686
  701    H    ALA  92           H        ALA  92   0.603 -10.528   3.040
  702    HA   ALA  92           HA       ALA  92   0.250 -12.768   3.106
  703   1HB   ALA  92          1HB       ALA  92   2.123 -12.358   4.806
  704   2HB   ALA  92          2HB       ALA  92   1.225 -13.876   5.005
  705   3HB   ALA  92          3HB       ALA  92   0.906 -12.505   6.078
  706    H    VAL  93           H        VAL  93  -2.207 -11.348   3.316
  707    HA   VAL  93           HA       VAL  93  -3.806 -13.038   5.184
  708    HB   VAL  93           HB       VAL  93  -5.414 -10.887   4.547
  709   1HG1  VAL  93          1HG1      VAL  93  -3.497  -9.557   3.645
  710   2HG1  VAL  93          2HG1      VAL  93  -4.289  -8.848   5.069
  711   3HG1  VAL  93          3HG1      VAL  93  -2.746  -9.666   5.262
  712   1HG2  VAL  93          1HG2      VAL  93  -5.439 -11.924   6.606
  713   2HG2  VAL  93          2HG2      VAL  93  -5.214 -10.172   6.782
  714   3HG2  VAL  93          3HG2      VAL  93  -3.819 -11.271   7.013
  715    HA   PRO  94           HA       PRO  94  -6.389 -13.709   1.534
  716   1HB   PRO  94          2HB       PRO  94  -8.712 -13.791   3.379
  717   2HB   PRO  94          1HB       PRO  94  -8.229 -15.018   2.205
  718   1HG   PRO  94          2HG       PRO  94  -7.840 -15.427   4.909
  719   2HG   PRO  94          1HG       PRO  94  -6.583 -15.924   3.736
  720   1HD   PRO  94          2HD       PRO  94  -6.712 -13.354   5.329
  721   2HD   PRO  94          1HD       PRO  94  -5.344 -14.459   5.182
  722    H    LYS  95           HN       LYS  95  -7.566 -12.129   0.395
  723    HA   LYS  95           HA       LYS  95  -7.497  -9.536   1.387
  724   1HB   LYS  95          2HB       LYS  95  -7.525  -9.639  -0.964
  725   2HB   LYS  95          1HB       LYS  95  -8.680 -10.981  -1.009
  726   1HG   LYS  95          2HG       LYS  95 -10.547  -9.427  -0.575
  727   2HG   LYS  95          1HG       LYS  95  -9.403  -8.065  -0.591
  728   1HD   LYS  95          2HD       LYS  95  -8.854  -8.537  -2.933
  729   2HD   LYS  95          1HD       LYS  95  -9.789 -10.042  -2.891
  730   1HE   LYS  95          2HE       LYS  95 -11.872  -8.744  -2.478
  731   2HE   LYS  95          1HE       LYS  95 -10.946  -7.234  -2.578
  732   1HZ   LYS  95          1HZ       LYS  95 -12.022  -7.811  -4.635
  733   2HZ   LYS  95          2HZ       LYS  95 -10.386  -7.794  -4.815
  734   3HZ   LYS  95          3HZ       LYS  95 -11.188  -9.232  -4.721
  735    H    ALA  96           H        ALA  96  -9.997 -11.927   1.829
  736    HA   ALA  96           HA       ALA  96 -12.265 -10.328   2.348
  737   1HB   ALA  96          1HB       ALA  96 -12.901 -12.073   3.987
  738   2HB   ALA  96          2HB       ALA  96 -12.271 -12.795   2.492
  739   3HB   ALA  96          3HB       ALA  96 -11.250 -12.728   3.948
  740    H    THR  97           H        THR  97  -9.440 -11.001   4.436
  741    HA   THR  97           HA       THR  97 -10.236  -9.563   6.739
  742    HB   THR  97           HB       THR  97  -7.348  -9.722   5.911
  743    HG1  THR  97           HG1      THR  97  -7.872 -11.647   5.182
  744   1HG2  THR  97          1HG2      THR  97  -7.107 -10.544   8.230
  745   2HG2  THR  97          2HG2      THR  97  -8.866 -10.541   8.433
  746   3HG2  THR  97          3HG2      THR  97  -7.993  -9.004   8.206
  747    H    ILE  98           H        ILE  98  -8.310  -8.658   3.870
  748    HA   ILE  98           HA       ILE  98  -7.626  -6.015   4.669
  749    HB   ILE  98           HB       ILE  98  -7.913  -7.282   1.891
  750   1HG1  ILE  98          2HG1      ILE  98  -6.166  -8.329   3.271
  751   2HG1  ILE  98          1HG1      ILE  98  -5.528  -7.446   1.887
  752   1HG2  ILE  98          1HG2      ILE  98  -8.106  -4.926   1.537
  753   2HG2  ILE  98          2HG2      ILE  98  -6.884  -4.548   2.760
  754   3HG2  ILE  98          3HG2      ILE  98  -6.407  -5.316   1.234
  755   1HD1  ILE  98          1HD1      ILE  98  -4.094  -7.011   3.749
  756   2HD1  ILE  98          2HD1      ILE  98  -5.449  -6.565   4.796
  757   3HD1  ILE  98          3HD1      ILE  98  -4.970  -5.515   3.441
  758    H    VAL  99           H        VAL  99 -10.355  -7.192   2.620
  759    HA   VAL  99           HA       VAL  99 -11.517  -4.680   2.096
  760    HB   VAL  99           HB       VAL  99 -12.772  -7.431   2.451
  761   1HG1  VAL  99          1HG1      VAL  99 -14.012  -4.877   1.324
  762   2HG1  VAL  99          2HG1      VAL  99 -14.697  -6.503   1.132
  763   3HG1  VAL  99          3HG1      VAL  99 -14.578  -5.789   2.741
  764   1HG2  VAL  99          1HG2      VAL  99 -12.771  -7.450  -0.013
  765   2HG2  VAL  99          2HG2      VAL  99 -11.128  -7.143   0.567
  766   3HG2  VAL  99          3HG2      VAL  99 -12.104  -5.804  -0.054
  767    H    GLN 100           H        GLN 100 -12.419  -6.983   4.749
  768    HA   GLN 100           HA       GLN 100 -14.282  -5.283   6.029
  769   1HB   GLN 100          2HB       GLN 100 -12.319  -7.269   7.207
  770   2HB   GLN 100          1HB       GLN 100 -13.629  -6.531   8.131
  771   1HG   GLN 100          1HG       GLN 100 -15.334  -7.628   6.909
  772   2HG   GLN 100          2HG       GLN 100 -14.237  -8.099   5.597
  773   1HE2  GLN 100          2HE2      GLN 100 -12.325  -9.377   6.247
  774   2HE2  GLN 100          1HE2      GLN 100 -12.410 -10.497   7.600
  775    H    THR 101           H        THR 101 -10.794  -5.684   6.737
  776    HA   THR 101           HA       THR 101 -10.565  -3.685   8.702
  777    HB   THR 101           HB       THR 101  -8.475  -4.439   6.618
  778    HG1  THR 101           HG1      THR 101  -9.170  -6.250   7.691
  779   1HG2  THR 101          1HG2      THR 101  -7.782  -2.463   7.865
  780   2HG2  THR 101          2HG2      THR 101  -8.260  -3.208   9.408
  781   3HG2  THR 101          3HG2      THR 101  -6.895  -3.867   8.487
  782    H    VAL 102           H        VAL 102 -10.247  -3.237   5.135
  783    HA   VAL 102           HA       VAL 102  -9.621  -0.460   5.203
  784    HB   VAL 102           HB       VAL 102 -10.850  -2.289   3.105
  785   1HG1  VAL 102          1HG1      VAL 102  -8.386  -2.485   3.721
  786   2HG1  VAL 102          2HG1      VAL 102  -8.690  -2.052   2.029
  787   3HG1  VAL 102          3HG1      VAL 102  -8.186  -0.809   3.194
  788   1HG2  VAL 102          1HG2      VAL 102 -10.459  -0.453   1.457
  789   2HG2  VAL 102          2HG2      VAL 102 -10.182   0.669   2.804
  790   3HG2  VAL 102          3HG2      VAL 102 -11.774  -0.091   2.576
  791    H    GLU 103           HN       GLU 103 -12.757  -2.163   4.891
  792    HA   GLU 103           HA       GLU 103 -14.358   0.188   4.777
  793   1HB   GLU 103          2HB       GLU 103 -14.955  -2.610   5.851
  794   2HB   GLU 103          1HB       GLU 103 -16.160  -1.353   5.595
  795   1HG   GLU 103          2HG       GLU 103 -14.390  -2.532   3.398
  796   2HG   GLU 103          1HG       GLU 103 -16.072  -2.973   3.707
  797    H    LYS 104           HN       LYS 104 -13.253  -1.735   7.540
  798    HA   LYS 104           HA       LYS 104 -14.491  -0.314   9.636
  799   1HB   LYS 104          1HB       LYS 104 -13.472  -2.031  10.648
  800   2HB   LYS 104          2HB       LYS 104 -12.362  -2.267   9.328
  801   1HG   LYS 104          2HG       LYS 104 -11.176  -2.085  11.316
  802   2HG   LYS 104          1HG       LYS 104 -10.754  -0.708  10.322
  803   1HD   LYS 104          2HD       LYS 104 -11.966   0.817  11.750
  804   2HD   LYS 104          1HD       LYS 104 -12.896  -0.488  12.493
  805   1HE   LYS 104          2HE       LYS 104  -9.883  -0.071  12.806
  806   2HE   LYS 104          1HE       LYS 104 -11.108   0.514  13.941
  807   1HZ   LYS 104          1HZ       LYS 104 -11.788  -1.747  14.296
  808   2HZ   LYS 104          2HZ       LYS 104 -10.614  -2.301  13.281
  809   3HZ   LYS 104          3HZ       LYS 104 -10.199  -1.531  14.674
  810    H    TYR 105           H        TYR 105 -11.275   0.326   8.117
  811    HA   TYR 105           HA       TYR 105 -10.846   2.707   9.697
  812   1HB   TYR 105          1HB       TYR 105  -9.679   1.962   6.990
  813   2HB   TYR 105          2HB       TYR 105  -9.057   3.167   8.119
  814    HD1  TYR 105           HD1      TYR 105  -7.657   0.706   6.820
  815    HD2  TYR 105           HD2      TYR 105  -9.338   1.466  10.723
  816    HE1  TYR 105           HE1      TYR 105  -5.811  -0.519   7.869
  817    HE2  TYR 105           HE2      TYR 105  -7.601   0.048  11.740
  818    HH   TYR 105           HH       TYR 105  -4.747  -1.101   9.917
  819    H    LEU 106           H        LEU 106 -12.204   2.229   6.419
  820    HA   LEU 106           HA       LEU 106 -12.594   5.143   6.072
  821   1HB   LEU 106          2HB       LEU 106 -13.253   2.800   4.259
  822   2HB   LEU 106          1HB       LEU 106 -13.422   4.526   3.893
  823    HG   LEU 106           HG       LEU 106 -10.864   2.923   4.302
  824   1HD1  LEU 106          1HD2      LEU 106  -9.607   5.076   3.996
  825   2HD1  LEU 106          2HD2      LEU 106 -10.388   4.966   5.572
  826   3HD1  LEU 106          3HD2      LEU 106 -11.110   5.971   4.290
  827   1HD2  LEU 106          1HD1      LEU 106 -10.435   3.847   2.088
  828   2HD2  LEU 106          2HD1      LEU 106 -11.914   4.846   2.203
  829   3HD2  LEU 106          3HD1      LEU 106 -12.048   3.067   2.134
  830    H    ASN 107           H        ASN 107 -13.692   5.120   7.898
  831    HA   ASN 107           HA       ASN 107 -16.643   4.969   7.602
  832   1HB   ASN 107          2HB       ASN 107 -15.674   2.920   8.887
  833   2HB   ASN 107          1HB       ASN 107 -15.294   4.062  10.179
  834   1HD2  ASN 107          2HD2      ASN 107 -17.711   5.704   9.967
  835   2HD2  ASN 107          1HD2      ASN 107 -19.052   4.672  10.486
  Start of MODEL   21
    1   1H    MET   1          1H        MET   1  -0.288  -2.067 -11.189
    2   2H    MET   1          2H        MET   1  -1.177  -3.423 -11.276
    3   3H    MET   1          3H        MET   1   0.298  -3.374 -12.046
    4    HA   MET   1           HA       MET   1  -0.496  -1.723 -13.561
    5   1HB   MET   1          2HB       MET   1  -0.847  -4.034 -14.239
    6   2HB   MET   1          1HB       MET   1  -2.359  -4.135 -13.340
    7   1HG   MET   1          1HG       MET   1  -3.349  -2.393 -14.823
    8   2HG   MET   1          2HG       MET   1  -1.814  -2.284 -15.699
    9   1HE   MET   1          1HE       MET   1  -4.806  -2.774 -16.877
   10   2HE   MET   1          2HE       MET   1  -3.349  -2.527 -17.875
   11   3HE   MET   1          3HE       MET   1  -4.406  -3.928 -18.170
   12    H    GLU   2           HN       GLU   2  -3.649  -2.917 -12.194
   13    HA   GLU   2           HA       GLU   2  -4.740  -0.247 -12.217
   14   1HB   GLU   2          2HB       GLU   2  -5.592  -2.743 -10.688
   15   2HB   GLU   2          1HB       GLU   2  -6.568  -1.282 -10.877
   16   1HG   GLU   2          1HG       GLU   2  -5.675  -3.165 -13.115
   17   2HG   GLU   2          2HG       GLU   2  -7.293  -3.027 -12.429
   18    H    ALA   3           H        ALA   3  -3.238  -2.319  -9.756
   19    HA   ALA   3           HA       ALA   3  -3.045  -0.156  -7.774
   20   1HB   ALA   3          1HB       ALA   3  -1.649  -2.860  -8.009
   21   2HB   ALA   3          2HB       ALA   3  -3.074  -2.518  -7.013
   22   3HB   ALA   3          3HB       ALA   3  -1.530  -1.743  -6.628
   23    H    GLY   4           H        GLY   4  -1.446   1.437  -7.974
   24   1HA   GLY   4          2HA       GLY   4   0.357   1.365 -10.244
   25   2HA   GLY   4          1HA       GLY   4   0.328   2.564  -8.942
   26    H    ALA   5           H        ALA   5   2.738   1.643  -9.971
   27    HA   ALA   5           HA       ALA   5   3.888  -0.037  -7.778
   28   1HB   ALA   5          1HB       ALA   5   5.793  -0.361  -9.286
   29   2HB   ALA   5          2HB       ALA   5   4.958   0.548 -10.566
   30   3HB   ALA   5          3HB       ALA   5   4.294  -1.003  -9.993
   31    H    VAL   6           H        VAL   6   4.971   1.234  -6.315
   32    HA   VAL   6           HA       VAL   6   5.809   3.982  -7.178
   33    HB   VAL   6           HB       VAL   6   5.485   4.468  -4.608
   34   1HG1  VAL   6          1HG1      VAL   6   4.729   2.241  -3.925
   35   2HG1  VAL   6          2HG1      VAL   6   3.344   2.336  -5.015
   36   3HG1  VAL   6          3HG1      VAL   6   3.485   3.452  -3.645
   37   1HG2  VAL   6          1HG2      VAL   6   3.235   5.331  -5.066
   38   2HG2  VAL   6          2HG2      VAL   6   3.210   4.429  -6.599
   39   3HG2  VAL   6          3HG2      VAL   6   4.398   5.729  -6.335
   40    H    ASN   7           H        ASN   7   7.462   4.928  -5.926
   41    HA   ASN   7           HA       ASN   7   9.406   3.182  -4.611
   42   1HB   ASN   7          1HB       ASN   7  10.259   3.240  -6.892
   43   2HB   ASN   7          2HB       ASN   7   9.924   4.984  -7.029
   44   1HD2  ASN   7          1HD2      ASN   7  11.905   2.570  -5.328
   45   2HD2  ASN   7          2HD2      ASN   7  13.256   3.611  -4.971
   46    H    ASP   8           HN       ASP   8  11.024   4.726  -3.641
   47    HA   ASP   8           HA       ASP   8  10.038   6.560  -1.839
   48   1HB   ASP   8          2HB       ASP   8  12.391   5.669  -2.008
   49   2HB   ASP   8          1HB       ASP   8  12.705   6.773  -3.336
   50    H    ASP   9           HN       ASP   9  11.317   7.252  -5.043
   51    HA   ASP   9           HA       ASP   9  10.983  10.039  -5.195
   52   1HB   ASP   9          2HB       ASP   9  12.166   8.700  -6.873
   53   2HB   ASP   9          1HB       ASP   9  10.680   7.924  -7.389
   54    H    THR  10           H        THR  10   8.730   7.680  -6.674
   55    HA   THR  10           HA       THR  10   6.735   9.629  -7.283
   56    HB   THR  10           HB       THR  10   5.401   7.478  -7.765
   57    HG1  THR  10           HG1      THR  10   6.884   5.645  -7.863
   58   1HG2  THR  10          1HG2      THR  10   8.178   7.753  -9.011
   59   2HG2  THR  10          2HG2      THR  10   6.745   8.688  -9.479
   60   3HG2  THR  10          3HG2      THR  10   6.779   6.935  -9.731
   61    H    PHE  11           H        PHE  11   7.047   7.296  -4.692
   62    HA   PHE  11           HA       PHE  11   4.715   7.119  -3.346
   63   1HB   PHE  11          1HB       PHE  11   6.804   6.107  -2.660
   64   2HB   PHE  11          2HB       PHE  11   7.515   7.652  -2.287
   65    HD1  PHE  11           HD1      PHE  11   4.834   5.282  -1.245
   66    HD2  PHE  11           HD2      PHE  11   7.524   8.438  -0.081
   67    HE1  PHE  11           HE1      PHE  11   4.235   4.912   1.125
   68    HE2  PHE  11           HE2      PHE  11   7.056   7.952   2.291
   69    HZ   PHE  11           HZ       PHE  11   5.386   6.216   2.911
   70    H    LYS  12           HN       LYS  12   7.001   9.718  -3.037
   71    HA   LYS  12           HA       LYS  12   5.873  11.444  -1.169
   72   1HB   LYS  12          1HB       LYS  12   7.265  12.003  -3.815
   73   2HB   LYS  12          2HB       LYS  12   6.736  13.297  -2.756
   74   1HG   LYS  12          2HG       LYS  12   8.091  12.284  -0.883
   75   2HG   LYS  12          1HG       LYS  12   8.512  10.924  -1.935
   76   1HD   LYS  12          1HD       LYS  12   9.663  12.564  -3.491
   77   2HD   LYS  12          2HD       LYS  12   9.350  13.828  -2.283
   78   1HE   LYS  12          1HE       LYS  12  11.564  13.038  -1.817
   79   2HE   LYS  12          2HE       LYS  12  10.538  12.306  -0.574
   80   1HZ   LYS  12          1HZ       LYS  12  11.521  11.019  -3.029
   81   2HZ   LYS  12          2HZ       LYS  12  12.009  10.697  -1.488
   82   3HZ   LYS  12          3HZ       LYS  12  10.490  10.302  -1.971
   83    H    ASN  13           H        ASN  13   5.101  11.538  -4.688
   84    HA   ASN  13           HA       ASN  13   3.018  13.561  -4.178
   85   1HB   ASN  13          2HB       ASN  13   4.494  13.417  -6.277
   86   2HB   ASN  13          1HB       ASN  13   3.555  12.032  -6.771
   87   1HD2  ASN  13          1HD2      ASN  13   3.146  15.420  -5.600
   88   2HD2  ASN  13          2HD2      ASN  13   1.750  15.758  -6.616
   89    H    VAL  14           H        VAL  14   3.366  10.230  -5.171
   90    HA   VAL  14           HA       VAL  14   0.634   9.969  -5.916
   91    HB   VAL  14           HB       VAL  14   2.821   7.880  -5.482
   92   1HG1  VAL  14          1HG1      VAL  14   1.633   9.112  -8.011
   93   2HG1  VAL  14          2HG1      VAL  14   2.906   7.879  -7.959
   94   3HG1  VAL  14          3HG1      VAL  14   3.224   9.502  -7.335
   95   1HG2  VAL  14          1HG2      VAL  14   0.707   6.651  -5.311
   96   2HG2  VAL  14          2HG2      VAL  14   0.067   7.488  -6.741
   97   3HG2  VAL  14          3HG2      VAL  14   1.416   6.351  -6.896
   98    H    VAL  15           H        VAL  15   2.383   9.247  -2.940
   99    HA   VAL  15           HA       VAL  15  -0.021   7.949  -1.725
  100    HB   VAL  15           HB       VAL  15   2.910   7.639  -0.947
  101   1HG1  VAL  15          1HG1      VAL  15   1.336   7.245   0.872
  102   2HG1  VAL  15          2HG1      VAL  15   0.426   6.104  -0.137
  103   3HG1  VAL  15          3HG1      VAL  15   2.101   5.757   0.349
  104   1HG2  VAL  15          1HG2      VAL  15   2.829   5.489  -2.105
  105   2HG2  VAL  15          2HG2      VAL  15   2.519   6.767  -3.249
  106   3HG2  VAL  15          3HG2      VAL  15   1.165   5.811  -2.630
  107    H    LEU  16           H        LEU  16   2.884   9.906  -0.753
  108    HA   LEU  16           HA       LEU  16   1.673  10.556   1.782
  109   1HB   LEU  16          1HB       LEU  16   3.874  12.106   0.361
  110   2HB   LEU  16          2HB       LEU  16   3.399  12.233   2.045
  111    HG   LEU  16           HG       LEU  16   4.634   9.788   0.704
  112   1HD1  LEU  16          1HD1      LEU  16   5.696  11.716   2.819
  113   2HD1  LEU  16          2HD1      LEU  16   6.157  11.729   1.108
  114   3HD1  LEU  16          3HD1      LEU  16   6.567  10.336   2.119
  115   1HD2  LEU  16          1HD2      LEU  16   4.788   8.961   3.114
  116   2HD2  LEU  16          2HD2      LEU  16   3.161   8.958   2.430
  117   3HD2  LEU  16          3HD2      LEU  16   3.652  10.244   3.560
  118    H    GLU  17           HN       GLU  17   2.283  12.849  -0.972
  119    HA   GLU  17           HA       GLU  17   0.269  14.654   0.123
  120   1HB   GLU  17          2HB       GLU  17   1.818  14.768  -2.498
  121   2HB   GLU  17          1HB       GLU  17   0.980  16.089  -1.685
  122   1HG   GLU  17          2HG       GLU  17   3.503  14.666  -0.726
  123   2HG   GLU  17          1HG       GLU  17   3.342  16.337  -1.261
  124    H    SER  18           H        SER  18  -0.988  12.239  -0.402
  125    HA   SER  18           HA       SER  18  -2.462  12.562  -2.961
  126   1HB   SER  18          2HB       SER  18  -1.657  10.308  -2.306
  127   2HB   SER  18          1HB       SER  18  -2.650  10.381  -0.834
  128    HG   SER  18           HG       SER  18  -4.410  10.125  -2.026
  129    H    SER  19           H        SER  19  -4.634  13.223  -2.958
  130    HA   SER  19           HA       SER  19  -5.616  14.666  -0.622
  131   1HB   SER  19          1HB       SER  19  -7.555  14.963  -2.332
  132   2HB   SER  19          2HB       SER  19  -5.975  15.662  -2.754
  133    HG   SER  19           HG       SER  19  -6.843  14.407  -4.489
  134    H    VAL  20           H        VAL  20  -6.712  12.027  -2.724
  135    HA   VAL  20           HA       VAL  20  -8.678  11.045  -0.804
  136    HB   VAL  20           HB       VAL  20  -9.030   9.261  -2.404
  137   1HG1  VAL  20          1HG2      VAL  20  -6.751   8.844  -3.239
  138   2HG1  VAL  20          2HG2      VAL  20  -7.861   9.169  -4.572
  139   3HG1  VAL  20          3HG2      VAL  20  -6.734  10.428  -4.043
  140   1HG2  VAL  20          1HG1      VAL  20  -8.813  11.965  -3.800
  141   2HG2  VAL  20          2HG1      VAL  20 -10.144  11.444  -2.743
  142   3HG2  VAL  20          3HG1      VAL  20  -9.851  10.611  -4.279
  143    HA   PRO  21           HA       PRO  21  -5.957   8.434   1.432
  144   1HB   PRO  21          2HB       PRO  21  -7.871   6.112   1.186
  145   2HB   PRO  21          1HB       PRO  21  -7.188   6.813   2.666
  146   1HG   PRO  21          1HG       PRO  21  -9.710   7.218   1.871
  147   2HG   PRO  21          2HG       PRO  21  -8.808   8.555   2.637
  148   1HD   PRO  21          1HD       PRO  21  -9.494   8.263  -0.329
  149   2HD   PRO  21          2HD       PRO  21  -9.329   9.689   0.727
  150    H    VAL  22           H        VAL  22  -4.560   6.662   1.294
  151    HA   VAL  22           HA       VAL  22  -4.501   4.975  -1.090
  152    HB   VAL  22           HB       VAL  22  -2.477   7.177  -0.779
  153   1HG1  VAL  22          1HG1      VAL  22  -1.389   6.134  -2.768
  154   2HG1  VAL  22          2HG1      VAL  22  -1.283   5.067  -1.360
  155   3HG1  VAL  22          3HG1      VAL  22  -2.503   4.756  -2.620
  156   1HG2  VAL  22          1HG2      VAL  22  -3.237   7.486  -3.234
  157   2HG2  VAL  22          2HG2      VAL  22  -4.487   7.834  -2.051
  158   3HG2  VAL  22          3HG2      VAL  22  -4.504   6.300  -2.926
  159    H    LEU  23           H        LEU  23  -3.875   2.949  -0.748
  160    HA   LEU  23           HA       LEU  23  -2.306   2.392   1.703
  161   1HB   LEU  23          1HB       LEU  23  -4.523   1.503   1.700
  162   2HB   LEU  23          2HB       LEU  23  -4.327   0.828   0.097
  163    HG   LEU  23           HG       LEU  23  -2.631  -0.187   2.352
  164   1HD1  LEU  23          1HD1      LEU  23  -1.817  -1.038   0.231
  165   2HD1  LEU  23          2HD1      LEU  23  -2.881  -2.303   0.825
  166   3HD1  LEU  23          3HD1      LEU  23  -3.462  -1.200  -0.419
  167   1HD2  LEU  23          1HD2      LEU  23  -5.389  -1.123   1.421
  168   2HD2  LEU  23          2HD2      LEU  23  -4.371  -1.966   2.603
  169   3HD2  LEU  23          3HD2      LEU  23  -5.028  -0.375   2.989
  170    H    VAL  24           H        VAL  24  -0.281   1.709   1.439
  171    HA   VAL  24           HA       VAL  24   0.528   0.674  -1.240
  172    HB   VAL  24           HB       VAL  24   2.684   1.459  -0.965
  173   1HG1  VAL  24          1HG2      VAL  24   1.051   3.186  -1.646
  174   2HG1  VAL  24          2HG2      VAL  24   0.897   3.699   0.052
  175   3HG1  VAL  24          3HG2      VAL  24   2.460   3.831  -0.786
  176   1HG2  VAL  24          1HG1      VAL  24   3.233   1.011   1.322
  177   2HG2  VAL  24          2HG1      VAL  24   3.482   2.724   1.036
  178   3HG2  VAL  24          3HG1      VAL  24   2.022   2.185   1.900
  179    H    ASP  25           HN       ASP  25   1.293  -1.338  -1.266
  180    HA   ASP  25           HA       ASP  25   1.809  -2.754   1.335
  181   1HB   ASP  25          2HB       ASP  25   0.310  -4.015  -0.083
  182   2HB   ASP  25          1HB       ASP  25   1.398  -3.813  -1.461
  183    H    PHE  26           H        PHE  26   3.926  -2.844   1.928
  184    HA   PHE  26           HA       PHE  26   6.037  -1.944   0.064
  185   1HB   PHE  26          2HB       PHE  26   5.999  -2.869   2.952
  186   2HB   PHE  26          1HB       PHE  26   7.488  -2.712   2.043
  187    HD1  PHE  26           HD1      PHE  26   8.584  -0.642   1.747
  188    HD2  PHE  26           HD2      PHE  26   4.495  -0.708   3.125
  189    HE1  PHE  26           HE1      PHE  26   8.769   1.734   2.424
  190    HE2  PHE  26           HE2      PHE  26   4.679   1.679   3.758
  191    HZ   PHE  26           HZ       PHE  26   6.807   2.894   3.452
  192    H    TRP  27           H        TRP  27   6.652  -3.411  -1.455
  193    HA   TRP  27           HA       TRP  27   6.634  -6.316  -0.743
  194   1HB   TRP  27          1HB       TRP  27   5.783  -6.848  -2.904
  195   2HB   TRP  27          2HB       TRP  27   4.722  -5.618  -2.242
  196    HD1  TRP  27           HD1      TRP  27   5.244  -3.093  -3.250
  197    HE1  TRP  27           HE1      TRP  27   6.144  -2.308  -5.563
  198    HE3  TRP  27           HE3      TRP  27   6.902  -7.571  -5.007
  199    HZ2  TRP  27           HZ2      TRP  27   7.588  -3.486  -7.746
  200    HZ3  TRP  27           HZ3      TRP  27   8.026  -7.726  -7.211
  201    HH2  TRP  27           HH2      TRP  27   8.379  -5.692  -8.585
  202    H    ALA  28           H        ALA  28   7.740  -7.430  -2.800
  203    HA   ALA  28           HA       ALA  28   9.893  -6.138  -4.059
  204   1HB   ALA  28          1HB       ALA  28  10.940  -6.287  -1.734
  205   2HB   ALA  28          2HB       ALA  28  11.786  -7.315  -2.882
  206   3HB   ALA  28          3HB       ALA  28  10.636  -8.039  -1.757
  207    HA   PRO  29           HA       PRO  29   8.990  -9.807  -6.412
  208   1HB   PRO  29          1HB       PRO  29  11.419 -10.728  -7.371
  209   2HB   PRO  29          2HB       PRO  29  10.518  -9.324  -8.023
  210   1HG   PRO  29          1HG       PRO  29  12.812  -9.301  -6.047
  211   2HG   PRO  29          2HG       PRO  29  12.586  -8.258  -7.480
  212   1HD   PRO  29          1HD       PRO  29  11.932  -7.354  -5.022
  213   2HD   PRO  29          2HD       PRO  29  10.840  -7.020  -6.378
  214    H    TRP  30           H        TRP  30  11.723 -10.161  -4.157
  215    HA   TRP  30           HA       TRP  30  11.330 -13.007  -3.754
  216   1HB   TRP  30          1HB       TRP  30  12.913 -12.609  -1.857
  217   2HB   TRP  30          2HB       TRP  30  13.497 -12.133  -3.443
  218    HD1  TRP  30           HD1      TRP  30  14.240  -9.695  -3.799
  219    HE1  TRP  30           HE1      TRP  30  14.566  -7.656  -2.268
  220    HE3  TRP  30           HE3      TRP  30  11.626 -11.324   0.306
  221    HZ2  TRP  30           HZ2      TRP  30  13.748  -6.820   0.350
  222    HZ3  TRP  30           HZ3      TRP  30  11.418  -9.876   2.294
  223    HH2  TRP  30           HH2      TRP  30  12.398  -7.596   2.301
  224    H    CYS  31           H        CYS  31   9.381 -10.347  -2.781
  225    HA   CYS  31           HA       CYS  31   8.774 -11.512  -0.108
  226   1HB   CYS  31          2HB       CYS  31   8.650  -9.123  -0.273
  227   2HB   CYS  31          1HB       CYS  31   7.463  -9.237  -1.574
  228    H    GLY  32           H        GLY  32   8.295 -13.619  -0.903
  229   1HA   GLY  32          1HA       GLY  32   6.501 -14.602  -2.644
  230   2HA   GLY  32          2HA       GLY  32   6.628 -15.266  -1.014
  231    HA   PRO  33           HA       PRO  33   2.585 -13.990   0.323
  232   1HB   PRO  33          2HB       PRO  33   3.758 -11.623   1.792
  233   2HB   PRO  33          1HB       PRO  33   2.473 -12.741   2.331
  234   1HG   PRO  33          2HG       PRO  33   5.003 -13.125   3.203
  235   2HG   PRO  33          1HG       PRO  33   4.043 -14.512   2.608
  236   1HD   PRO  33          1HD       PRO  33   6.180 -12.931   1.148
  237   2HD   PRO  33          2HD       PRO  33   5.945 -14.702   1.199
  238    H    CYS  34           H        CYS  34   4.570 -11.163  -0.444
  239    HA   CYS  34           HA       CYS  34   2.529  -9.301  -1.166
  240   1HB   CYS  34          2HB       CYS  34   5.318  -9.295  -2.254
  241   2HB   CYS  34          1HB       CYS  34   4.116  -8.017  -2.138
  242    H    ARG  35           HN       ARG  35   4.636 -11.490  -3.111
  243    HA   ARG  35           HA       ARG  35   3.477 -10.857  -5.644
  244   1HB   ARG  35          1HB       ARG  35   4.967 -13.305  -4.607
  245   2HB   ARG  35          2HB       ARG  35   4.506 -13.074  -6.285
  246   1HG   ARG  35          2HG       ARG  35   6.405 -11.258  -4.715
  247   2HG   ARG  35          1HG       ARG  35   6.844 -12.495  -5.890
  248   1HD   ARG  35          2HD       ARG  35   6.959 -10.549  -7.157
  249   2HD   ARG  35          1HD       ARG  35   5.372 -11.211  -7.580
  250    HE   ARG  35           HE       ARG  35   5.242  -9.375  -5.344
  251   1HH1  ARG  35          2HH2      ARG  35   5.536  -9.446  -8.858
  252   2HH1  ARG  35          1HH2      ARG  35   4.675  -7.952  -9.112
  253   1HH2  ARG  35          2HH1      ARG  35   4.111  -7.418  -5.648
  254   2HH2  ARG  35          1HH1      ARG  35   3.883  -6.762  -7.248
  255    H    ILE  36           H        ILE  36   2.602 -13.506  -3.356
  256    HA   ILE  36           HA       ILE  36   0.659 -14.483  -5.270
  257    HB   ILE  36           HB       ILE  36  -0.263 -15.829  -3.476
  258   1HG1  ILE  36          1HG1      ILE  36   1.780 -14.568  -1.632
  259   2HG1  ILE  36          2HG1      ILE  36   0.063 -14.116  -1.617
  260   1HG2  ILE  36          1HG2      ILE  36   1.769 -17.176  -3.155
  261   2HG2  ILE  36          2HG2      ILE  36   1.795 -16.456  -4.769
  262   3HG2  ILE  36          3HG2      ILE  36   2.800 -15.772  -3.483
  263   1HD1  ILE  36          1HD1      ILE  36   1.166 -16.850  -0.979
  264   2HD1  ILE  36          2HD1      ILE  36   0.445 -15.667   0.132
  265   3HD1  ILE  36          3HD1      ILE  36  -0.565 -16.428  -1.117
  266    H    ILE  37           H        ILE  37   0.286 -12.131  -2.538
  267    HA   ILE  37           HA       ILE  37  -2.556 -11.859  -3.184
  268    HB   ILE  37           HB       ILE  37  -2.650 -10.076  -1.620
  269   1HG1  ILE  37          2HG1      ILE  37   0.382 -10.141  -1.566
  270   2HG1  ILE  37          1HG1      ILE  37  -0.640  -8.812  -2.080
  271   1HG2  ILE  37          1HG2      ILE  37  -0.813 -12.214  -0.468
  272   2HG2  ILE  37          2HG2      ILE  37  -2.512 -12.498  -0.894
  273   3HG2  ILE  37          3HG2      ILE  37  -2.105 -11.321   0.353
  274   1HD1  ILE  37          1HD1      ILE  37  -1.539  -8.674   0.278
  275   2HD1  ILE  37          2HD1      ILE  37  -0.324  -9.888   0.749
  276   3HD1  ILE  37          3HD1      ILE  37   0.193  -8.321   0.116
  277    H    ALA  38           H        ALA  38   0.333 -10.269  -4.415
  278    HA   ALA  38           HA       ALA  38  -0.324  -7.913  -5.321
  279   1HB   ALA  38          1HB       ALA  38   1.076  -8.262  -7.311
  280   2HB   ALA  38          2HB       ALA  38   1.781  -9.029  -5.888
  281   3HB   ALA  38          3HB       ALA  38   0.960 -10.013  -7.116
  282    HA   PRO  39           HA       PRO  39  -2.810  -8.847  -9.230
  283   1HB   PRO  39          1HB       PRO  39  -4.131 -11.166  -9.686
  284   2HB   PRO  39          2HB       PRO  39  -2.408 -10.947 -10.103
  285   1HG   PRO  39          1HG       PRO  39  -3.573 -12.354  -7.712
  286   2HG   PRO  39          2HG       PRO  39  -2.188 -12.849  -8.720
  287   1HD   PRO  39          1HD       PRO  39  -2.091 -11.513  -6.301
  288   2HD   PRO  39          2HD       PRO  39  -0.737 -11.498  -7.468
  289    H    VAL  40           H        VAL  40  -3.777 -10.225  -6.133
  290    HA   VAL  40           HA       VAL  40  -6.598  -9.597  -6.384
  291    HB   VAL  40           HB       VAL  40  -5.046 -10.095  -3.813
  292   1HG1  VAL  40          1HG1      VAL  40  -7.190 -10.958  -3.050
  293   2HG1  VAL  40          2HG1      VAL  40  -7.902 -10.694  -4.655
  294   3HG1  VAL  40          3HG1      VAL  40  -7.401  -9.304  -3.665
  295   1HG2  VAL  40          1HG2      VAL  40  -6.149 -12.153  -5.774
  296   2HG2  VAL  40          2HG2      VAL  40  -4.456 -11.987  -5.256
  297   3HG2  VAL  40          3HG2      VAL  40  -5.680 -12.504  -4.098
  298    H    VAL  41           H        VAL  41  -3.655  -8.175  -4.896
  299    HA   VAL  41           HA       VAL  41  -4.802  -5.792  -3.837
  300    HB   VAL  41           HB       VAL  41  -2.054  -6.188  -5.114
  301   1HG1  VAL  41          1HG1      VAL  41  -1.201  -6.588  -2.902
  302   2HG1  VAL  41          2HG1      VAL  41  -2.534  -7.720  -3.143
  303   3HG1  VAL  41          3HG1      VAL  41  -2.783  -6.273  -2.167
  304   1HG2  VAL  41          1HG2      VAL  41  -2.505  -3.813  -4.919
  305   2HG2  VAL  41          2HG2      VAL  41  -3.043  -4.018  -3.232
  306   3HG2  VAL  41          3HG2      VAL  41  -1.350  -4.287  -3.674
  307    H    ASP  42           HN       ASP  42  -3.596  -6.592  -7.117
  308    HA   ASP  42           HA       ASP  42  -4.152  -4.068  -8.271
  309   1HB   ASP  42          2HB       ASP  42  -2.869  -6.232  -9.173
  310   2HB   ASP  42          1HB       ASP  42  -4.413  -6.562  -9.955
  311    H    GLU  43           HN       GLU  43  -6.250  -7.059  -8.426
  312    HA   GLU  43           HA       GLU  43  -8.313  -5.702  -9.802
  313   1HB   GLU  43          1HB       GLU  43  -9.645  -7.504  -9.450
  314   2HB   GLU  43          2HB       GLU  43  -8.040  -8.222  -9.347
  315   1HG   GLU  43          1HG       GLU  43  -8.261  -8.132  -6.836
  316   2HG   GLU  43          2HG       GLU  43  -9.917  -7.540  -7.013
  317    H    ILE  44           H        ILE  44  -7.728  -5.947  -6.258
  318    HA   ILE  44           HA       ILE  44 -10.022  -4.487  -5.447
  319    HB   ILE  44           HB       ILE  44  -7.245  -4.863  -4.252
  320   1HG1  ILE  44          2HG1      ILE  44 -10.027  -5.924  -3.549
  321   2HG1  ILE  44          1HG1      ILE  44  -8.855  -6.816  -4.501
  322   1HG2  ILE  44          1HG2      ILE  44  -8.158  -2.708  -3.400
  323   2HG2  ILE  44          2HG2      ILE  44  -8.123  -3.936  -2.144
  324   3HG2  ILE  44          3HG2      ILE  44  -9.659  -3.552  -2.947
  325   1HD1  ILE  44          1HD1      ILE  44  -8.836  -7.641  -2.277
  326   2HD1  ILE  44          2HD1      ILE  44  -8.453  -6.050  -1.602
  327   3HD1  ILE  44          3HD1      ILE  44  -7.278  -6.877  -2.655
  328    H    ALA  45           H        ALA  45  -6.762  -3.322  -6.483
  329    HA   ALA  45           HA       ALA  45  -7.271  -0.557  -6.171
  330   1HB   ALA  45          1HB       ALA  45  -5.867  -1.728  -8.597
  331   2HB   ALA  45          2HB       ALA  45  -5.580  -0.188  -7.808
  332   3HB   ALA  45          3HB       ALA  45  -5.113  -1.712  -7.007
  333    H    GLY  46           H        GLY  46  -8.081  -2.782  -8.836
  334   1HA   GLY  46          1HA       GLY  46  -9.336  -1.093 -10.675
  335   2HA   GLY  46          2HA       GLY  46  -9.802  -2.765 -10.349
  336    H    GLU  47           HN       GLU  47 -10.904  -2.899  -7.946
  337    HA   GLU  47           HA       GLU  47 -13.490  -1.880  -8.161
  338   1HB   GLU  47          1HB       GLU  47 -11.955  -2.468  -5.591
  339   2HB   GLU  47          2HB       GLU  47 -13.690  -2.327  -5.759
  340   1HG   GLU  47          1HG       GLU  47 -13.842  -4.357  -7.042
  341   2HG   GLU  47          2HG       GLU  47 -12.083  -4.477  -7.183
  342    H    TYR  48           H        TYR  48 -10.784  -0.567  -6.249
  343    HA   TYR  48           HA       TYR  48 -12.421   1.803  -5.519
  344   1HB   TYR  48          2HB       TYR  48  -9.655   0.925  -4.646
  345   2HB   TYR  48          1HB       TYR  48 -10.495   2.359  -4.076
  346    HD1  TYR  48           HD1      TYR  48 -10.248  -1.259  -3.721
  347    HD2  TYR  48           HD2      TYR  48 -12.640   2.192  -2.778
  348    HE1  TYR  48           HE1      TYR  48 -11.643  -2.638  -2.196
  349    HE2  TYR  48           HE2      TYR  48 -13.943   0.840  -1.159
  350    HH   TYR  48           HH       TYR  48 -14.077  -1.240  -0.038
  351    H    LYS  49           HN       LYS  49 -11.237   1.342  -8.416
  352    HA   LYS  49           HA       LYS  49  -9.369   3.386  -8.879
  353   1HB   LYS  49          2HB       LYS  49 -11.584   2.136 -10.540
  354   2HB   LYS  49          1HB       LYS  49 -10.742   3.541 -11.188
  355   1HG   LYS  49          2HG       LYS  49  -9.249   1.143 -10.166
  356   2HG   LYS  49          1HG       LYS  49  -9.795   1.247 -11.836
  357   1HD   LYS  49          1HD       LYS  49  -8.309   2.899 -12.419
  358   2HD   LYS  49          2HD       LYS  49  -8.266   3.642 -10.822
  359   1HE   LYS  49          1HE       LYS  49  -6.965   0.976 -11.493
  360   2HE   LYS  49          2HE       LYS  49  -6.122   2.530 -11.444
  361   1HZ   LYS  49          1HZ       LYS  49  -6.731   2.743  -9.149
  362   2HZ   LYS  49          2HZ       LYS  49  -5.851   1.378  -9.421
  363   3HZ   LYS  49          3HZ       LYS  49  -7.482   1.276  -9.157
  364    H    ASP  50           HN       ASP  50  -9.588   5.500  -9.649
  365    HA   ASP  50           HA       ASP  50 -10.333   7.620  -9.829
  366   1HB   ASP  50          2HB       ASP  50 -12.449   6.600 -10.785
  367   2HB   ASP  50          1HB       ASP  50 -13.158   6.655  -9.174
  368    H    LYS  51           HN       LYS  51 -12.099   5.950  -7.272
  369    HA   LYS  51           HA       LYS  51 -12.229   8.193  -5.524
  370   1HB   LYS  51          2HB       LYS  51 -12.554   5.228  -4.985
  371   2HB   LYS  51          1HB       LYS  51 -12.991   6.539  -3.871
  372   1HG   LYS  51          1HG       LYS  51 -14.735   7.276  -5.482
  373   2HG   LYS  51          2HG       LYS  51 -14.159   6.166  -6.722
  374   1HD   LYS  51          2HD       LYS  51 -15.447   5.378  -4.079
  375   2HD   LYS  51          1HD       LYS  51 -16.203   5.328  -5.671
  376   1HE   LYS  51          2HE       LYS  51 -13.925   3.553  -4.676
  377   2HE   LYS  51          1HE       LYS  51 -15.582   3.087  -5.033
  378   1HZ   LYS  51          1HZ       LYS  51 -15.193   3.628  -7.331
  379   2HZ   LYS  51          2HZ       LYS  51 -14.157   2.463  -6.803
  380   3HZ   LYS  51          3HZ       LYS  51 -13.621   4.005  -7.024
  381    H    LEU  52           H        LEU  52 -10.306   5.145  -5.323
  382    HA   LEU  52           HA       LEU  52  -8.813   6.458  -3.081
  383   1HB   LEU  52          1HB       LEU  52 -11.249   4.956  -2.779
  384   2HB   LEU  52          2HB       LEU  52 -10.013   3.849  -2.361
  385    HG   LEU  52           HG       LEU  52  -9.245   6.166  -0.962
  386   1HD1  LEU  52          1HD2      LEU  52 -12.309   5.981  -1.053
  387   2HD1  LEU  52          2HD2      LEU  52 -11.341   7.336  -1.657
  388   3HD1  LEU  52          3HD2      LEU  52 -11.389   6.978   0.075
  389   1HD2  LEU  52          1HD1      LEU  52 -11.024   3.874  -0.136
  390   2HD2  LEU  52          2HD1      LEU  52  -9.276   4.019   0.041
  391   3HD2  LEU  52          3HD1      LEU  52 -10.313   5.056   1.001
  392    H    LYS  53           HN       LYS  53  -7.951   4.627  -1.827
  393    HA   LYS  53           HA       LYS  53  -5.635   4.377  -2.501
  394   1HB   LYS  53          2HB       LYS  53  -5.633   3.467  -0.037
  395   2HB   LYS  53          1HB       LYS  53  -7.042   4.392  -0.243
  396   1HG   LYS  53          1HG       LYS  53  -6.629   1.537   0.318
  397   2HG   LYS  53          2HG       LYS  53  -7.840   2.630   0.894
  398   1HD   LYS  53          1HD       LYS  53  -9.059   2.288  -1.341
  399   2HD   LYS  53          2HD       LYS  53  -7.872   1.072  -1.756
  400   1HE   LYS  53          1HE       LYS  53  -9.704   0.994   0.677
  401   2HE   LYS  53          2HE       LYS  53  -9.942   0.116  -0.831
  402   1HZ   LYS  53          1HZ       LYS  53  -7.893  -1.030  -0.460
  403   2HZ   LYS  53          2HZ       LYS  53  -7.663  -0.244   0.970
  404   3HZ   LYS  53          3HZ       LYS  53  -8.940  -1.270   0.791
  405    H    CYS  54           H        CYS  54  -4.865   2.965  -4.395
  406    HA   CYS  54           HA       CYS  54  -3.775   0.564  -2.995
  407   1HB   CYS  54          1HB       CYS  54  -5.964  -0.065  -4.182
  408   2HB   CYS  54          2HB       CYS  54  -5.031   0.185  -5.698
  409    HG   CYS  54           HG       CYS  54  -5.110  -2.364  -5.014
  410    H    VAL  55           H        VAL  55  -1.709   0.412  -3.181
  411    HA   VAL  55           HA       VAL  55  -0.433   0.668  -5.780
  412    HB   VAL  55           HB       VAL  55   1.144   2.238  -3.896
  413   1HG1  VAL  55          1HG1      VAL  55  -1.538   3.540  -4.470
  414   2HG1  VAL  55          2HG1      VAL  55  -0.995   2.958  -2.871
  415   3HG1  VAL  55          3HG1      VAL  55  -0.122   4.250  -3.696
  416   1HG2  VAL  55          1HG2      VAL  55   1.462   2.327  -6.286
  417   2HG2  VAL  55          2HG2      VAL  55  -0.210   2.893  -6.534
  418   3HG2  VAL  55          3HG2      VAL  55   0.985   3.929  -5.725
  419    H    LYS  56           HN       LYS  56   1.888   0.082  -5.625
  420    HA   LYS  56           HA       LYS  56   2.559  -1.680  -3.298
  421   1HB   LYS  56          2HB       LYS  56   2.217  -2.215  -6.213
  422   2HB   LYS  56          1HB       LYS  56   3.614  -2.971  -5.463
  423   1HG   LYS  56          1HG       LYS  56   2.273  -4.012  -3.740
  424   2HG   LYS  56          2HG       LYS  56   0.809  -3.188  -4.294
  425   1HD   LYS  56          1HD       LYS  56   2.409  -5.160  -5.991
  426   2HD   LYS  56          2HD       LYS  56   1.038  -5.616  -4.962
  427   1HE   LYS  56          1HE       LYS  56  -0.410  -3.983  -6.207
  428   2HE   LYS  56          2HE       LYS  56   0.931  -3.673  -7.322
  429   1HZ   LYS  56          1HZ       LYS  56  -0.443  -6.236  -6.909
  430   2HZ   LYS  56          2HZ       LYS  56   0.877  -6.016  -7.879
  431   3HZ   LYS  56          3HZ       LYS  56  -0.544  -5.253  -8.217
  432    H    LEU  57           H        LEU  57   4.343  -0.971  -2.341
  433    HA   LEU  57           HA       LEU  57   6.242   0.763  -3.840
  434   1HB   LEU  57          1HB       LEU  57   5.339   1.723  -1.843
  435   2HB   LEU  57          2HB       LEU  57   5.818   0.310  -0.866
  436    HG   LEU  57           HG       LEU  57   8.130   0.925  -1.028
  437   1HD1  LEU  57          1HD1      LEU  57   8.049   3.023   0.154
  438   2HD1  LEU  57          2HD1      LEU  57   6.504   2.207   0.505
  439   3HD1  LEU  57          3HD1      LEU  57   6.562   3.513  -0.679
  440   1HD2  LEU  57          1HD2      LEU  57   7.129   2.959  -3.070
  441   2HD2  LEU  57          2HD2      LEU  57   8.395   1.711  -3.270
  442   3HD2  LEU  57          3HD2      LEU  57   8.680   3.133  -2.250
  443    H    ASN  58           H        ASN  58   7.941  -0.141  -4.727
  444    HA   ASN  58           HA       ASN  58   8.778  -2.838  -3.941
  445   1HB   ASN  58          1HB       ASN  58   8.936  -2.048  -6.277
  446   2HB   ASN  58          2HB       ASN  58  10.163  -0.876  -5.793
  447   1HD2  ASN  58          2HD2      ASN  58   9.807  -3.953  -7.089
  448   2HD2  ASN  58          1HD2      ASN  58  11.356  -4.613  -6.596
  449    H    THR  59           H        THR  59   9.801  -3.156  -2.123
  450    HA   THR  59           HA       THR  59  10.975  -1.056  -0.529
  451    HB   THR  59           HB       THR  59  11.139  -4.080  -0.164
  452    HG1  THR  59           HG1      THR  59   9.011  -3.561  -0.411
  453   1HG2  THR  59          1HG2      THR  59  11.153  -3.484   2.249
  454   2HG2  THR  59          2HG2      THR  59  11.176  -1.762   1.815
  455   3HG2  THR  59          3HG2      THR  59  12.557  -2.806   1.408
  456    H    ASP  60           HN       ASP  60  12.207  -3.458  -2.765
  457    HA   ASP  60           HA       ASP  60  14.950  -3.524  -1.883
  458   1HB   ASP  60          1HB       ASP  60  13.428  -5.125  -3.379
  459   2HB   ASP  60          2HB       ASP  60  14.016  -4.124  -4.706
  460    H    GLU  61           HN       GLU  61  13.035  -1.747  -4.208
  461    HA   GLU  61           HA       GLU  61  15.192  -0.065  -5.227
  462   1HB   GLU  61          2HB       GLU  61  13.124  -1.042  -6.469
  463   2HB   GLU  61          1HB       GLU  61  12.192   0.203  -5.624
  464   1HG   GLU  61          1HG       GLU  61  12.687   1.066  -7.756
  465   2HG   GLU  61          2HG       GLU  61  13.801   1.918  -6.689
  466    H    SER  62           H        SER  62  12.673   0.138  -2.777
  467    HA   SER  62           HA       SER  62  13.310   2.991  -2.178
  468   1HB   SER  62          2HB       SER  62  11.040   2.492  -3.110
  469   2HB   SER  62          1HB       SER  62  10.676   1.521  -1.673
  470    HG   SER  62           HG       SER  62  11.091   3.304  -0.399
  471    HA   PRO  63           HA       PRO  63  14.299   0.074   1.485
  472   1HB   PRO  63          2HB       PRO  63  16.964   0.712   1.734
  473   2HB   PRO  63          1HB       PRO  63  16.324  -0.545   0.646
  474   1HG   PRO  63          2HG       PRO  63  17.116   2.227  -0.175
  475   2HG   PRO  63          1HG       PRO  63  17.569   0.673  -0.918
  476   1HD   PRO  63          1HD       PRO  63  15.468   2.118  -1.854
  477   2HD   PRO  63          2HD       PRO  63  15.404   0.326  -1.802
  478    H    ASN  64           H        ASN  64  15.415   3.101   0.414
  479    HA   ASN  64           HA       ASN  64  15.975   4.744   2.526
  480   1HB   ASN  64          1HB       ASN  64  14.093   5.502   0.238
  481   2HB   ASN  64          2HB       ASN  64  14.877   6.647   1.337
  482   1HD2  ASN  64          2HD2      ASN  64  15.352   7.236  -1.143
  483   2HD2  ASN  64          1HD2      ASN  64  16.943   6.683  -1.671
  484    H    VAL  65           H        VAL  65  12.625   4.671   1.353
  485    HA   VAL  65           HA       VAL  65  11.406   5.929   3.533
  486    HB   VAL  65           HB       VAL  65  10.308   3.866   1.560
  487   1HG1  VAL  65          1HG2      VAL  65   8.796   4.112   3.486
  488   2HG1  VAL  65          2HG2      VAL  65   8.824   5.880   3.290
  489   3HG1  VAL  65          3HG2      VAL  65   8.108   4.843   2.032
  490   1HG2  VAL  65          1HG1      VAL  65  11.252   5.812   0.406
  491   2HG2  VAL  65          2HG1      VAL  65  10.394   6.915   1.499
  492   3HG2  VAL  65          3HG1      VAL  65   9.488   5.895   0.360
  493    H    ALA  66           H        ALA  66  11.662   2.469   2.811
  494    HA   ALA  66           HA       ALA  66  10.367   1.480   5.128
  495   1HB   ALA  66          1HB       ALA  66  12.522   0.304   3.340
  496   2HB   ALA  66          2HB       ALA  66  11.747  -0.608   4.639
  497   3HB   ALA  66          3HB       ALA  66  10.762   0.026   3.302
  498    H    SER  67           H        SER  67  13.767   2.500   4.703
  499    HA   SER  67           HA       SER  67  14.668   1.459   7.240
  500   1HB   SER  67          2HB       SER  67  15.857   3.687   5.521
  501   2HB   SER  67          1HB       SER  67  16.658   2.816   6.839
  502    HG   SER  67           HG       SER  67  15.637   1.652   4.451
  503    H    GLU  68           HN       GLU  68  13.630   4.652   6.056
  504    HA   GLU  68           HA       GLU  68  13.894   6.114   8.487
  505   1HB   GLU  68          1HB       GLU  68  11.891   6.389   6.200
  506   2HB   GLU  68          2HB       GLU  68  12.092   7.572   7.489
  507   1HG   GLU  68          2HG       GLU  68  14.314   8.125   6.796
  508   2HG   GLU  68          1HG       GLU  68  14.437   6.723   5.732
  509    H    TYR  69           H        TYR  69  11.194   4.183   7.198
  510    HA   TYR  69           HA       TYR  69   9.506   4.618   9.524
  511   1HB   TYR  69          1HB       TYR  69   9.369   3.152   6.903
  512   2HB   TYR  69          2HB       TYR  69   8.380   2.525   8.176
  513    HD1  TYR  69           HD1      TYR  69   8.670   5.104   5.676
  514    HD2  TYR  69           HD2      TYR  69   6.905   4.264   9.513
  515    HE1  TYR  69           HE1      TYR  69   7.201   7.087   5.432
  516    HE2  TYR  69           HE2      TYR  69   5.526   6.320   9.320
  517    HH   TYR  69           HH       TYR  69   5.743   8.505   6.521
  518    H    GLY  70           H        GLY  70  11.862   2.130   8.696
  519   1HA   GLY  70          1HA       GLY  70  12.861   0.677  10.221
  520   2HA   GLY  70          2HA       GLY  70  11.603   1.005  11.421
  521    H    ILE  71           H        ILE  71  11.120   0.088   8.017
  522    HA   ILE  71           HA       ILE  71   9.426  -2.199   8.781
  523    HB   ILE  71           HB       ILE  71  10.219  -1.071   6.079
  524   1HG1  ILE  71          2HG1      ILE  71   7.722  -0.734   7.804
  525   2HG1  ILE  71          1HG1      ILE  71   8.929   0.500   7.415
  526   1HG2  ILE  71          1HG2      ILE  71   9.588  -3.482   5.970
  527   2HG2  ILE  71          2HG2      ILE  71   8.405  -2.460   5.173
  528   3HG2  ILE  71          3HG2      ILE  71   8.061  -3.099   6.794
  529   1HD1  ILE  71          1HD1      ILE  71   6.945  -0.751   5.508
  530   2HD1  ILE  71          2HD1      ILE  71   8.378   0.161   4.979
  531   3HD1  ILE  71          3HD1      ILE  71   7.137   0.950   5.967
  532    H    ARG  72           HN       ARG  72  10.887  -3.493   9.820
  533    HA   ARG  72           HA       ARG  72  13.456  -4.226   8.741
  534   1HB   ARG  72          2HB       ARG  72  13.663  -5.551  10.698
  535   2HB   ARG  72          1HB       ARG  72  12.904  -4.035  11.168
  536   1HG   ARG  72          1HG       ARG  72  11.477  -6.733  10.824
  537   2HG   ARG  72          2HG       ARG  72  12.017  -6.018  12.324
  538   1HD   ARG  72          1HD       ARG  72   9.787  -5.510  12.374
  539   2HD   ARG  72          2HD       ARG  72  10.483  -4.004  11.765
  540    HE   ARG  72           HE       ARG  72   9.638  -5.995   9.751
  541   1HH1  ARG  72          1HH2      ARG  72   8.478  -3.305  11.735
  542   2HH1  ARG  72          2HH2      ARG  72   7.119  -2.960  10.700
  543   1HH2  ARG  72          1HH1      ARG  72   7.997  -5.406   8.288
  544   2HH2  ARG  72          2HH1      ARG  72   6.794  -4.250   8.705
  545    H    SER  73           H        SER  73  10.339  -5.358   7.941
  546    HA   SER  73           HA       SER  73  11.371  -7.541   6.380
  547   1HB   SER  73          1HB       SER  73   9.387  -8.176   8.617
  548   2HB   SER  73          2HB       SER  73   9.993  -9.307   7.397
  549    HG   SER  73           HG       SER  73  12.135  -8.328   8.521
  550    H    ILE  74           H        ILE  74   9.420  -8.436   5.083
  551    HA   ILE  74           HA       ILE  74   7.189  -6.535   4.940
  552    HB   ILE  74           HB       ILE  74   7.413  -6.599   2.420
  553   1HG1  ILE  74          1HG1      ILE  74  10.245  -7.497   2.984
  554   2HG1  ILE  74          2HG1      ILE  74   8.971  -8.472   2.227
  555   1HG2  ILE  74          1HG2      ILE  74   9.687  -5.197   3.895
  556   2HG2  ILE  74          2HG2      ILE  74   7.997  -4.648   3.916
  557   3HG2  ILE  74          3HG2      ILE  74   8.888  -4.675   2.399
  558   1HD1  ILE  74          1HD1      ILE  74   8.738  -6.630   0.482
  559   2HD1  ILE  74          2HD1      ILE  74  10.249  -5.945   1.124
  560   3HD1  ILE  74          3HD1      ILE  74  10.234  -7.566   0.427
  561    HA   PRO  75           HA       PRO  75   5.252  -6.827   2.911
  562   1HB   PRO  75          1HB       PRO  75   2.674  -7.411   3.563
  563   2HB   PRO  75          2HB       PRO  75   3.533  -8.214   2.236
  564   1HG   PRO  75          1HG       PRO  75   3.214  -9.243   5.071
  565   2HG   PRO  75          2HG       PRO  75   2.875 -10.117   3.546
  566   1HD   PRO  75          2HD       PRO  75   5.232 -10.405   4.867
  567   2HD   PRO  75          1HD       PRO  75   5.218 -10.349   3.089
  568    H    THR  76           H        THR  76   4.032  -5.075   3.676
  569    HA   THR  76           HA       THR  76   3.202  -4.668   6.382
  570    HB   THR  76           HB       THR  76   5.745  -3.301   5.412
  571    HG1  THR  76           HG1      THR  76   5.596  -5.292   6.829
  572   1HG2  THR  76          1HG2      THR  76   4.295  -1.504   6.201
  573   2HG2  THR  76          2HG2      THR  76   5.498  -1.859   7.452
  574   3HG2  THR  76          3HG2      THR  76   3.834  -2.451   7.638
  575    H    ILE  77           H        ILE  77   1.377  -3.460   6.024
  576    HA   ILE  77           HA       ILE  77   1.053  -2.208   3.328
  577    HB   ILE  77           HB       ILE  77  -0.901  -3.621   5.162
  578   1HG1  ILE  77          1HG1      ILE  77   0.247  -4.325   2.424
  579   2HG1  ILE  77          2HG1      ILE  77   0.646  -5.128   3.948
  580   1HG2  ILE  77          1HG2      ILE  77  -1.287  -2.270   2.469
  581   2HG2  ILE  77          2HG2      ILE  77  -1.990  -1.722   4.008
  582   3HG2  ILE  77          3HG2      ILE  77  -2.526  -3.239   3.309
  583   1HD1  ILE  77          1HD1      ILE  77  -1.778  -5.783   4.166
  584   2HD1  ILE  77          2HD1      ILE  77  -2.008  -5.215   2.491
  585   3HD1  ILE  77          3HD1      ILE  77  -0.882  -6.531   2.825
  586    H    MET  78           H        MET  78   1.420  -0.004   3.686
  587    HA   MET  78           HA       MET  78   0.364   1.204   6.235
  588   1HB   MET  78          1HB       MET  78   2.470   2.171   4.295
  589   2HB   MET  78          2HB       MET  78   1.776   3.150   5.606
  590   1HG   MET  78          2HG       MET  78   2.465   1.420   7.245
  591   2HG   MET  78          1HG       MET  78   3.306   0.558   5.948
  592   1HE   MET  78          1HE       MET  78   6.083   2.024   8.313
  593   2HE   MET  78          2HE       MET  78   5.370   0.552   7.622
  594   3HE   MET  78          3HE       MET  78   4.454   1.515   8.801
  595    H    VAL  79           H        VAL  79  -1.148   2.791   6.184
  596    HA   VAL  79           HA       VAL  79  -2.321   3.460   3.515
  597    HB   VAL  79           HB       VAL  79  -3.747   3.289   6.177
  598   1HG1  VAL  79          1HG1      VAL  79  -3.722   1.318   3.871
  599   2HG1  VAL  79          2HG1      VAL  79  -4.859   1.252   5.231
  600   3HG1  VAL  79          3HG1      VAL  79  -3.130   1.002   5.505
  601   1HG2  VAL  79          1HG2      VAL  79  -4.771   4.883   4.580
  602   2HG2  VAL  79          2HG2      VAL  79  -4.777   3.631   3.324
  603   3HG2  VAL  79          3HG2      VAL  79  -5.792   3.455   4.769
  604    H    PHE  80           H        PHE  80  -2.402   5.553   3.015
  605    HA   PHE  80           HA       PHE  80  -1.838   7.605   5.083
  606   1HB   PHE  80          1HB       PHE  80  -0.777   7.450   2.227
  607   2HB   PHE  80          2HB       PHE  80  -0.480   8.767   3.341
  608    HD1  PHE  80           HD1      PHE  80   1.338   8.706   4.887
  609    HD2  PHE  80           HD2      PHE  80   0.239   5.174   2.673
  610    HE1  PHE  80           HE1      PHE  80   3.511   7.660   5.471
  611    HE2  PHE  80           HE2      PHE  80   2.432   4.159   3.215
  612    HZ   PHE  80           HZ       PHE  80   4.016   5.338   4.730
  613    H    LYS  81           HN       LYS  81  -2.370   9.782   4.350
  614    HA   LYS  81           HA       LYS  81  -3.971  10.320   2.046
  615   1HB   LYS  81          2HB       LYS  81  -6.047  10.843   2.958
  616   2HB   LYS  81          1HB       LYS  81  -5.710   9.223   3.549
  617   1HG   LYS  81          2HG       LYS  81  -5.576  11.821   5.151
  618   2HG   LYS  81          1HG       LYS  81  -6.776  10.533   5.232
  619   1HD   LYS  81          2HD       LYS  81  -4.810   8.968   5.826
  620   2HD   LYS  81          1HD       LYS  81  -3.860  10.426   6.099
  621   1HE   LYS  81          1HE       LYS  81  -4.696   9.682   8.212
  622   2HE   LYS  81          2HE       LYS  81  -5.453  11.222   7.790
  623   1HZ   LYS  81          1HZ       LYS  81  -7.407  10.004   7.136
  624   2HZ   LYS  81          2HZ       LYS  81  -7.000   9.616   8.683
  625   3HZ   LYS  81          3HZ       LYS  81  -6.678   8.562   7.462
  626    H    GLY  82           H        GLY  82  -4.010  12.754   1.880
  627   1HA   GLY  82          2HA       GLY  82  -3.386  14.901   2.428
  628   2HA   GLY  82          1HA       GLY  82  -3.991  14.422   4.036
  629    H    GLY  83           H        GLY  83  -0.968  13.206   2.459
  630   1HA   GLY  83          2HA       GLY  83   1.226  13.517   3.041
  631   2HA   GLY  83          1HA       GLY  83   0.759  14.973   3.906
  632    H    LYS  84           HN       LYS  84  -0.963  12.175   5.097
  633    HA   LYS  84           HA       LYS  84   1.141  11.510   7.070
  634   1HB   LYS  84          2HB       LYS  84  -1.661  12.527   7.737
  635   2HB   LYS  84          1HB       LYS  84  -0.575  11.793   8.918
  636   1HG   LYS  84          2HG       LYS  84  -0.021  14.366   7.402
  637   2HG   LYS  84          1HG       LYS  84  -0.618  14.250   9.053
  638   1HD   LYS  84          2HD       LYS  84   1.419  13.087   9.799
  639   2HD   LYS  84          1HD       LYS  84   2.090  13.114   8.168
  640   1HE   LYS  84          2HE       LYS  84   1.421  15.601   9.791
  641   2HE   LYS  84          1HE       LYS  84   3.033  14.900   9.561
  642   1HZ   LYS  84          1HZ       LYS  84   2.714  16.637   8.020
  643   2HZ   LYS  84          2HZ       LYS  84   1.307  15.991   7.457
  644   3HZ   LYS  84          3HZ       LYS  84   2.728  15.212   7.184
  645    H    LYS  85           HN       LYS  85   0.298   9.785   8.567
  646    HA   LYS  85           HA       LYS  85  -0.658   7.569   6.886
  647   1HB   LYS  85          2HB       LYS  85   0.627   7.756   9.631
  648   2HB   LYS  85          1HB       LYS  85  -0.079   6.263   8.984
  649   1HG   LYS  85          2HG       LYS  85   1.346   6.364   7.007
  650   2HG   LYS  85          1HG       LYS  85   2.066   7.887   7.570
  651   1HD   LYS  85          1HD       LYS  85   3.539   6.023   7.983
  652   2HD   LYS  85          2HD       LYS  85   3.015   6.718   9.535
  653   1HE   LYS  85          2HE       LYS  85   1.398   4.843   9.808
  654   2HE   LYS  85          1HE       LYS  85   1.827   4.235   8.194
  655   1HZ   LYS  85          1HZ       LYS  85   4.043   3.879   9.021
  656   2HZ   LYS  85          2HZ       LYS  85   3.603   4.406  10.524
  657   3HZ   LYS  85          3HZ       LYS  85   2.908   3.046   9.887
  658    H    CYS  86           H        CYS  86  -2.151   6.082   7.718
  659    HA   CYS  86           HA       CYS  86  -4.283   7.106   9.556
  660   1HB   CYS  86          2HB       CYS  86  -4.934   7.209   7.137
  661   2HB   CYS  86          1HB       CYS  86  -4.664   5.483   6.990
  662    HG   CYS  86           HG       CYS  86  -6.205   5.772   9.635
  663    H    GLU  87           HN       GLU  87  -2.984   4.263   7.854
  664    HA   GLU  87           HA       GLU  87  -3.267   2.604  10.319
  665   1HB   GLU  87          1HB       GLU  87  -3.890   1.392   7.635
  666   2HB   GLU  87          2HB       GLU  87  -4.438   0.918   9.236
  667   1HG   GLU  87          1HG       GLU  87  -5.972   2.885   9.265
  668   2HG   GLU  87          2HG       GLU  87  -5.420   3.351   7.662
  669    H    THR  88           H        THR  88  -2.126   0.510  10.104
  670    HA   THR  88           HA       THR  88   0.002   0.189   8.142
  671    HB   THR  88           HB       THR  88   0.625   0.648  11.084
  672    HG1  THR  88           HG1      THR  88   0.528   2.293   9.107
  673   1HG2  THR  88          1HG2      THR  88   2.416  -0.384   8.829
  674   2HG2  THR  88          2HG2      THR  88   2.991   0.180  10.413
  675   3HG2  THR  88          3HG2      THR  88   1.975  -1.262  10.307
  676    H    ILE  89           H        ILE  89  -1.095  -1.559   7.548
  677    HA   ILE  89           HA       ILE  89  -1.793  -3.699   9.477
  678    HB   ILE  89           HB       ILE  89  -2.594  -3.849   6.586
  679   1HG1  ILE  89          1HG1      ILE  89  -3.970  -1.876   8.470
  680   2HG1  ILE  89          2HG1      ILE  89  -3.040  -1.434   7.025
  681   1HG2  ILE  89          1HG2      ILE  89  -4.566  -4.876   7.521
  682   2HG2  ILE  89          2HG2      ILE  89  -4.211  -4.229   9.138
  683   3HG2  ILE  89          3HG2      ILE  89  -3.216  -5.514   8.446
  684   1HD1  ILE  89          1HD1      ILE  89  -4.558  -2.636   5.581
  685   2HD1  ILE  89          2HD1      ILE  89  -5.619  -2.991   6.972
  686   3HD1  ILE  89          3HD1      ILE  89  -5.330  -1.317   6.476
  687    H    ILE  90           H        ILE  90  -1.489  -5.944   7.838
  688    HA   ILE  90           HA       ILE  90   1.220  -5.908   6.710
  689    HB   ILE  90           HB       ILE  90   0.310  -7.713   9.012
  690   1HG1  ILE  90          2HG1      ILE  90   2.493  -5.575   8.845
  691   2HG1  ILE  90          1HG1      ILE  90   1.008  -5.504   9.810
  692   1HG2  ILE  90          1HG2      ILE  90   2.906  -7.743   7.404
  693   2HG2  ILE  90          2HG2      ILE  90   2.581  -8.727   8.845
  694   3HG2  ILE  90          3HG2      ILE  90   1.655  -9.009   7.400
  695   1HD1  ILE  90          1HD1      ILE  90   3.391  -7.295  10.307
  696   2HD1  ILE  90          2HD1      ILE  90   1.806  -7.515  11.096
  697   3HD1  ILE  90          3HD1      ILE  90   2.724  -6.013  11.319
  698    H    GLY  91           H        GLY  91   1.505  -7.834   5.382
  699   1HA   GLY  91          1HA       GLY  91  -0.949  -8.678   4.014
  700   2HA   GLY  91          2HA       GLY  91   0.714  -9.144   3.629
  701    H    ALA  92           H        ALA  92   0.164 -11.414   3.532
  702    HA   ALA  92           HA       ALA  92   0.007 -13.508   4.281
  703   1HB   ALA  92          1HB       ALA  92   0.552 -14.123   6.531
  704   2HB   ALA  92          2HB       ALA  92   1.606 -12.768   6.087
  705   3HB   ALA  92          3HB       ALA  92   0.211 -12.511   7.162
  706    H    VAL  93           H        VAL  93  -2.022 -11.306   6.222
  707    HA   VAL  93           HA       VAL  93  -4.128 -13.278   6.564
  708    HB   VAL  93           HB       VAL  93  -5.452 -11.418   7.434
  709   1HG1  VAL  93          1HG2      VAL  93  -3.104  -9.606   6.729
  710   2HG1  VAL  93          2HG2      VAL  93  -4.714  -9.578   5.983
  711   3HG1  VAL  93          3HG2      VAL  93  -4.523  -9.165   7.689
  712   1HG2  VAL  93          1HG1      VAL  93  -2.599 -11.388   8.516
  713   2HG2  VAL  93          2HG1      VAL  93  -3.834 -12.607   8.898
  714   3HG2  VAL  93          3HG1      VAL  93  -4.071 -10.920   9.386
  715    HA   PRO  94           HA       PRO  94  -6.011 -12.870   2.618
  716   1HB   PRO  94          1HB       PRO  94  -8.664 -12.460   3.965
  717   2HB   PRO  94          2HB       PRO  94  -8.256 -13.600   2.657
  718   1HG   PRO  94          2HG       PRO  94  -8.490 -14.502   5.218
  719   2HG   PRO  94          1HG       PRO  94  -7.169 -15.086   4.165
  720   1HD   PRO  94          1HD       PRO  94  -7.017 -13.007   6.348
  721   2HD   PRO  94          2HD       PRO  94  -5.886 -14.319   5.925
  722    H    LYS  95           HN       LYS  95  -6.770 -11.361   1.148
  723    HA   LYS  95           HA       LYS  95  -6.448  -8.599   1.763
  724   1HB   LYS  95          2HB       LYS  95  -7.713 -10.084  -0.575
  725   2HB   LYS  95          1HB       LYS  95  -7.607  -8.336  -0.504
  726   1HG   LYS  95          1HG       LYS  95  -5.267 -10.297  -0.469
  727   2HG   LYS  95          2HG       LYS  95  -5.778  -9.260  -1.799
  728   1HD   LYS  95          1HD       LYS  95  -4.543  -8.343   0.834
  729   2HD   LYS  95          2HD       LYS  95  -3.789  -8.347  -0.744
  730   1HE   LYS  95          2HE       LYS  95  -5.224  -6.640  -1.604
  731   2HE   LYS  95          1HE       LYS  95  -6.259  -6.655  -0.170
  732   1HZ   LYS  95          1HZ       LYS  95  -4.712  -4.869  -0.113
  733   2HZ   LYS  95          2HZ       LYS  95  -3.428  -5.898  -0.200
  734   3HZ   LYS  95          3HZ       LYS  95  -4.412  -5.919   1.120
  735    H    ALA  96           H        ALA  96  -9.306 -10.646   1.555
  736    HA   ALA  96           HA       ALA  96 -11.355  -8.769   1.840
  737   1HB   ALA  96          1HB       ALA  96 -11.096 -11.457   3.275
  738   2HB   ALA  96          2HB       ALA  96 -11.749 -11.197   1.641
  739   3HB   ALA  96          3HB       ALA  96 -12.598 -10.536   3.052
  740    H    THR  97           H        THR  97  -9.368 -10.219   4.525
  741    HA   THR  97           HA       THR  97 -10.498  -8.834   6.661
  742    HB   THR  97           HB       THR  97  -7.575  -9.662   6.345
  743    HG1  THR  97           HG1      THR  97  -8.520 -11.748   7.031
  744   1HG2  THR  97          1HG2      THR  97  -9.473  -9.851   8.716
  745   2HG2  THR  97          2HG2      THR  97  -7.768 -10.351   8.674
  746   3HG2  THR  97          3HG2      THR  97  -8.184  -8.637   8.514
  747    H    ILE  98           H        ILE  98  -7.718  -8.010   4.554
  748    HA   ILE  98           HA       ILE  98  -7.007  -5.565   5.864
  749    HB   ILE  98           HB       ILE  98  -6.528  -6.722   3.097
  750   1HG1  ILE  98          2HG1      ILE  98  -4.462  -5.992   5.182
  751   2HG1  ILE  98          1HG1      ILE  98  -5.438  -7.439   5.430
  752   1HG2  ILE  98          1HG2      ILE  98  -4.825  -4.831   2.847
  753   2HG2  ILE  98          2HG2      ILE  98  -6.516  -4.349   2.661
  754   3HG2  ILE  98          3HG2      ILE  98  -5.660  -4.016   4.178
  755   1HD1  ILE  98          1HD1      ILE  98  -3.310  -7.952   4.309
  756   2HD1  ILE  98          2HD1      ILE  98  -4.714  -8.410   3.337
  757   3HD1  ILE  98          3HD1      ILE  98  -3.789  -6.948   2.926
  758    H    VAL  99           H        VAL  99  -9.099  -6.121   2.967
  759    HA   VAL  99           HA       VAL  99  -9.835  -3.427   2.554
  760    HB   VAL  99           HB       VAL  99 -11.327  -6.034   2.028
  761   1HG1  VAL  99          1HG1      VAL  99 -12.718  -4.670   0.439
  762   2HG1  VAL  99          2HG1      VAL  99 -13.031  -4.278   2.131
  763   3HG1  VAL  99          3HG1      VAL  99 -12.023  -3.197   1.143
  764   1HG2  VAL  99          1HG2      VAL  99 -10.616  -5.643  -0.288
  765   2HG2  VAL  99          2HG2      VAL  99  -9.186  -5.631   0.755
  766   3HG2  VAL  99          3HG2      VAL  99  -9.861  -4.103   0.167
  767    H    GLN 100           H        GLN 100 -11.526  -5.956   4.528
  768    HA   GLN 100           HA       GLN 100 -13.547  -4.292   5.553
  769   1HB   GLN 100          2HB       GLN 100 -12.051  -6.674   6.731
  770   2HB   GLN 100          1HB       GLN 100 -13.364  -5.907   7.604
  771   1HG   GLN 100          2HG       GLN 100 -13.570  -7.155   4.821
  772   2HG   GLN 100          1HG       GLN 100 -14.109  -7.878   6.337
  773   1HE2  GLN 100          1HE2      GLN 100 -15.180  -5.169   7.329
  774   2HE2  GLN 100          2HE2      GLN 100 -16.660  -4.981   6.407
  775    H    THR 101           H        THR 101 -10.209  -4.713   6.728
  776    HA   THR 101           HA       THR 101 -10.492  -3.065   9.058
  777    HB   THR 101           HB       THR 101  -7.992  -3.444   7.348
  778    HG1  THR 101           HG1      THR 101  -8.933  -5.430   8.047
  779   1HG2  THR 101          1HG2      THR 101  -7.775  -1.642   9.023
  780   2HG2  THR 101          2HG2      THR 101  -6.787  -3.048   9.439
  781   3HG2  THR 101          3HG2      THR 101  -8.318  -2.756  10.293
  782    H    VAL 102           H        VAL 102  -9.540  -2.259   5.665
  783    HA   VAL 102           HA       VAL 102  -9.155   0.533   6.223
  784    HB   VAL 102           HB       VAL 102  -9.796  -0.813   3.575
  785   1HG1  VAL 102          1HG1      VAL 102  -7.088  -0.034   4.716
  786   2HG1  VAL 102          2HG1      VAL 102  -7.421  -0.828   3.155
  787   3HG1  VAL 102          3HG1      VAL 102  -7.694  -1.696   4.666
  788   1HG2  VAL 102          1HG2      VAL 102  -8.562   1.903   4.280
  789   2HG2  VAL 102          2HG2      VAL 102 -10.077   1.640   3.405
  790   3HG2  VAL 102          3HG2      VAL 102  -8.537   1.201   2.660
  791    H    GLU 103           HN       GLU 103 -12.003  -1.301   5.145
  792    HA   GLU 103           HA       GLU 103 -13.663   0.656   4.196
  793   1HB   GLU 103          2HB       GLU 103 -14.227  -1.800   5.869
  794   2HB   GLU 103          1HB       GLU 103 -15.525  -0.786   5.263
  795   1HG   GLU 103          2HG       GLU 103 -13.363  -1.800   3.374
  796   2HG   GLU 103          1HG       GLU 103 -14.765  -2.809   3.796
  797    H    LYS 104           HN       LYS 104 -13.095  -0.042   7.612
  798    HA   LYS 104           HA       LYS 104 -14.909   1.587   8.944
  799   1HB   LYS 104          1HB       LYS 104 -13.223   0.082   9.979
  800   2HB   LYS 104          2HB       LYS 104 -11.934   1.162   9.435
  801   1HG   LYS 104          1HG       LYS 104 -12.994   2.985  10.904
  802   2HG   LYS 104          2HG       LYS 104 -14.030   1.704  11.568
  803   1HD   LYS 104          1HD       LYS 104 -11.926   0.409  12.112
  804   2HD   LYS 104          2HD       LYS 104 -10.971   1.759  11.502
  805   1HE   LYS 104          1HE       LYS 104 -12.907   1.924  13.860
  806   2HE   LYS 104          2HE       LYS 104 -11.146   1.775  13.982
  807   1HZ   LYS 104          1HZ       LYS 104 -12.584   4.011  12.742
  808   2HZ   LYS 104          2HZ       LYS 104 -10.945   3.851  12.812
  809   3HZ   LYS 104          3HZ       LYS 104 -11.818   4.029  14.199
  810    H    TYR 105           H        TYR 105 -11.984   2.536   7.209
  811    HA   TYR 105           HA       TYR 105 -12.199   5.413   7.925
  812   1HB   TYR 105          2HB       TYR 105 -10.073   3.752   6.518
  813   2HB   TYR 105          1HB       TYR 105  -9.883   5.430   7.032
  814    HD1  TYR 105           HD1      TYR 105  -9.941   5.929   9.511
  815    HD2  TYR 105           HD2      TYR 105  -9.743   1.920   8.005
  816    HE1  TYR 105           HE1      TYR 105  -8.787   5.211  11.612
  817    HE2  TYR 105           HE2      TYR 105  -8.596   1.180  10.089
  818    HH   TYR 105           HH       TYR 105  -7.683   3.468  12.678
  819    H    LEU 106           H        LEU 106 -14.035   3.937   5.991
  820    HA   LEU 106           HA       LEU 106 -13.410   5.470   3.514
  821   1HB   LEU 106          1HB       LEU 106 -12.698   2.877   3.924
  822   2HB   LEU 106          2HB       LEU 106 -14.329   2.627   3.367
  823    HG   LEU 106           HG       LEU 106 -11.978   3.978   2.008
  824   1HD1  LEU 106          1HD1      LEU 106 -13.905   5.160   1.099
  825   2HD1  LEU 106          2HD1      LEU 106 -13.341   4.010  -0.115
  826   3HD1  LEU 106          3HD1      LEU 106 -14.778   3.628   0.841
  827   1HD2  LEU 106          1HD2      LEU 106 -11.966   1.491   2.218
  828   2HD2  LEU 106          2HD2      LEU 106 -13.511   1.436   1.358
  829   3HD2  LEU 106          3HD2      LEU 106 -12.049   1.995   0.524
  830    H    ASN 107           H        ASN 107 -15.812   3.435   5.265
  831    HA   ASN 107           HA       ASN 107 -17.965   5.250   4.533
  832   1HB   ASN 107          1HB       ASN 107 -17.618   3.530   2.595
  833   2HB   ASN 107          2HB       ASN 107 -18.201   2.318   3.738
  834   1HD2  ASN 107          1HD2      ASN 107 -20.268   3.981   5.019
  835   2HD2  ASN 107          2HD2      ASN 107 -21.506   4.240   3.783
  Start of MODEL   22
    1   1H    MET   1          1H        MET   1  -8.936   2.594 -12.070
    2   2H    MET   1          2H        MET   1  -8.454   1.659 -10.784
    3   3H    MET   1          3H        MET   1  -8.688   0.949 -12.235
    4    HA   MET   1           HA       MET   1  -6.943   2.219 -13.224
    5   1HB   MET   1          2HB       MET   1  -7.024   3.886 -11.214
    6   2HB   MET   1          1HB       MET   1  -6.066   2.705 -10.326
    7   1HG   MET   1          2HG       MET   1  -4.660   4.442 -11.321
    8   2HG   MET   1          1HG       MET   1  -4.291   2.925 -12.134
    9   1HE   MET   1          1HE       MET   1  -3.138   3.826 -14.216
   10   2HE   MET   1          2HE       MET   1  -3.164   5.399 -13.376
   11   3HE   MET   1          3HE       MET   1  -3.681   5.286 -15.074
   12    H    GLU   2           HN       GLU   2  -4.645   1.296 -11.105
   13    HA   GLU   2           HA       GLU   2  -5.006  -1.545 -11.003
   14   1HB   GLU   2          1HB       GLU   2  -3.102  -2.023 -12.523
   15   2HB   GLU   2          2HB       GLU   2  -4.501  -1.365 -13.363
   16   1HG   GLU   2          2HG       GLU   2  -3.386   0.887 -13.414
   17   2HG   GLU   2          1HG       GLU   2  -1.987   0.197 -12.570
   18    H    ALA   3           H        ALA   3  -2.783  -2.401 -10.062
   19    HA   ALA   3           HA       ALA   3  -2.278  -0.803  -7.758
   20   1HB   ALA   3          1HB       ALA   3  -0.334  -2.409  -7.425
   21   2HB   ALA   3          2HB       ALA   3  -0.943  -3.273  -8.863
   22   3HB   ALA   3          3HB       ALA   3  -1.948  -3.079  -7.402
   23    H    GLY   4           H        GLY   4  -1.098   1.080  -7.703
   24   1HA   GLY   4          1HA       GLY   4   0.719   1.963  -9.678
   25   2HA   GLY   4          2HA       GLY   4   0.694   2.520  -8.035
   26    H    ALA   5           H        ALA   5   3.004   1.924  -9.807
   27    HA   ALA   5           HA       ALA   5   4.443  -0.025  -8.037
   28   1HB   ALA   5          1HB       ALA   5   4.560  -0.708 -10.359
   29   2HB   ALA   5          2HB       ALA   5   5.127   0.921 -10.835
   30   3HB   ALA   5          3HB       ALA   5   6.132  -0.104  -9.779
   31    H    VAL   6           H        VAL   6   5.107   1.214  -6.455
   32    HA   VAL   6           HA       VAL   6   6.016   4.031  -6.998
   33    HB   VAL   6           HB       VAL   6   5.589   4.391  -4.541
   34   1HG1  VAL   6          1HG2      VAL   6   3.791   1.948  -4.771
   35   2HG1  VAL   6          2HG2      VAL   6   4.105   2.947  -3.334
   36   3HG1  VAL   6          3HG2      VAL   6   5.380   1.915  -4.008
   37   1HG2  VAL   6          1HG1      VAL   6   3.131   3.676  -6.202
   38   2HG2  VAL   6          2HG1      VAL   6   4.015   5.221  -6.272
   39   3HG2  VAL   6          3HG1      VAL   6   3.183   4.735  -4.783
   40    H    ASN   7           H        ASN   7   7.789   4.791  -5.692
   41    HA   ASN   7           HA       ASN   7   9.658   2.905  -4.464
   42   1HB   ASN   7          2HB       ASN   7  10.163   4.383  -7.082
   43   2HB   ASN   7          1HB       ASN   7  11.488   4.022  -6.000
   44   1HD2  ASN   7          2HD2      ASN   7  11.573   1.711  -5.146
   45   2HD2  ASN   7          1HD2      ASN   7  11.310   0.445  -6.337
   46    H    ASP   8           HN       ASP   8  11.565   4.403  -3.795
   47    HA   ASP   8           HA       ASP   8  10.581   6.132  -1.861
   48   1HB   ASP   8          1HB       ASP   8  12.836   6.882  -1.512
   49   2HB   ASP   8          2HB       ASP   8  12.883   5.168  -1.972
   50    H    ASP   9           HN       ASP   9  11.933   7.076  -4.925
   51    HA   ASP   9           HA       ASP   9  11.410   9.861  -4.822
   52   1HB   ASP   9          1HB       ASP   9  12.800   8.900  -6.559
   53   2HB   ASP   9          2HB       ASP   9  11.469   7.963  -7.220
   54    H    THR  10           H        THR  10   9.479   7.610  -6.815
   55    HA   THR  10           HA       THR  10   7.385   9.347  -7.378
   56    HB   THR  10           HB       THR  10   6.117   7.155  -7.846
   57    HG1  THR  10           HG1      THR  10   7.643   5.350  -7.834
   58   1HG2  THR  10          1HG2      THR  10   7.468   8.354  -9.552
   59   2HG2  THR  10          2HG2      THR  10   8.925   7.501  -9.012
   60   3HG2  THR  10          3HG2      THR  10   7.587   6.598  -9.751
   61    H    PHE  11           H        PHE  11   7.714   7.229  -4.578
   62    HA   PHE  11           HA       PHE  11   5.300   7.096  -3.362
   63   1HB   PHE  11          2HB       PHE  11   7.473   6.340  -2.434
   64   2HB   PHE  11          1HB       PHE  11   7.907   7.982  -2.052
   65    HD1  PHE  11           HD1      PHE  11   7.005   9.097  -0.072
   66    HD2  PHE  11           HD2      PHE  11   5.723   5.125  -1.172
   67    HE1  PHE  11           HE1      PHE  11   6.275   8.689   2.250
   68    HE2  PHE  11           HE2      PHE  11   4.940   4.746   1.148
   69    HZ   PHE  11           HZ       PHE  11   5.334   6.469   2.886
   70    H    LYS  12           HN       LYS  12   7.482   9.858  -3.255
   71    HA   LYS  12           HA       LYS  12   6.032  11.613  -1.588
   72   1HB   LYS  12          1HB       LYS  12   7.903  12.090  -3.936
   73   2HB   LYS  12          2HB       LYS  12   6.998  13.403  -3.231
   74   1HG   LYS  12          2HG       LYS  12   9.163  13.326  -2.148
   75   2HG   LYS  12          1HG       LYS  12   7.959  12.801  -0.953
   76   1HD   LYS  12          1HD       LYS  12   8.555  10.450  -1.336
   77   2HD   LYS  12          2HD       LYS  12   9.652  10.915  -2.649
   78   1HE   LYS  12          1HE       LYS  12  11.117  12.065  -1.081
   79   2HE   LYS  12          2HE       LYS  12   9.988  11.775   0.260
   80   1HZ   LYS  12          1HZ       LYS  12  11.834  10.201   0.151
   81   2HZ   LYS  12          2HZ       LYS  12  10.359   9.469   0.058
   82   3HZ   LYS  12          3HZ       LYS  12  11.263   9.644  -1.301
   83    H    ASN  13           H        ASN  13   5.789  11.399  -5.193
   84    HA   ASN  13           HA       ASN  13   3.710  13.427  -5.168
   85   1HB   ASN  13          2HB       ASN  13   5.296  12.977  -7.094
   86   2HB   ASN  13          1HB       ASN  13   4.379  11.536  -7.455
   87   1HD2  ASN  13          1HD2      ASN  13   3.596  15.017  -6.561
   88   2HD2  ASN  13          2HD2      ASN  13   2.443  15.187  -7.873
   89    H    VAL  14           H        VAL  14   3.935   9.969  -5.564
   90    HA   VAL  14           HA       VAL  14   1.225   9.773  -6.465
   91    HB   VAL  14           HB       VAL  14   3.229   7.607  -5.652
   92   1HG1  VAL  14          1HG1      VAL  14   3.851   8.943  -7.665
   93   2HG1  VAL  14          2HG1      VAL  14   3.445   7.278  -8.094
   94   3HG1  VAL  14          3HG1      VAL  14   2.273   8.578  -8.385
   95   1HG2  VAL  14          1HG2      VAL  14   1.018   6.566  -5.449
   96   2HG2  VAL  14          2HG2      VAL  14   0.508   7.273  -6.995
   97   3HG2  VAL  14          3HG2      VAL  14   1.754   6.018  -6.954
   98    H    VAL  15           H        VAL  15   2.870   9.057  -3.391
   99    HA   VAL  15           HA       VAL  15   0.385   8.028  -2.156
  100    HB   VAL  15           HB       VAL  15   3.222   8.069  -1.044
  101   1HG1  VAL  15          1HG1      VAL  15   0.782   6.461  -0.257
  102   2HG1  VAL  15          2HG1      VAL  15   2.409   6.376   0.465
  103   3HG1  VAL  15          3HG1      VAL  15   1.453   7.849   0.626
  104   1HG2  VAL  15          1HG2      VAL  15   3.413   5.757  -1.764
  105   2HG2  VAL  15          2HG2      VAL  15   3.145   6.765  -3.179
  106   3HG2  VAL  15          3HG2      VAL  15   1.811   5.817  -2.525
  107    H    LEU  16           H        LEU  16   3.053  10.255  -1.196
  108    HA   LEU  16           HA       LEU  16   1.520  11.313   1.008
  109   1HB   LEU  16          2HB       LEU  16   3.984  12.353  -0.454
  110   2HB   LEU  16          1HB       LEU  16   3.290  13.122   0.940
  111    HG   LEU  16           HG       LEU  16   4.486  10.306   0.731
  112   1HD1  LEU  16          1HD1      LEU  16   6.217  11.203   2.240
  113   2HD1  LEU  16          2HD1      LEU  16   5.387  12.773   2.280
  114   3HD1  LEU  16          3HD1      LEU  16   6.107  12.184   0.769
  115   1HD2  LEU  16          1HD2      LEU  16   3.177  11.649   3.138
  116   2HD2  LEU  16          2HD2      LEU  16   2.720  10.103   2.381
  117   3HD2  LEU  16          3HD2      LEU  16   4.246  10.237   3.244
  118    H    GLU  17           HN       GLU  17   2.496  12.997  -2.001
  119    HA   GLU  17           HA       GLU  17   0.591  15.126  -1.573
  120   1HB   GLU  17          2HB       GLU  17   2.091  14.280  -4.054
  121   2HB   GLU  17          1HB       GLU  17   1.361  15.854  -3.806
  122   1HG   GLU  17          1HG       GLU  17   2.966  16.522  -2.197
  123   2HG   GLU  17          2HG       GLU  17   3.560  14.881  -1.943
  124    H    SER  18           H        SER  18  -0.913  12.742  -1.487
  125    HA   SER  18           HA       SER  18  -2.297  12.483  -4.115
  126   1HB   SER  18          2HB       SER  18  -1.698  10.425  -2.835
  127   2HB   SER  18          1HB       SER  18  -2.751  10.966  -1.511
  128    HG   SER  18           HG       SER  18  -4.213   9.903  -2.673
  129    H    SER  19           H        SER  19  -4.773  12.019  -3.346
  130    HA   SER  19           HA       SER  19  -5.861  14.362  -1.825
  131   1HB   SER  19          1HB       SER  19  -7.679  14.400  -3.590
  132   2HB   SER  19          2HB       SER  19  -6.083  14.935  -4.157
  133    HG   SER  19           HG       SER  19  -6.958  13.461  -5.642
  134    H    VAL  20           H        VAL  20  -6.937  11.546  -3.621
  135    HA   VAL  20           HA       VAL  20  -8.712  10.573  -1.505
  136    HB   VAL  20           HB       VAL  20  -9.287   8.870  -3.131
  137   1HG1  VAL  20          1HG2      VAL  20  -7.016   8.315  -4.013
  138   2HG1  VAL  20          2HG2      VAL  20  -7.000   9.857  -4.891
  139   3HG1  VAL  20          3HG2      VAL  20  -8.196   8.610  -5.292
  140   1HG2  VAL  20          1HG1      VAL  20  -8.958  11.480  -4.620
  141   2HG2  VAL  20          2HG1      VAL  20 -10.121  10.182  -4.934
  142   3HG2  VAL  20          3HG1      VAL  20 -10.230  11.118  -3.433
  143    HA   PRO  21           HA       PRO  21  -5.746   8.168   0.624
  144   1HB   PRO  21          1HB       PRO  21  -6.825   5.753   1.254
  145   2HB   PRO  21          2HB       PRO  21  -7.381   7.307   1.936
  146   1HG   PRO  21          2HG       PRO  21  -8.587   5.821  -0.406
  147   2HG   PRO  21          1HG       PRO  21  -9.395   6.447   1.057
  148   1HD   PRO  21          2HD       PRO  21  -9.329   7.822  -1.296
  149   2HD   PRO  21          1HD       PRO  21  -9.276   8.669   0.244
  150    H    VAL  22           H        VAL  22  -4.319   6.356   0.516
  151    HA   VAL  22           HA       VAL  22  -4.062   4.957  -2.077
  152    HB   VAL  22           HB       VAL  22  -1.818   6.450  -0.660
  153   1HG1  VAL  22          1HG1      VAL  22  -1.073   4.441  -1.926
  154   2HG1  VAL  22          2HG1      VAL  22  -0.463   5.958  -2.595
  155   3HG1  VAL  22          3HG1      VAL  22  -1.782   5.122  -3.395
  156   1HG2  VAL  22          1HG2      VAL  22  -3.452   7.266  -3.079
  157   2HG2  VAL  22          2HG2      VAL  22  -3.213   8.142  -1.559
  158   3HG2  VAL  22          3HG2      VAL  22  -1.870   7.949  -2.686
  159    H    LEU  23           H        LEU  23  -3.623   2.808  -1.753
  160    HA   LEU  23           HA       LEU  23  -2.847   1.896   1.008
  161   1HB   LEU  23          2HB       LEU  23  -4.982   1.045   0.024
  162   2HB   LEU  23          1HB       LEU  23  -4.082   0.242  -1.235
  163    HG   LEU  23           HG       LEU  23  -3.646  -0.255   1.744
  164   1HD1  LEU  23          1HD1      LEU  23  -1.703  -1.052   0.523
  165   2HD1  LEU  23          2HD1      LEU  23  -2.700  -2.459   0.854
  166   3HD1  LEU  23          3HD1      LEU  23  -2.715  -1.742  -0.760
  167   1HD2  LEU  23          1HD2      LEU  23  -5.343  -1.796  -0.259
  168   2HD2  LEU  23          2HD2      LEU  23  -4.972  -2.317   1.401
  169   3HD2  LEU  23          3HD2      LEU  23  -5.928  -0.858   1.136
  170    H    VAL  24           H        VAL  24  -0.585   1.918   0.979
  171    HA   VAL  24           HA       VAL  24   0.768   0.962  -1.543
  172    HB   VAL  24           HB       VAL  24   2.730   1.912  -0.873
  173   1HG1  VAL  24          1HG2      VAL  24   0.592   3.901   0.032
  174   2HG1  VAL  24          2HG2      VAL  24   1.115   3.633  -1.636
  175   3HG1  VAL  24          3HG2      VAL  24   2.256   4.261  -0.459
  176   1HG2  VAL  24          1HG1      VAL  24   3.137   2.982   1.310
  177   2HG2  VAL  24          2HG1      VAL  24   1.551   2.370   1.854
  178   3HG2  VAL  24          3HG1      VAL  24   2.878   1.244   1.453
  179    H    ASP  25           HN       ASP  25   1.685  -1.012  -1.548
  180    HA   ASP  25           HA       ASP  25   1.892  -2.529   1.050
  181   1HB   ASP  25          2HB       ASP  25   0.466  -3.679  -0.540
  182   2HB   ASP  25          1HB       ASP  25   1.693  -3.520  -1.806
  183    H    PHE  26           H        PHE  26   3.964  -2.600   1.863
  184    HA   PHE  26           HA       PHE  26   6.246  -1.901   0.072
  185   1HB   PHE  26          2HB       PHE  26   6.024  -2.719   3.000
  186   2HB   PHE  26          1HB       PHE  26   7.545  -2.454   2.163
  187    HD1  PHE  26           HD1      PHE  26   8.541  -0.322   2.218
  188    HD2  PHE  26           HD2      PHE  26   4.278  -0.619   2.893
  189    HE1  PHE  26           HE1      PHE  26   8.470   2.027   2.940
  190    HE2  PHE  26           HE2      PHE  26   4.224   1.747   3.525
  191    HZ   PHE  26           HZ       PHE  26   6.318   3.082   3.601
  192    H    TRP  27           H        TRP  27   6.975  -3.396  -1.278
  193    HA   TRP  27           HA       TRP  27   6.712  -6.314  -0.480
  194   1HB   TRP  27          2HB       TRP  27   5.994  -6.975  -2.581
  195   2HB   TRP  27          1HB       TRP  27   4.985  -5.593  -2.199
  196    HD1  TRP  27           HD1      TRP  27   5.984  -3.273  -3.319
  197    HE1  TRP  27           HE1      TRP  27   7.172  -2.799  -5.586
  198    HE3  TRP  27           HE3      TRP  27   7.249  -8.113  -4.672
  199    HZ2  TRP  27           HZ2      TRP  27   8.634  -4.343  -7.539
  200    HZ3  TRP  27           HZ3      TRP  27   8.068  -8.506  -6.892
  201    HH2  TRP  27           HH2      TRP  27   8.985  -6.703  -8.242
  202    H    ALA  28           H        ALA  28   7.920  -7.598  -2.313
  203    HA   ALA  28           HA       ALA  28  10.117  -6.448  -3.663
  204   1HB   ALA  28          1HB       ALA  28  10.843  -8.253  -1.332
  205   2HB   ALA  28          2HB       ALA  28  11.946  -7.654  -2.587
  206   3HB   ALA  28          3HB       ALA  28  11.218  -6.505  -1.442
  207    HA   PRO  29           HA       PRO  29   9.019 -10.107  -6.120
  208   1HB   PRO  29          2HB       PRO  29  11.958 -10.207  -5.957
  209   2HB   PRO  29          1HB       PRO  29  10.982 -10.831  -7.326
  210   1HG   PRO  29          2HG       PRO  29  12.125  -8.357  -7.431
  211   2HG   PRO  29          1HG       PRO  29  10.365  -8.432  -7.733
  212   1HD   PRO  29          2HD       PRO  29  11.821  -7.635  -5.192
  213   2HD   PRO  29          1HD       PRO  29  10.337  -6.986  -5.838
  214    H    TRP  30           H        TRP  30  11.728 -10.979  -3.896
  215    HA   TRP  30           HA       TRP  30  11.025 -13.734  -3.800
  216   1HB   TRP  30          1HB       TRP  30  12.468 -13.743  -1.768
  217   2HB   TRP  30          2HB       TRP  30  13.207 -12.995  -3.177
  218    HD1  TRP  30           HD1      TRP  30  14.126 -10.620  -2.918
  219    HE1  TRP  30           HE1      TRP  30  14.216  -8.861  -1.025
  220    HE3  TRP  30           HE3      TRP  30  10.971 -12.843   0.463
  221    HZ2  TRP  30           HZ2      TRP  30  13.058  -8.459   1.549
  222    HZ3  TRP  30           HZ3      TRP  30  10.421 -11.701   2.581
  223    HH2  TRP  30           HH2      TRP  30  11.426  -9.499   3.124
  224    H    CYS  31           H        CYS  31   9.354 -11.074  -2.461
  225    HA   CYS  31           HA       CYS  31   8.446 -12.339   0.020
  226   1HB   CYS  31          1HB       CYS  31   8.629  -9.884  -0.191
  227   2HB   CYS  31          2HB       CYS  31   7.382  -9.928  -1.449
  228    H    GLY  32           H        GLY  32   7.801 -14.353  -1.044
  229   1HA   GLY  32          2HA       GLY  32   5.861 -15.010  -2.750
  230   2HA   GLY  32          1HA       GLY  32   5.922 -15.783  -1.163
  231    HA   PRO  33           HA       PRO  33   2.138 -14.018   0.312
  232   1HB   PRO  33          1HB       PRO  33   3.611 -11.898   1.857
  233   2HB   PRO  33          2HB       PRO  33   2.199 -12.866   2.380
  234   1HG   PRO  33          1HG       PRO  33   4.651 -13.577   3.201
  235   2HG   PRO  33          2HG       PRO  33   3.586 -14.850   2.527
  236   1HD   PRO  33          1HD       PRO  33   5.822 -13.369   1.127
  237   2HD   PRO  33          2HD       PRO  33   5.456 -15.118   1.102
  238    H    CYS  34           H        CYS  34   4.435 -11.395  -0.467
  239    HA   CYS  34           HA       CYS  34   2.574  -9.297  -1.030
  240   1HB   CYS  34          1HB       CYS  34   5.195  -9.578  -2.353
  241   2HB   CYS  34          2HB       CYS  34   4.197  -8.190  -2.068
  242    H    ARG  35           HN       ARG  35   4.360 -11.744  -2.996
  243    HA   ARG  35           HA       ARG  35   3.327 -10.944  -5.527
  244   1HB   ARG  35          2HB       ARG  35   4.413 -13.640  -4.564
  245   2HB   ARG  35          1HB       ARG  35   4.066 -13.218  -6.225
  246   1HG   ARG  35          2HG       ARG  35   6.224 -12.060  -4.426
  247   2HG   ARG  35          1HG       ARG  35   6.420 -12.967  -5.921
  248   1HD   ARG  35          2HD       ARG  35   5.436 -10.120  -5.560
  249   2HD   ARG  35          1HD       ARG  35   6.891 -10.680  -6.396
  250    HE   ARG  35           HE       ARG  35   4.886 -11.918  -7.790
  251   1HH1  ARG  35          2HH2      ARG  35   5.632  -8.551  -7.003
  252   2HH1  ARG  35          1HH2      ARG  35   4.776  -7.895  -8.369
  253   1HH2  ARG  35          2HH1      ARG  35   3.750 -11.072  -9.567
  254   2HH2  ARG  35          1HH1      ARG  35   3.695  -9.356  -9.861
  255    H    ILE  36           H        ILE  36   2.166 -13.498  -3.250
  256    HA   ILE  36           HA       ILE  36   0.024 -14.144  -5.118
  257    HB   ILE  36           HB       ILE  36  -0.897 -15.600  -3.429
  258   1HG1  ILE  36          2HG1      ILE  36   0.644 -16.019  -1.371
  259   2HG1  ILE  36          1HG1      ILE  36   1.134 -14.347  -1.588
  260   1HG2  ILE  36          1HG2      ILE  36   2.137 -15.825  -3.648
  261   2HG2  ILE  36          2HG2      ILE  36   0.981 -17.143  -3.387
  262   3HG2  ILE  36          3HG2      ILE  36   0.982 -16.265  -4.921
  263   1HD1  ILE  36          1HD1      ILE  36  -1.699 -15.401  -1.119
  264   2HD1  ILE  36          2HD1      ILE  36  -1.300 -13.686  -1.306
  265   3HD1  ILE  36          3HD1      ILE  36  -0.676 -14.587   0.081
  266    H    ILE  37           H        ILE  37   0.230 -11.656  -2.535
  267    HA   ILE  37           HA       ILE  37  -2.675 -11.192  -2.876
  268    HB   ILE  37           HB       ILE  37  -2.481  -9.278  -1.473
  269   1HG1  ILE  37          1HG1      ILE  37   0.488  -9.797  -1.461
  270   2HG1  ILE  37          2HG1      ILE  37  -0.334  -8.348  -2.043
  271   1HG2  ILE  37          1HG2      ILE  37  -0.953 -11.597  -0.225
  272   2HG2  ILE  37          2HG2      ILE  37  -2.064 -10.467   0.568
  273   3HG2  ILE  37          3HG2      ILE  37  -2.689 -11.639  -0.589
  274   1HD1  ILE  37          1HD1      ILE  37  -1.148  -7.980   0.336
  275   2HD1  ILE  37          2HD1      ILE  37   0.612  -7.865   0.119
  276   3HD1  ILE  37          3HD1      ILE  37  -0.085  -9.319   0.838
  277    H    ALA  38           H        ALA  38   0.332  -9.735  -4.308
  278    HA   ALA  38           HA       ALA  38  -0.329  -7.662  -5.528
  279   1HB   ALA  38          1HB       ALA  38   1.718  -8.949  -5.975
  280   2HB   ALA  38          2HB       ALA  38   1.034  -8.214  -7.431
  281   3HB   ALA  38          3HB       ALA  38   0.832  -9.945  -7.149
  282    HA   PRO  39           HA       PRO  39  -3.034  -9.361  -9.188
  283   1HB   PRO  39          1HB       PRO  39  -4.548 -11.565  -7.831
  284   2HB   PRO  39          2HB       PRO  39  -3.930 -11.501  -9.503
  285   1HG   PRO  39          2HG       PRO  39  -2.717 -13.062  -7.612
  286   2HG   PRO  39          1HG       PRO  39  -1.739 -12.131  -8.788
  287   1HD   PRO  39          1HD       PRO  39  -2.479 -11.318  -5.954
  288   2HD   PRO  39          2HD       PRO  39  -0.871 -11.353  -6.707
  289    H    VAL  40           H        VAL  40  -3.951  -9.770  -5.810
  290    HA   VAL  40           HA       VAL  40  -6.631  -8.672  -6.087
  291    HB   VAL  40           HB       VAL  40  -5.187  -9.054  -3.445
  292   1HG1  VAL  40          1HG1      VAL  40  -7.532  -8.137  -3.631
  293   2HG1  VAL  40          2HG1      VAL  40  -7.438  -9.676  -2.736
  294   3HG1  VAL  40          3HG1      VAL  40  -8.000  -9.669  -4.410
  295   1HG2  VAL  40          1HG2      VAL  40  -4.650 -11.180  -4.561
  296   2HG2  VAL  40          2HG2      VAL  40  -6.311 -11.304  -5.179
  297   3HG2  VAL  40          3HG2      VAL  40  -5.982 -11.438  -3.441
  298    H    VAL  41           H        VAL  41  -3.467  -7.671  -4.741
  299    HA   VAL  41           HA       VAL  41  -4.132  -4.998  -3.948
  300    HB   VAL  41           HB       VAL  41  -1.866  -6.646  -3.976
  301   1HG1  VAL  41          1HG2      VAL  41  -0.840  -4.988  -2.551
  302   2HG1  VAL  41          2HG2      VAL  41  -2.580  -4.815  -2.261
  303   3HG1  VAL  41          3HG2      VAL  41  -1.722  -3.669  -3.305
  304   1HG2  VAL  41          1HG1      VAL  41  -1.136  -5.778  -6.179
  305   2HG2  VAL  41          2HG1      VAL  41  -0.932  -4.200  -5.419
  306   3HG2  VAL  41          3HG1      VAL  41  -0.018  -5.597  -4.826
  307    H    ASP  42           HN       ASP  42  -3.373  -6.342  -7.160
  308    HA   ASP  42           HA       ASP  42  -3.632  -3.771  -8.470
  309   1HB   ASP  42          2HB       ASP  42  -2.579  -5.866  -9.452
  310   2HB   ASP  42          1HB       ASP  42  -4.203  -6.489  -9.723
  311    H    GLU  43           HN       GLU  43  -5.895  -6.531  -8.299
  312    HA   GLU  43           HA       GLU  43  -8.015  -5.316  -9.581
  313   1HB   GLU  43          1HB       GLU  43  -9.253  -7.070  -9.034
  314   2HB   GLU  43          2HB       GLU  43  -7.745  -7.757  -8.443
  315   1HG   GLU  43          2HG       GLU  43  -8.419  -7.015  -6.107
  316   2HG   GLU  43          1HG       GLU  43  -9.927  -6.386  -6.778
  317    H    ILE  44           H        ILE  44  -7.243  -4.934  -6.106
  318    HA   ILE  44           HA       ILE  44  -9.540  -3.509  -5.338
  319    HB   ILE  44           HB       ILE  44  -6.643  -3.278  -4.424
  320   1HG1  ILE  44          2HG1      ILE  44  -7.830  -5.470  -4.016
  321   2HG1  ILE  44          1HG1      ILE  44  -7.273  -4.644  -2.568
  322   1HG2  ILE  44          1HG2      ILE  44  -9.123  -2.021  -3.167
  323   2HG2  ILE  44          2HG2      ILE  44  -7.707  -1.176  -3.792
  324   3HG2  ILE  44          3HG2      ILE  44  -7.552  -2.194  -2.358
  325   1HD1  ILE  44          1HD1      ILE  44 -10.147  -4.723  -3.589
  326   2HD1  ILE  44          2HD1      ILE  44  -9.459  -5.692  -2.287
  327   3HD1  ILE  44          3HD1      ILE  44  -9.597  -3.940  -2.086
  328    H    ALA  45           H        ALA  45  -6.663  -2.257  -7.081
  329    HA   ALA  45           HA       ALA  45  -7.507   0.523  -6.898
  330   1HB   ALA  45          1HB       ALA  45  -5.164  -0.051  -7.334
  331   2HB   ALA  45          2HB       ALA  45  -5.640  -0.919  -8.806
  332   3HB   ALA  45          3HB       ALA  45  -5.833   0.846  -8.699
  333    H    GLY  46           H        GLY  46  -8.347  -2.215  -8.949
  334   1HA   GLY  46          1HA       GLY  46  -9.620  -0.674 -11.071
  335   2HA   GLY  46          2HA       GLY  46  -9.747  -2.408 -10.748
  336    H    GLU  47           HN       GLU  47 -10.681  -2.518  -8.168
  337    HA   GLU  47           HA       GLU  47 -13.483  -1.967  -8.540
  338   1HB   GLU  47          1HB       GLU  47 -11.868  -3.082  -6.210
  339   2HB   GLU  47          2HB       GLU  47 -13.634  -3.010  -6.281
  340   1HG   GLU  47          1HG       GLU  47 -13.608  -4.456  -8.297
  341   2HG   GLU  47          2HG       GLU  47 -11.842  -4.533  -8.233
  342    H    TYR  48           H        TYR  48 -11.287  -0.951  -5.911
  343    HA   TYR  48           HA       TYR  48 -13.317   0.951  -4.897
  344   1HB   TYR  48          1HB       TYR  48 -10.596   0.077  -3.863
  345   2HB   TYR  48          2HB       TYR  48 -11.664   1.203  -3.034
  346    HD1  TYR  48           HD1      TYR  48 -13.624   0.480  -1.820
  347    HD2  TYR  48           HD2      TYR  48 -11.281  -2.348  -4.072
  348    HE1  TYR  48           HE1      TYR  48 -14.794  -1.384  -0.699
  349    HE2  TYR  48           HE2      TYR  48 -12.507  -4.218  -2.992
  350    HH   TYR  48           HH       TYR  48 -14.883  -3.684  -0.390
  351    H    LYS  49           HN       LYS  49 -11.671   1.330  -7.450
  352    HA   LYS  49           HA       LYS  49  -9.792   3.248  -7.587
  353   1HB   LYS  49          2HB       LYS  49 -10.819   3.843  -9.762
  354   2HB   LYS  49          1HB       LYS  49 -10.893   2.103  -9.426
  355   1HG   LYS  49          1HG       LYS  49 -13.257   2.339  -8.701
  356   2HG   LYS  49          2HG       LYS  49 -13.245   4.012  -9.288
  357   1HD   LYS  49          2HD       LYS  49 -13.016   3.390 -11.520
  358   2HD   LYS  49          1HD       LYS  49 -12.401   1.776 -11.143
  359   1HE   LYS  49          1HE       LYS  49 -15.255   2.681 -10.550
  360   2HE   LYS  49          2HE       LYS  49 -14.747   1.754 -11.972
  361   1HZ   LYS  49          1HZ       LYS  49 -15.544   0.271 -10.351
  362   2HZ   LYS  49          2HZ       LYS  49 -13.906   0.065 -10.461
  363   3HZ   LYS  49          3HZ       LYS  49 -14.545   0.857  -9.178
  364    H    ASP  50           HN       ASP  50 -13.148   3.739  -7.080
  365    HA   ASP  50           HA       ASP  50 -13.800   6.356  -7.123
  366   1HB   ASP  50          2HB       ASP  50 -15.169   4.394  -6.282
  367   2HB   ASP  50          1HB       ASP  50 -14.368   4.535  -4.725
  368    H    LYS  51           HN       LYS  51 -12.045   4.788  -4.520
  369    HA   LYS  51           HA       LYS  51 -11.055   7.439  -3.502
  370   1HB   LYS  51          1HB       LYS  51 -12.222   5.110  -1.966
  371   2HB   LYS  51          2HB       LYS  51 -11.071   6.150  -1.194
  372   1HG   LYS  51          2HG       LYS  51 -12.483   8.126  -1.626
  373   2HG   LYS  51          1HG       LYS  51 -13.606   7.176  -2.594
  374   1HD   LYS  51          1HD       LYS  51 -13.124   6.756   0.398
  375   2HD   LYS  51          2HD       LYS  51 -14.438   7.699  -0.317
  376   1HE   LYS  51          2HE       LYS  51 -15.160   5.626  -1.589
  377   2HE   LYS  51          1HE       LYS  51 -14.005   4.695  -0.618
  378   1HZ   LYS  51          1HZ       LYS  51 -15.199   5.397   1.341
  379   2HZ   LYS  51          2HZ       LYS  51 -16.238   6.288   0.425
  380   3HZ   LYS  51          3HZ       LYS  51 -16.205   4.651   0.279
  381    H    LEU  52           H        LEU  52 -10.508   3.917  -3.438
  382    HA   LEU  52           HA       LEU  52  -7.962   4.472  -2.143
  383   1HB   LEU  52          1HB       LEU  52  -9.701   2.738  -1.495
  384   2HB   LEU  52          2HB       LEU  52  -9.089   1.756  -2.829
  385    HG   LEU  52           HG       LEU  52  -6.889   1.646  -1.797
  386   1HD1  LEU  52          1HD2      LEU  52  -6.474   3.752  -0.731
  387   2HD1  LEU  52          2HD2      LEU  52  -7.954   3.628   0.253
  388   3HD1  LEU  52          3HD2      LEU  52  -6.574   2.580   0.576
  389   1HD2  LEU  52          1HD1      LEU  52  -9.147   1.349   0.271
  390   2HD2  LEU  52          2HD1      LEU  52  -7.620   0.448   0.282
  391   3HD2  LEU  52          3HD1      LEU  52  -8.808   0.173  -1.016
  392    H    LYS  53           HN       LYS  53  -6.236   4.901  -3.162
  393    HA   LYS  53           HA       LYS  53  -5.682   3.891  -5.875
  394   1HB   LYS  53          2HB       LYS  53  -5.162   6.282  -4.530
  395   2HB   LYS  53          1HB       LYS  53  -3.621   5.478  -4.430
  396   1HG   LYS  53          1HG       LYS  53  -5.116   5.905  -7.032
  397   2HG   LYS  53          2HG       LYS  53  -3.792   6.898  -6.402
  398   1HD   LYS  53          2HD       LYS  53  -2.290   4.893  -6.388
  399   2HD   LYS  53          1HD       LYS  53  -3.591   3.910  -7.070
  400   1HE   LYS  53          1HE       LYS  53  -2.107   4.553  -8.855
  401   2HE   LYS  53          2HE       LYS  53  -3.649   5.396  -9.079
  402   1HZ   LYS  53          1HZ       LYS  53  -1.755   6.823  -9.411
  403   2HZ   LYS  53          2HZ       LYS  53  -1.227   6.547  -7.874
  404   3HZ   LYS  53          3HZ       LYS  53  -2.645   7.346  -8.129
  405    H    CYS  54           H        CYS  54  -5.367   1.607  -5.485
  406    HA   CYS  54           HA       CYS  54  -3.607   0.820  -3.291
  407   1HB   CYS  54          1HB       CYS  54  -5.571  -0.541  -4.192
  408   2HB   CYS  54          2HB       CYS  54  -4.489  -1.019  -5.532
  409    HG   CYS  54           HG       CYS  54  -3.231  -2.596  -4.396
  410    H    VAL  55           H        VAL  55  -1.429   0.041  -3.455
  411    HA   VAL  55           HA       VAL  55  -0.113  -0.085  -6.039
  412    HB   VAL  55           HB       VAL  55   1.423   1.746  -5.810
  413   1HG1  VAL  55          1HG2      VAL  55   1.925   1.583  -3.459
  414   2HG1  VAL  55          2HG2      VAL  55   0.307   2.298  -3.135
  415   3HG1  VAL  55          3HG2      VAL  55   1.582   3.234  -3.963
  416   1HG2  VAL  55          1HG1      VAL  55  -0.835   2.743  -6.512
  417   2HG2  VAL  55          2HG1      VAL  55  -1.123   3.081  -4.796
  418   3HG2  VAL  55          3HG1      VAL  55   0.221   3.845  -5.644
  419    H    LYS  56           HN       LYS  56   2.376  -0.283  -5.678
  420    HA   LYS  56           HA       LYS  56   2.979  -1.603  -3.113
  421   1HB   LYS  56          2HB       LYS  56   3.686  -3.609  -4.170
  422   2HB   LYS  56          1HB       LYS  56   2.089  -3.226  -4.813
  423   1HG   LYS  56          1HG       LYS  56   3.326  -2.101  -6.801
  424   2HG   LYS  56          2HG       LYS  56   4.784  -2.848  -6.183
  425   1HD   LYS  56          2HD       LYS  56   4.151  -4.431  -7.726
  426   2HD   LYS  56          1HD       LYS  56   3.433  -5.088  -6.251
  427   1HE   LYS  56          1HE       LYS  56   1.803  -5.205  -8.065
  428   2HE   LYS  56          2HE       LYS  56   1.248  -3.995  -6.902
  429   1HZ   LYS  56          1HZ       LYS  56   1.085  -3.288  -9.218
  430   2HZ   LYS  56          2HZ       LYS  56   2.067  -2.294  -8.362
  431   3HZ   LYS  56          3HZ       LYS  56   2.715  -3.407  -9.391
  432    H    LEU  57           H        LEU  57   5.076  -1.339  -2.422
  433    HA   LEU  57           HA       LEU  57   6.905   0.182  -4.203
  434   1HB   LEU  57          2HB       LEU  57   7.149   1.674  -2.760
  435   2HB   LEU  57          1HB       LEU  57   5.759   1.091  -1.864
  436    HG   LEU  57           HG       LEU  57   7.525   0.005  -0.319
  437   1HD1  LEU  57          1HD1      LEU  57   7.347   3.015  -0.880
  438   2HD1  LEU  57          2HD1      LEU  57   8.087   2.363   0.572
  439   3HD1  LEU  57          3HD1      LEU  57   6.359   2.075   0.258
  440   1HD2  LEU  57          1HD2      LEU  57   9.546   0.128  -1.819
  441   2HD2  LEU  57          2HD2      LEU  57   9.340   1.886  -1.913
  442   3HD2  LEU  57          3HD2      LEU  57   9.764   1.101  -0.378
  443    H    ASN  58           H        ASN  58   8.774  -0.651  -4.761
  444    HA   ASN  58           HA       ASN  58   9.449  -3.261  -3.649
  445   1HB   ASN  58          1HB       ASN  58   9.765  -2.780  -6.042
  446   2HB   ASN  58          2HB       ASN  58  10.971  -1.558  -5.652
  447   1HD2  ASN  58          2HD2      ASN  58  10.704  -4.690  -6.679
  448   2HD2  ASN  58          1HD2      ASN  58  12.224  -5.310  -6.052
  449    H    THR  59           H        THR  59  10.252  -3.421  -1.806
  450    HA   THR  59           HA       THR  59  11.304  -1.362  -0.173
  451    HB   THR  59           HB       THR  59  11.358  -4.414   0.023
  452    HG1  THR  59           HG1      THR  59   9.294  -3.658  -0.136
  453   1HG2  THR  59          1HG2      THR  59  12.924  -3.502   1.622
  454   2HG2  THR  59          2HG2      THR  59  11.448  -4.028   2.454
  455   3HG2  THR  59          3HG2      THR  59  11.726  -2.288   2.150
  456    H    ASP  60           HN       ASP  60  12.870  -3.832  -2.163
  457    HA   ASP  60           HA       ASP  60  15.521  -3.543  -0.984
  458   1HB   ASP  60          2HB       ASP  60  14.792  -5.634  -1.872
  459   2HB   ASP  60          1HB       ASP  60  14.298  -4.909  -3.385
  460    H    GLU  61           HN       GLU  61  13.797  -2.327  -3.819
  461    HA   GLU  61           HA       GLU  61  16.027  -0.786  -4.886
  462   1HB   GLU  61          2HB       GLU  61  14.239  -1.798  -6.280
  463   2HB   GLU  61          1HB       GLU  61  13.041  -0.804  -5.438
  464   1HG   GLU  61          1HG       GLU  61  13.520   0.106  -7.639
  465   2HG   GLU  61          2HG       GLU  61  13.989   1.252  -6.390
  466    H    SER  62           H        SER  62  13.366  -0.210  -2.625
  467    HA   SER  62           HA       SER  62  14.190   2.649  -2.269
  468   1HB   SER  62          1HB       SER  62  11.455   1.469  -2.688
  469   2HB   SER  62          2HB       SER  62  11.774   3.071  -2.023
  470    HG   SER  62           HG       SER  62  13.341   2.716  -4.170
  471    HA   PRO  63           HA       PRO  63  14.104   0.203   1.757
  472   1HB   PRO  63          2HB       PRO  63  16.704   0.694   2.473
  473   2HB   PRO  63          1HB       PRO  63  16.201  -0.594   1.349
  474   1HG   PRO  63          1HG       PRO  63  17.309   2.073   0.535
  475   2HG   PRO  63          2HG       PRO  63  17.824   0.446   0.013
  476   1HD   PRO  63          1HD       PRO  63  16.040   1.854  -1.463
  477   2HD   PRO  63          2HD       PRO  63  15.842   0.103  -1.251
  478    H    ASN  64           H        ASN  64  15.541   3.062   0.648
  479    HA   ASN  64           HA       ASN  64  15.838   4.892   2.648
  480   1HB   ASN  64          1HB       ASN  64  14.346   5.457   0.048
  481   2HB   ASN  64          2HB       ASN  64  15.028   6.692   1.119
  482   1HD2  ASN  64          2HD2      ASN  64  15.822   6.496  -1.663
  483   2HD2  ASN  64          1HD2      ASN  64  17.487   5.962  -1.634
  484    H    VAL  65           H        VAL  65  12.623   4.787   1.076
  485    HA   VAL  65           HA       VAL  65  11.325   6.176   3.190
  486    HB   VAL  65           HB       VAL  65  10.377   4.464   0.867
  487   1HG1  VAL  65          1HG2      VAL  65   8.629   6.030   2.803
  488   2HG1  VAL  65          2HG2      VAL  65   8.641   4.264   2.619
  489   3HG1  VAL  65          3HG2      VAL  65   8.117   5.272   1.275
  490   1HG2  VAL  65          1HG1      VAL  65  10.346   7.451   1.545
  491   2HG2  VAL  65          2HG1      VAL  65  11.413   6.660   0.376
  492   3HG2  VAL  65          3HG1      VAL  65   9.660   6.742   0.075
  493    H    ALA  66           H        ALA  66  11.571   2.709   2.493
  494    HA   ALA  66           HA       ALA  66   9.940   1.756   4.594
  495   1HB   ALA  66          1HB       ALA  66  11.149  -0.342   4.401
  496   2HB   ALA  66          2HB       ALA  66  10.940   0.341   2.777
  497   3HB   ALA  66          3HB       ALA  66  12.510   0.446   3.599
  498    H    SER  67           H        SER  67  13.293   2.905   4.716
  499    HA   SER  67           HA       SER  67  13.724   2.157   7.484
  500   1HB   SER  67          2HB       SER  67  15.250   4.169   5.770
  501   2HB   SER  67          1HB       SER  67  15.798   3.383   7.259
  502    HG   SER  67           HG       SER  67  15.133   2.073   4.816
  503    H    GLU  68           HN       GLU  68  12.952   5.166   5.738
  504    HA   GLU  68           HA       GLU  68  12.892   6.959   7.933
  505   1HB   GLU  68          1HB       GLU  68  11.207   6.886   5.398
  506   2HB   GLU  68          2HB       GLU  68  11.245   8.250   6.511
  507   1HG   GLU  68          2HG       GLU  68  13.487   8.790   6.020
  508   2HG   GLU  68          1HG       GLU  68  13.835   7.218   5.306
  509    H    TYR  69           H        TYR  69  10.284   4.884   6.609
  510    HA   TYR  69           HA       TYR  69   8.383   5.693   8.693
  511   1HB   TYR  69          2HB       TYR  69   8.367   3.761   6.360
  512   2HB   TYR  69          1HB       TYR  69   7.159   3.643   7.625
  513    HD1  TYR  69           HD1      TYR  69   8.677   6.142   5.254
  514    HD2  TYR  69           HD2      TYR  69   5.270   5.099   7.680
  515    HE1  TYR  69           HE1      TYR  69   7.544   8.210   4.541
  516    HE2  TYR  69           HE2      TYR  69   4.136   7.191   6.961
  517    HH   TYR  69           HH       TYR  69   5.738   9.607   4.897
  518    H    GLY  70           H        GLY  70  10.595   2.945   8.141
  519   1HA   GLY  70          2HA       GLY  70  11.625   1.745   9.850
  520   2HA   GLY  70          1HA       GLY  70  10.425   2.302  11.022
  521    H    ILE  71           H        ILE  71  10.339   0.577   7.880
  522    HA   ILE  71           HA       ILE  71   8.145  -1.144   8.635
  523    HB   ILE  71           HB       ILE  71  10.210  -1.333   6.397
  524   1HG1  ILE  71          1HG1      ILE  71   8.790   0.744   6.358
  525   2HG1  ILE  71          2HG1      ILE  71   8.620  -0.315   4.964
  526   1HG2  ILE  71          1HG2      ILE  71   7.607  -2.859   6.834
  527   2HG2  ILE  71          2HG2      ILE  71   8.448  -2.764   5.270
  528   3HG2  ILE  71          3HG2      ILE  71   9.246  -3.518   6.652
  529   1HD1  ILE  71          1HD1      ILE  71   6.484   0.665   5.764
  530   2HD1  ILE  71          2HD1      ILE  71   6.648  -0.222   7.282
  531   3HD1  ILE  71          3HD1      ILE  71   6.458  -1.102   5.744
  532    H    ARG  72           HN       ARG  72   8.183  -3.042   9.741
  533    HA   ARG  72           HA       ARG  72  10.695  -3.912  10.909
  534   1HB   ARG  72          1HB       ARG  72   8.227  -3.896  11.908
  535   2HB   ARG  72          2HB       ARG  72   8.070  -5.422  11.060
  536   1HG   ARG  72          2HG       ARG  72   8.699  -5.944  13.284
  537   2HG   ARG  72          1HG       ARG  72  10.124  -6.254  12.291
  538   1HD   ARG  72          1HD       ARG  72  10.708  -5.176  14.401
  539   2HD   ARG  72          2HD       ARG  72  11.145  -4.113  13.086
  540    HE   ARG  72           HE       ARG  72   8.999  -3.811  15.107
  541   1HH1  ARG  72          2HH2      ARG  72  10.481  -2.416  12.207
  542   2HH1  ARG  72          1HH2      ARG  72   9.570  -0.940  12.276
  543   1HH2  ARG  72          2HH1      ARG  72   7.948  -1.819  15.319
  544   2HH2  ARG  72          1HH1      ARG  72   8.215  -0.545  14.159
  545    H    SER  73           H        SER  73   8.449  -5.198   8.458
  546    HA   SER  73           HA       SER  73  10.411  -6.735   7.092
  547   1HB   SER  73          1HB       SER  73   8.365  -8.199   8.833
  548   2HB   SER  73          2HB       SER  73   9.135  -8.956   7.437
  549    HG   SER  73           HG       SER  73  10.789  -7.758   9.352
  550    H    ILE  74           H        ILE  74   8.974  -8.099   5.370
  551    HA   ILE  74           HA       ILE  74   6.580  -6.480   4.682
  552    HB   ILE  74           HB       ILE  74   7.190  -6.888   2.294
  553   1HG1  ILE  74          1HG1      ILE  74   9.989  -7.500   3.297
  554   2HG1  ILE  74          2HG1      ILE  74   8.849  -8.725   2.701
  555   1HG2  ILE  74          1HG2      ILE  74   9.226  -5.231   3.870
  556   2HG2  ILE  74          2HG2      ILE  74   8.644  -4.937   2.220
  557   3HG2  ILE  74          3HG2      ILE  74   7.548  -4.729   3.581
  558   1HD1  ILE  74          1HD1      ILE  74  10.277  -8.095   0.878
  559   2HD1  ILE  74          2HD1      ILE  74   9.935  -6.377   1.097
  560   3HD1  ILE  74          3HD1      ILE  74   8.653  -7.486   0.552
  561    HA   PRO  75           HA       PRO  75   4.970  -6.938   2.772
  562   1HB   PRO  75          1HB       PRO  75   2.341  -7.580   3.062
  563   2HB   PRO  75          2HB       PRO  75   3.403  -8.292   1.846
  564   1HG   PRO  75          1HG       PRO  75   2.736  -9.414   4.611
  565   2HG   PRO  75          2HG       PRO  75   2.602 -10.276   3.051
  566   1HD   PRO  75          1HD       PRO  75   4.738 -10.496   4.756
  567   2HD   PRO  75          2HD       PRO  75   5.005 -10.493   2.999
  568    H    THR  76           H        THR  76   4.069  -5.124   3.439
  569    HA   THR  76           HA       THR  76   2.758  -4.840   6.036
  570    HB   THR  76           HB       THR  76   5.345  -3.357   5.433
  571    HG1  THR  76           HG1      THR  76   5.798  -5.094   6.684
  572   1HG2  THR  76          1HG2      THR  76   3.171  -2.762   7.496
  573   2HG2  THR  76          2HG2      THR  76   3.730  -1.677   6.202
  574   3HG2  THR  76          3HG2      THR  76   4.810  -2.089   7.542
  575    H    ILE  77           H        ILE  77   0.960  -3.929   5.431
  576    HA   ILE  77           HA       ILE  77   0.766  -2.280   2.981
  577    HB   ILE  77           HB       ILE  77  -1.203  -3.764   4.767
  578   1HG1  ILE  77          1HG1      ILE  77  -2.037  -4.451   2.456
  579   2HG1  ILE  77          2HG1      ILE  77  -0.606  -3.687   1.769
  580   1HG2  ILE  77          1HG2      ILE  77  -2.260  -1.618   4.599
  581   2HG2  ILE  77          2HG2      ILE  77  -3.037  -2.664   3.420
  582   3HG2  ILE  77          3HG2      ILE  77  -1.832  -1.472   2.884
  583   1HD1  ILE  77          1HD1      ILE  77  -0.579  -5.940   3.839
  584   2HD1  ILE  77          2HD1      ILE  77   0.836  -5.286   2.984
  585   3HD1  ILE  77          3HD1      ILE  77  -0.406  -6.163   2.087
  586    H    MET  78           H        MET  78   0.339  -0.079   3.167
  587    HA   MET  78           HA       MET  78  -0.260   1.008   5.886
  588   1HB   MET  78          1HB       MET  78   1.799   2.010   3.943
  589   2HB   MET  78          2HB       MET  78   1.115   3.012   5.224
  590   1HG   MET  78          2HG       MET  78   1.840   1.296   6.906
  591   2HG   MET  78          1HG       MET  78   2.728   0.472   5.618
  592   1HE   MET  78          1HE       MET  78   4.405   0.631   7.646
  593   2HE   MET  78          2HE       MET  78   3.793   1.985   8.627
  594   3HE   MET  78          3HE       MET  78   5.437   2.047   7.960
  595    H    VAL  79           H        VAL  79  -1.931   2.277   5.889
  596    HA   VAL  79           HA       VAL  79  -3.211   2.839   3.284
  597    HB   VAL  79           HB       VAL  79  -4.378   3.010   6.100
  598   1HG1  VAL  79          1HG1      VAL  79  -3.806   0.663   5.573
  599   2HG1  VAL  79          2HG1      VAL  79  -5.546   0.925   5.617
  600   3HG1  VAL  79          3HG1      VAL  79  -4.714   0.789   4.049
  601   1HG2  VAL  79          1HG2      VAL  79  -5.707   3.028   3.351
  602   2HG2  VAL  79          2HG2      VAL  79  -6.527   3.173   4.926
  603   3HG2  VAL  79          3HG2      VAL  79  -5.464   4.461   4.362
  604    H    PHE  80           H        PHE  80  -2.265   4.665   2.568
  605    HA   PHE  80           HA       PHE  80  -1.733   6.947   4.364
  606   1HB   PHE  80          1HB       PHE  80  -1.311   6.383   1.456
  607   2HB   PHE  80          2HB       PHE  80  -1.168   8.017   2.106
  608    HD1  PHE  80           HD1      PHE  80   0.657   8.663   3.552
  609    HD2  PHE  80           HD2      PHE  80   0.177   4.542   2.404
  610    HE1  PHE  80           HE1      PHE  80   2.898   8.146   4.488
  611    HE2  PHE  80           HE2      PHE  80   2.450   4.040   3.313
  612    HZ   PHE  80           HZ       PHE  80   3.764   5.787   4.410
  613    H    LYS  81           HN       LYS  81  -3.190   8.467   4.721
  614    HA   LYS  81           HA       LYS  81  -5.807   8.262   3.376
  615   1HB   LYS  81          2HB       LYS  81  -5.354   7.878   5.915
  616   2HB   LYS  81          1HB       LYS  81  -5.049   9.587   6.057
  617   1HG   LYS  81          1HG       LYS  81  -7.328   8.694   6.776
  618   2HG   LYS  81          2HG       LYS  81  -7.363  10.115   5.760
  619   1HD   LYS  81          2HD       LYS  81  -9.051   8.593   5.037
  620   2HD   LYS  81          1HD       LYS  81  -7.832   8.767   3.785
  621   1HE   LYS  81          2HE       LYS  81  -8.284   6.422   3.831
  622   2HE   LYS  81          1HE       LYS  81  -6.803   6.542   4.774
  623   1HZ   LYS  81          1HZ       LYS  81  -8.390   5.185   5.869
  624   2HZ   LYS  81          2HZ       LYS  81  -9.570   6.324   5.782
  625   3HZ   LYS  81          3HZ       LYS  81  -8.262   6.567   6.752
  626    H    GLY  82           H        GLY  82  -6.059  11.058   4.770
  627   1HA   GLY  82          2HA       GLY  82  -5.491  12.688   2.456
  628   2HA   GLY  82          1HA       GLY  82  -6.060  13.183   4.064
  629    H    GLY  83           H        GLY  83  -3.166  11.927   2.368
  630   1HA   GLY  83          2HA       GLY  83  -0.975  12.758   2.346
  631   2HA   GLY  83          1HA       GLY  83  -1.382  13.955   3.574
  632    H    LYS  84           HN       LYS  84  -2.188  12.745   5.672
  633    HA   LYS  84           HA       LYS  84   0.140  11.197   6.638
  634   1HB   LYS  84          2HB       LYS  84  -2.378  12.123   8.079
  635   2HB   LYS  84          1HB       LYS  84  -0.920  11.506   8.851
  636   1HG   LYS  84          2HG       LYS  84  -1.181  14.076   7.209
  637   2HG   LYS  84          1HG       LYS  84  -1.029  13.965   8.962
  638   1HD   LYS  84          2HD       LYS  84   1.111  13.222   6.905
  639   2HD   LYS  84          1HD       LYS  84   1.074  14.647   7.939
  640   1HE   LYS  84          1HE       LYS  84   1.178  13.166   9.966
  641   2HE   LYS  84          2HE       LYS  84   1.360  11.762   8.895
  642   1HZ   LYS  84          1HZ       LYS  84   3.184  14.050   9.025
  643   2HZ   LYS  84          2HZ       LYS  84   3.452  12.554   9.659
  644   3HZ   LYS  84          3HZ       LYS  84   3.342  12.748   8.026
  645    H    LYS  85           HN       LYS  85  -0.376   9.245   8.121
  646    HA   LYS  85           HA       LYS  85  -1.887   7.359   6.438
  647   1HB   LYS  85          1HB       LYS  85  -0.202   6.931   8.917
  648   2HB   LYS  85          2HB       LYS  85  -0.957   5.664   7.931
  649   1HG   LYS  85          2HG       LYS  85   0.372   6.574   5.947
  650   2HG   LYS  85          1HG       LYS  85   1.332   7.488   7.121
  651   1HD   LYS  85          2HD       LYS  85   0.917   4.473   6.902
  652   2HD   LYS  85          1HD       LYS  85   2.438   5.340   6.681
  653   1HE   LYS  85          1HE       LYS  85   0.875   4.932   9.274
  654   2HE   LYS  85          2HE       LYS  85   2.413   4.177   8.829
  655   1HZ   LYS  85          1HZ       LYS  85   3.439   6.324   8.849
  656   2HZ   LYS  85          2HZ       LYS  85   2.016   7.053   9.253
  657   3HZ   LYS  85          3HZ       LYS  85   2.738   6.013  10.307
  658    H    CYS  86           H        CYS  86  -3.534   6.096   7.057
  659    HA   CYS  86           HA       CYS  86  -5.092   6.799   9.486
  660   1HB   CYS  86          1HB       CYS  86  -6.278   6.520   7.377
  661   2HB   CYS  86          2HB       CYS  86  -5.627   4.898   7.141
  662    HG   CYS  86           HG       CYS  86  -7.225   5.893   9.849
  663    H    GLU  87           HN       GLU  87  -3.743   3.973   7.834
  664    HA   GLU  87           HA       GLU  87  -3.229   2.591  10.433
  665   1HB   GLU  87          2HB       GLU  87  -4.807   1.601   8.026
  666   2HB   GLU  87          1HB       GLU  87  -4.046   0.451   9.114
  667   1HG   GLU  87          1HG       GLU  87  -6.019   2.552  10.090
  668   2HG   GLU  87          2HG       GLU  87  -6.458   0.935   9.526
  669    H    THR  88           H        THR  88  -1.934   0.707  10.265
  670    HA   THR  88           HA       THR  88  -0.139   0.328   7.993
  671    HB   THR  88           HB       THR  88   1.129   1.863   9.396
  672    HG1  THR  88           HG1      THR  88   2.829   0.313   9.999
  673   1HG2  THR  88          1HG2      THR  88   0.768  -0.097  11.714
  674   2HG2  THR  88          2HG2      THR  88  -0.032   1.485  11.588
  675   3HG2  THR  88          3HG2      THR  88   1.728   1.390  11.714
  676    H    ILE  89           H        ILE  89  -0.067  -1.934   7.698
  677    HA   ILE  89           HA       ILE  89  -1.045  -3.664   9.912
  678    HB   ILE  89           HB       ILE  89  -2.133  -3.893   7.080
  679   1HG1  ILE  89          2HG1      ILE  89  -3.498  -2.370   9.344
  680   2HG1  ILE  89          1HG1      ILE  89  -2.849  -1.657   7.854
  681   1HG2  ILE  89          1HG2      ILE  89  -2.234  -5.829   8.739
  682   2HG2  ILE  89          2HG2      ILE  89  -3.800  -5.318   8.138
  683   3HG2  ILE  89          3HG2      ILE  89  -3.269  -4.821   9.760
  684   1HD1  ILE  89          1HD1      ILE  89  -4.401  -3.017   6.495
  685   2HD1  ILE  89          2HD1      ILE  89  -5.179  -3.583   7.991
  686   3HD1  ILE  89          3HD1      ILE  89  -5.197  -1.863   7.582
  687    H    ILE  90           H        ILE  90  -0.005  -5.685   9.868
  688    HA   ILE  90           HA       ILE  90   2.183  -6.024   7.910
  689    HB   ILE  90           HB       ILE  90   1.201  -7.775  10.204
  690   1HG1  ILE  90          2HG1      ILE  90   3.621  -5.915   9.945
  691   2HG1  ILE  90          1HG1      ILE  90   2.171  -5.584  10.902
  692   1HG2  ILE  90          1HG2      ILE  90   3.306  -9.035   9.863
  693   2HG2  ILE  90          2HG2      ILE  90   2.329  -9.098   8.410
  694   3HG2  ILE  90          3HG2      ILE  90   3.720  -7.995   8.483
  695   1HD1  ILE  90          1HD1      ILE  90   2.649  -7.635  12.273
  696   2HD1  ILE  90          2HD1      ILE  90   3.842  -6.328  12.413
  697   3HD1  ILE  90          3HD1      ILE  90   4.221  -7.755  11.443
  698    H    GLY  91           H        GLY  91   2.037  -7.544   6.190
  699   1HA   GLY  91          2HA       GLY  91  -0.706  -8.175   5.342
  700   2HA   GLY  91          1HA       GLY  91   0.758  -8.499   4.442
  701    H    ALA  92           H        ALA  92   0.590 -10.717   4.051
  702    HA   ALA  92           HA       ALA  92   0.579 -12.915   4.348
  703   1HB   ALA  92          1HB       ALA  92   1.270 -13.947   6.413
  704   2HB   ALA  92          2HB       ALA  92   2.229 -12.470   6.208
  705   3HB   ALA  92          3HB       ALA  92   0.879 -12.514   7.367
  706    H    VAL  93           H        VAL  93  -1.602 -11.138   6.499
  707    HA   VAL  93           HA       VAL  93  -3.530 -13.266   6.734
  708    HB   VAL  93           HB       VAL  93  -5.026 -11.513   7.556
  709   1HG1  VAL  93          1HG2      VAL  93  -2.796  -9.517   6.940
  710   2HG1  VAL  93          2HG2      VAL  93  -4.364  -9.608   6.112
  711   3HG1  VAL  93          3HG2      VAL  93  -4.291  -9.195   7.827
  712   1HG2  VAL  93          1HG1      VAL  93  -3.377 -12.572   9.070
  713   2HG2  VAL  93          2HG1      VAL  93  -2.220 -11.268   8.723
  714   3HG2  VAL  93          3HG1      VAL  93  -3.750 -10.905   9.543
  715    HA   PRO  94           HA       PRO  94  -5.210 -13.036   2.685
  716   1HB   PRO  94          2HB       PRO  94  -7.986 -12.981   3.772
  717   2HB   PRO  94          1HB       PRO  94  -7.290 -14.108   2.583
  718   1HG   PRO  94          1HG       PRO  94  -7.698 -14.925   5.165
  719   2HG   PRO  94          2HG       PRO  94  -6.234 -15.407   4.259
  720   1HD   PRO  94          2HD       PRO  94  -6.496 -13.239   6.339
  721   2HD   PRO  94          1HD       PRO  94  -5.212 -14.441   6.110
  722    H    LYS  95           HN       LYS  95  -5.926 -11.460   1.245
  723    HA   LYS  95           HA       LYS  95  -5.850  -8.815   2.055
  724   1HB   LYS  95          2HB       LYS  95  -5.441  -9.780  -0.279
  725   2HB   LYS  95          1HB       LYS  95  -7.200  -9.853  -0.462
  726   1HG   LYS  95          1HG       LYS  95  -6.381  -7.852  -1.538
  727   2HG   LYS  95          2HG       LYS  95  -7.278  -7.352  -0.106
  728   1HD   LYS  95          2HD       LYS  95  -5.114  -7.005   1.098
  729   2HD   LYS  95          1HD       LYS  95  -4.233  -7.594  -0.324
  730   1HE   LYS  95          1HE       LYS  95  -5.109  -5.706  -1.651
  731   2HE   LYS  95          2HE       LYS  95  -6.088  -5.163  -0.273
  732   1HZ   LYS  95          1HZ       LYS  95  -4.056  -3.941  -0.481
  733   2HZ   LYS  95          2HZ       LYS  95  -4.090  -4.771   0.940
  734   3HZ   LYS  95          3HZ       LYS  95  -3.159  -5.313  -0.303
  735    H    ALA  96           H        ALA  96  -8.651 -10.977   1.799
  736    HA   ALA  96           HA       ALA  96 -10.772  -9.138   1.922
  737   1HB   ALA  96          1HB       ALA  96 -11.060 -11.577   1.687
  738   2HB   ALA  96          2HB       ALA  96 -10.489 -11.818   3.355
  739   3HB   ALA  96          3HB       ALA  96 -12.010 -10.952   3.049
  740    H    THR  97           H        THR  97  -8.550 -10.232   4.493
  741    HA   THR  97           HA       THR  97  -9.923  -9.135   6.740
  742    HB   THR  97           HB       THR  97  -6.886  -9.456   6.518
  743    HG1  THR  97           HG1      THR  97  -7.443 -11.275   5.639
  744   1HG2  THR  97          1HG2      THR  97  -7.878  -8.718   8.692
  745   2HG2  THR  97          2HG2      THR  97  -7.130 -10.327   8.786
  746   3HG2  THR  97          3HG2      THR  97  -8.896 -10.183   8.696
  747    H    ILE  98           H        ILE  98  -7.352  -7.989   4.576
  748    HA   ILE  98           HA       ILE  98  -6.956  -5.401   5.779
  749    HB   ILE  98           HB       ILE  98  -6.199  -6.712   3.137
  750   1HG1  ILE  98          2HG1      ILE  98  -4.440  -5.704   5.404
  751   2HG1  ILE  98          1HG1      ILE  98  -5.164  -7.312   5.444
  752   1HG2  ILE  98          1HG2      ILE  98  -5.604  -3.875   4.132
  753   2HG2  ILE  98          2HG2      ILE  98  -6.427  -4.323   2.621
  754   3HG2  ILE  98          3HG2      ILE  98  -4.709  -4.665   2.827
  755   1HD1  ILE  98          1HD1      ILE  98  -4.055  -7.944   3.361
  756   2HD1  ILE  98          2HD1      ILE  98  -3.291  -6.343   3.254
  757   3HD1  ILE  98          3HD1      ILE  98  -2.896  -7.429   4.595
  758    H    VAL  99           H        VAL  99  -8.999  -6.541   3.053
  759    HA   VAL  99           HA       VAL  99 -10.013  -4.043   2.245
  760    HB   VAL  99           HB       VAL  99 -11.169  -6.845   2.189
  761   1HG1  VAL  99          1HG1      VAL  99 -12.808  -5.946   0.508
  762   2HG1  VAL  99          2HG1      VAL  99 -13.122  -5.415   2.159
  763   3HG1  VAL  99          3HG1      VAL  99 -12.352  -4.303   1.000
  764   1HG2  VAL  99          1HG2      VAL  99  -9.163  -6.264   0.745
  765   2HG2  VAL  99          2HG2      VAL  99 -10.140  -4.996  -0.003
  766   3HG2  VAL  99          3HG2      VAL  99 -10.604  -6.702  -0.188
  767    H    GLN 100           H        GLN 100 -11.427  -6.400   4.622
  768    HA   GLN 100           HA       GLN 100 -13.565  -4.728   5.456
  769   1HB   GLN 100          2HB       GLN 100 -11.935  -6.856   6.894
  770   2HB   GLN 100          1HB       GLN 100 -13.345  -6.078   7.632
  771   1HG   GLN 100          1HG       GLN 100 -14.837  -6.880   5.984
  772   2HG   GLN 100          2HG       GLN 100 -13.545  -7.371   4.885
  773   1HE2  GLN 100          1HE2      GLN 100 -12.059  -9.078   5.624
  774   2HE2  GLN 100          2HE2      GLN 100 -12.718 -10.382   6.623
  775    H    THR 101           H        THR 101 -10.240  -4.990   6.754
  776    HA   THR 101           HA       THR 101 -10.575  -3.096   8.839
  777    HB   THR 101           HB       THR 101  -8.011  -3.722   7.310
  778    HG1  THR 101           HG1      THR 101  -8.969  -5.610   8.111
  779   1HG2  THR 101          1HG2      THR 101  -8.544  -2.676  10.131
  780   2HG2  THR 101          2HG2      THR 101  -7.732  -1.795   8.817
  781   3HG2  THR 101          3HG2      THR 101  -6.966  -3.220   9.540
  782    H    VAL 102           H        VAL 102  -9.501  -2.540   5.416
  783    HA   VAL 102           HA       VAL 102  -9.008   0.259   5.960
  784    HB   VAL 102           HB       VAL 102  -7.988  -1.307   4.197
  785   1HG1  VAL 102          1HG2      VAL 102  -7.495   1.130   4.497
  786   2HG1  VAL 102          2HG2      VAL 102  -8.804   1.510   3.367
  787   3HG1  VAL 102          3HG2      VAL 102  -7.369   0.626   2.805
  788   1HG2  VAL 102          1HG1      VAL 102  -9.982  -1.971   2.980
  789   2HG2  VAL 102          2HG1      VAL 102  -8.800  -1.191   1.941
  790   3HG2  VAL 102          3HG1      VAL 102 -10.248  -0.298   2.447
  791    H    GLU 103           HN       GLU 103 -11.624  -1.539   4.411
  792    HA   GLU 103           HA       GLU 103 -13.278   0.489   3.488
  793   1HB   GLU 103          1HB       GLU 103 -13.871  -2.189   4.777
  794   2HB   GLU 103          2HB       GLU 103 -15.174  -1.115   4.281
  795   1HG   GLU 103          2HG       GLU 103 -14.382  -1.041   1.984
  796   2HG   GLU 103          1HG       GLU 103 -12.999  -2.065   2.374
  797    H    LYS 104           HN       LYS 104 -13.137  -0.778   6.796
  798    HA   LYS 104           HA       LYS 104 -15.055   0.666   8.150
  799   1HB   LYS 104          2HB       LYS 104 -13.475  -1.025   9.108
  800   2HB   LYS 104          1HB       LYS 104 -12.177   0.168   8.959
  801   1HG   LYS 104          1HG       LYS 104 -13.481   1.662  10.568
  802   2HG   LYS 104          2HG       LYS 104 -14.542   0.268  10.857
  803   1HD   LYS 104          1HD       LYS 104 -12.555  -1.067  11.546
  804   2HD   LYS 104          2HD       LYS 104 -11.497   0.284  11.121
  805   1HE   LYS 104          1HE       LYS 104 -12.644   1.704  12.850
  806   2HE   LYS 104          2HE       LYS 104 -13.581   0.281  13.347
  807   1HZ   LYS 104          1HZ       LYS 104 -11.489  -0.797  13.854
  808   2HZ   LYS 104          2HZ       LYS 104 -11.666   0.598  14.712
  809   3HZ   LYS 104          3HZ       LYS 104 -10.651   0.556  13.416
  810    H    TYR 105           H        TYR 105 -11.899   1.888   6.989
  811    HA   TYR 105           HA       TYR 105 -12.356   4.551   8.248
  812   1HB   TYR 105          2HB       TYR 105  -9.902   3.263   7.015
  813   2HB   TYR 105          1HB       TYR 105  -9.952   4.808   7.865
  814    HD1  TYR 105           HD1      TYR 105  -9.057   1.454   8.217
  815    HD2  TYR 105           HD2      TYR 105 -11.042   4.632  10.344
  816    HE1  TYR 105           HE1      TYR 105  -8.523   0.352  10.365
  817    HE2  TYR 105           HE2      TYR 105 -10.378   3.594  12.501
  818    HH   TYR 105           HH       TYR 105  -8.111   0.941  12.667
  819    H    LEU 106           H        LEU 106 -13.337   3.277   5.422
  820    HA   LEU 106           HA       LEU 106 -12.394   5.573   3.715
  821   1HB   LEU 106          2HB       LEU 106 -13.342   2.762   3.125
  822   2HB   LEU 106          1HB       LEU 106 -13.458   4.024   1.923
  823    HG   LEU 106           HG       LEU 106 -11.303   2.345   2.286
  824   1HD1  LEU 106          1HD2      LEU 106 -10.376   3.586   4.222
  825   2HD1  LEU 106          2HD2      LEU 106 -10.346   5.077   3.251
  826   3HD1  LEU 106          3HD2      LEU 106  -9.352   3.703   2.793
  827   1HD2  LEU 106          1HD1      LEU 106 -11.451   5.058   0.927
  828   2HD2  LEU 106          2HD1      LEU 106 -11.947   3.496   0.232
  829   3HD2  LEU 106          3HD1      LEU 106 -10.241   3.810   0.579
  830    H    ASN 107           H        ASN 107 -13.835   6.751   5.312
  831    HA   ASN 107           HA       ASN 107 -16.291   7.373   4.039
  832   1HB   ASN 107          1HB       ASN 107 -16.815   5.319   5.585
  833   2HB   ASN 107          2HB       ASN 107 -16.477   6.412   6.929
  834   1HD2  ASN 107          2HD2      ASN 107 -17.701   8.814   5.895
  835   2HD2  ASN 107          1HD2      ASN 107 -19.442   8.503   5.798
  Start of MODEL   23
    1   1H    MET   1          1H        MET   1  -8.120   3.949  -8.200
    2   2H    MET   1          2H        MET   1  -7.511   4.202  -6.706
    3   3H    MET   1          3H        MET   1  -7.900   5.493  -7.714
    4    HA   MET   1           HA       MET   1  -6.164   5.010  -9.160
    5   1HB   MET   1          2HB       MET   1  -5.468   6.060  -7.003
    6   2HB   MET   1          1HB       MET   1  -5.140   4.454  -6.334
    7   1HG   MET   1          2HG       MET   1  -3.406   4.095  -8.062
    8   2HG   MET   1          1HG       MET   1  -3.680   5.719  -8.691
    9   1HE   MET   1          1HE       MET   1  -3.954   7.429  -5.901
   10   2HE   MET   1          2HE       MET   1  -2.251   7.895  -5.748
   11   3HE   MET   1          3HE       MET   1  -3.026   7.899  -7.350
   12    H    GLU   2           HN       GLU   2  -4.835   3.487 -10.213
   13    HA   GLU   2           HA       GLU   2  -5.549   0.660  -9.777
   14   1HB   GLU   2          1HB       GLU   2  -4.304   0.298 -11.867
   15   2HB   GLU   2          2HB       GLU   2  -5.634   1.443 -12.045
   16   1HG   GLU   2          2HG       GLU   2  -4.059   3.347 -12.041
   17   2HG   GLU   2          1HG       GLU   2  -2.703   2.262 -11.696
   18    H    ALA   3           H        ALA   3  -3.684  -0.969  -9.810
   19    HA   ALA   3           HA       ALA   3  -1.941  -0.425  -7.629
   20   1HB   ALA   3          1HB       ALA   3  -2.868  -2.622  -8.128
   21   2HB   ALA   3          2HB       ALA   3  -1.102  -2.700  -8.140
   22   3HB   ALA   3          3HB       ALA   3  -1.996  -2.691  -9.673
   23    H    GLY   4           H        GLY   4  -0.912   1.594  -8.571
   24   1HA   GLY   4          2HA       GLY   4   1.124   1.262 -10.599
   25   2HA   GLY   4          1HA       GLY   4   0.956   2.615  -9.468
   26    H    ALA   5           H        ALA   5   3.448   1.431 -10.232
   27    HA   ALA   5           HA       ALA   5   4.400   0.101  -7.734
   28   1HB   ALA   5          1HB       ALA   5   5.066  -1.016  -9.802
   29   2HB   ALA   5          2HB       ALA   5   6.464  -0.277  -8.990
   30   3HB   ALA   5          3HB       ALA   5   5.759   0.504 -10.423
   31    H    VAL   6           H        VAL   6   5.207   1.526  -6.266
   32    HA   VAL   6           HA       VAL   6   6.022   4.258  -7.191
   33    HB   VAL   6           HB       VAL   6   5.630   4.894  -4.744
   34   1HG1  VAL   6          1HG1      VAL   6   3.924   3.675  -3.511
   35   2HG1  VAL   6          2HG1      VAL   6   5.322   2.640  -3.810
   36   3HG1  VAL   6          3HG1      VAL   6   3.840   2.428  -4.769
   37   1HG2  VAL   6          1HG2      VAL   6   4.257   5.740  -6.534
   38   2HG2  VAL   6          2HG2      VAL   6   3.247   5.342  -5.135
   39   3HG2  VAL   6          3HG2      VAL   6   3.283   4.254  -6.545
   40    H    ASN   7           H        ASN   7   7.639   5.247  -6.012
   41    HA   ASN   7           HA       ASN   7   9.606   3.732  -4.542
   42   1HB   ASN   7          1HB       ASN   7  10.332   3.205  -6.818
   43   2HB   ASN   7          2HB       ASN   7  10.032   4.857  -7.367
   44   1HD2  ASN   7          2HD2      ASN   7  12.108   3.074  -5.011
   45   2HD2  ASN   7          1HD2      ASN   7  13.574   3.930  -5.436
   46    H    ASP   8           HN       ASP   8  11.482   5.388  -4.190
   47    HA   ASP   8           HA       ASP   8  10.782   7.269  -2.404
   48   1HB   ASP   8          2HB       ASP   8  13.094   6.548  -2.993
   49   2HB   ASP   8          1HB       ASP   8  13.065   7.566  -4.421
   50    H    ASP   9           HN       ASP   9  11.520   8.204  -5.734
   51    HA   ASP   9           HA       ASP   9  10.766  10.917  -5.574
   52   1HB   ASP   9          2HB       ASP   9  12.005  10.044  -7.465
   53   2HB   ASP   9          1HB       ASP   9  10.689   8.980  -7.941
   54    H    THR  10           H        THR  10   8.847   8.402  -7.174
   55    HA   THR  10           HA       THR  10   6.509   9.870  -7.575
   56    HB   THR  10           HB       THR  10   5.424   7.615  -7.809
   57    HG1  THR  10           HG1      THR  10   7.797   6.930  -6.482
   58   1HG2  THR  10          1HG2      THR  10   6.845   6.781  -9.613
   59   2HG2  THR  10          2HG2      THR  10   8.223   7.739  -9.051
   60   3HG2  THR  10          3HG2      THR  10   6.779   8.554  -9.685
   61    H    PHE  11           H        PHE  11   7.317   7.810  -4.804
   62    HA   PHE  11           HA       PHE  11   5.037   7.571  -3.358
   63   1HB   PHE  11          2HB       PHE  11   7.308   6.696  -2.852
   64   2HB   PHE  11          1HB       PHE  11   7.809   8.275  -2.308
   65    HD1  PHE  11           HD1      PHE  11   5.649   5.346  -1.548
   66    HD2  PHE  11           HD2      PHE  11   7.267   9.079  -0.115
   67    HE1  PHE  11           HE1      PHE  11   4.958   4.768   0.769
   68    HE2  PHE  11           HE2      PHE  11   6.683   8.440   2.197
   69    HZ   PHE  11           HZ       PHE  11   5.478   6.311   2.643
   70    H    LYS  12           HN       LYS  12   7.250  10.270  -3.264
   71    HA   LYS  12           HA       LYS  12   6.095  11.934  -1.303
   72   1HB   LYS  12          2HB       LYS  12   7.447  12.709  -3.919
   73   2HB   LYS  12          1HB       LYS  12   7.117  13.830  -2.601
   74   1HG   LYS  12          2HG       LYS  12   8.572  12.669  -1.089
   75   2HG   LYS  12          1HG       LYS  12   8.732  11.277  -2.165
   76   1HD   LYS  12          1HD       LYS  12   9.860  12.669  -3.860
   77   2HD   LYS  12          2HD       LYS  12   9.809  14.062  -2.754
   78   1HE   LYS  12          1HE       LYS  12  11.168  12.812  -1.101
   79   2HE   LYS  12          2HE       LYS  12  11.116  11.364  -2.122
   80   1HZ   LYS  12          1HZ       LYS  12  12.394  13.898  -2.853
   81   2HZ   LYS  12          2HZ       LYS  12  12.314  12.542  -3.793
   82   3HZ   LYS  12          3HZ       LYS  12  13.154  12.509  -2.382
   83    H    ASN  13           H        ASN  13   5.296  11.738  -4.789
   84    HA   ASN  13           HA       ASN  13   3.193  13.769  -4.572
   85   1HB   ASN  13          1HB       ASN  13   3.992  11.933  -6.866
   86   2HB   ASN  13          2HB       ASN  13   2.915  13.317  -6.948
   87   1HD2  ASN  13          2HD2      ASN  13   4.663  15.110  -5.182
   88   2HD2  ASN  13          1HD2      ASN  13   6.012  15.459  -6.242
   89    H    VAL  14           H        VAL  14   3.328  10.351  -5.505
   90    HA   VAL  14           HA       VAL  14   0.503   9.986  -5.775
   91    HB   VAL  14           HB       VAL  14   2.865   8.054  -5.509
   92   1HG1  VAL  14          1HG1      VAL  14   2.731   7.937  -7.988
   93   2HG1  VAL  14          2HG1      VAL  14   1.443   9.156  -7.974
   94   3HG1  VAL  14          3HG1      VAL  14   3.086   9.581  -7.458
   95   1HG2  VAL  14          1HG2      VAL  14   0.823   6.759  -5.126
   96   2HG2  VAL  14          2HG2      VAL  14   0.072   7.482  -6.572
   97   3HG2  VAL  14          3HG2      VAL  14   1.472   6.411  -6.730
   98    H    VAL  15           H        VAL  15   2.644   9.558  -2.978
   99    HA   VAL  15           HA       VAL  15   0.399   8.235  -1.509
  100    HB   VAL  15           HB       VAL  15   3.374   8.154  -0.876
  101   1HG1  VAL  15          1HG1      VAL  15   1.812   7.813   0.988
  102   2HG1  VAL  15          2HG1      VAL  15   2.746   6.378   0.605
  103   3HG1  VAL  15          3HG1      VAL  15   1.041   6.488   0.090
  104   1HG2  VAL  15          1HG2      VAL  15   2.954   7.052  -3.077
  105   2HG2  VAL  15          2HG2      VAL  15   3.328   5.880  -1.815
  106   3HG2  VAL  15          3HG2      VAL  15   1.648   6.116  -2.343
  107    H    LEU  16           H        LEU  16   3.159  10.552  -0.889
  108    HA   LEU  16           HA       LEU  16   1.891  11.292   1.632
  109   1HB   LEU  16          1HB       LEU  16   4.123  12.767   0.187
  110   2HB   LEU  16          2HB       LEU  16   3.629  12.922   1.869
  111    HG   LEU  16           HG       LEU  16   4.891  10.472   0.557
  112   1HD1  LEU  16          1HD1      LEU  16   5.857  12.327   2.775
  113   2HD1  LEU  16          2HD1      LEU  16   6.742  10.946   2.097
  114   3HD1  LEU  16          3HD1      LEU  16   6.415  12.366   1.089
  115   1HD2  LEU  16          1HD2      LEU  16   3.321   9.595   2.173
  116   2HD2  LEU  16          2HD2      LEU  16   3.753  10.850   3.356
  117   3HD2  LEU  16          3HD2      LEU  16   4.902   9.577   2.952
  118    H    GLU  17           HN       GLU  17   2.419  13.232  -1.392
  119    HA   GLU  17           HA       GLU  17   0.419  15.189  -0.508
  120   1HB   GLU  17          1HB       GLU  17   1.824  14.822  -3.169
  121   2HB   GLU  17          2HB       GLU  17   0.932  16.256  -2.665
  122   1HG   GLU  17          2HG       GLU  17   2.546  16.769  -0.933
  123   2HG   GLU  17          1HG       GLU  17   3.427  15.262  -1.199
  124    H    SER  18           H        SER  18  -0.841  12.680  -0.531
  125    HA   SER  18           HA       SER  18  -2.254  12.414  -3.133
  126   1HB   SER  18          2HB       SER  18  -3.094  10.325  -2.220
  127   2HB   SER  18          1HB       SER  18  -1.341  10.387  -2.100
  128    HG   SER  18           HG       SER  18  -1.434  10.524   0.022
  129    H    SER  19           H        SER  19  -4.525  12.627  -3.286
  130    HA   SER  19           HA       SER  19  -5.823  14.408  -1.342
  131   1HB   SER  19          1HB       SER  19  -7.607  14.202  -3.208
  132   2HB   SER  19          2HB       SER  19  -6.071  14.982  -3.644
  133    HG   SER  19           HG       SER  19  -6.650  13.376  -5.187
  134    H    VAL  20           H        VAL  20  -6.618  11.500  -3.136
  135    HA   VAL  20           HA       VAL  20  -8.526  10.488  -1.172
  136    HB   VAL  20           HB       VAL  20  -8.751   8.615  -2.740
  137   1HG1  VAL  20          1HG2      VAL  20  -6.350   9.826  -4.199
  138   2HG1  VAL  20          2HG2      VAL  20  -7.449   8.664  -4.927
  139   3HG1  VAL  20          3HG2      VAL  20  -6.506   8.197  -3.510
  140   1HG2  VAL  20          1HG1      VAL  20  -9.944  10.748  -3.186
  141   2HG2  VAL  20          2HG1      VAL  20  -9.594   9.838  -4.665
  142   3HG2  VAL  20          3HG1      VAL  20  -8.619  11.259  -4.254
  143    HA   PRO  21           HA       PRO  21  -5.489   8.214   1.087
  144   1HB   PRO  21          1HB       PRO  21  -6.832   6.084   2.171
  145   2HB   PRO  21          2HB       PRO  21  -7.100   7.769   2.695
  146   1HG   PRO  21          1HG       PRO  21  -8.718   6.127   0.753
  147   2HG   PRO  21          2HG       PRO  21  -9.283   7.178   2.073
  148   1HD   PRO  21          1HD       PRO  21  -9.191   7.941  -0.613
  149   2HD   PRO  21          2HD       PRO  21  -9.027   9.115   0.732
  150    H    VAL  22           H        VAL  22  -4.343   6.152   1.172
  151    HA   VAL  22           HA       VAL  22  -4.717   4.409  -1.074
  152    HB   VAL  22           HB       VAL  22  -3.224   6.840  -1.394
  153   1HG1  VAL  22          1HG1      VAL  22  -1.219   5.830  -0.580
  154   2HG1  VAL  22          2HG1      VAL  22  -1.419   4.441  -1.661
  155   3HG1  VAL  22          3HG1      VAL  22  -1.116   6.059  -2.330
  156   1HG2  VAL  22          1HG2      VAL  22  -3.157   6.070  -3.722
  157   2HG2  VAL  22          2HG2      VAL  22  -3.631   4.434  -3.198
  158   3HG2  VAL  22          3HG2      VAL  22  -4.745   5.809  -3.009
  159    H    LEU  23           H        LEU  23  -3.938   2.396  -1.078
  160    HA   LEU  23           HA       LEU  23  -2.562   1.615   1.385
  161   1HB   LEU  23          2HB       LEU  23  -4.596   0.577   0.515
  162   2HB   LEU  23          1HB       LEU  23  -3.722   0.008  -0.914
  163    HG   LEU  23           HG       LEU  23  -2.923  -0.756   1.879
  164   1HD1  LEU  23          1HD2      LEU  23  -2.113  -2.840   0.469
  165   2HD1  LEU  23          2HD2      LEU  23  -1.207  -1.349   0.208
  166   3HD1  LEU  23          3HD2      LEU  23  -2.438  -1.867  -0.961
  167   1HD2  LEU  23          1HD1      LEU  23  -4.897  -2.145   0.015
  168   2HD2  LEU  23          2HD1      LEU  23  -4.240  -2.846   1.507
  169   3HD2  LEU  23          3HD1      LEU  23  -5.260  -1.404   1.591
  170    H    VAL  24           H        VAL  24  -0.364   1.760   1.284
  171    HA   VAL  24           HA       VAL  24   1.028   1.169  -1.295
  172    HB   VAL  24           HB       VAL  24   2.061   2.368   1.305
  173   1HG1  VAL  24          1HG1      VAL  24   3.412   1.832  -1.382
  174   2HG1  VAL  24          2HG1      VAL  24   3.805   1.025   0.150
  175   3HG1  VAL  24          3HG1      VAL  24   4.129   2.747  -0.040
  176   1HG2  VAL  24          1HG2      VAL  24   1.550   3.563  -1.460
  177   2HG2  VAL  24          2HG2      VAL  24   2.366   4.366  -0.112
  178   3HG2  VAL  24          3HG2      VAL  24   0.649   3.944   0.027
  179    H    ASP  25           HN       ASP  25   1.316  -1.012  -1.518
  180    HA   ASP  25           HA       ASP  25   1.775  -2.677   0.910
  181   1HB   ASP  25          1HB       ASP  25   0.333  -3.659  -0.777
  182   2HB   ASP  25          2HB       ASP  25   1.556  -3.372  -2.028
  183    H    PHE  26           H        PHE  26   3.852  -2.649   1.679
  184    HA   PHE  26           HA       PHE  26   6.105  -1.848  -0.049
  185   1HB   PHE  26          1HB       PHE  26   5.916  -2.719   2.851
  186   2HB   PHE  26          2HB       PHE  26   7.420  -2.391   2.022
  187    HD1  PHE  26           HD1      PHE  26   4.067  -0.644   2.514
  188    HD2  PHE  26           HD2      PHE  26   8.366  -0.280   2.330
  189    HE1  PHE  26           HE1      PHE  26   3.902   1.709   3.157
  190    HE2  PHE  26           HE2      PHE  26   8.183   2.039   3.176
  191    HZ   PHE  26           HZ       PHE  26   5.930   3.001   3.709
  192    H    TRP  27           H        TRP  27   6.801  -3.400  -1.461
  193    HA   TRP  27           HA       TRP  27   6.679  -6.269  -0.626
  194   1HB   TRP  27          2HB       TRP  27   5.729  -6.885  -2.701
  195   2HB   TRP  27          1HB       TRP  27   4.759  -5.550  -2.133
  196    HD1  TRP  27           HD1      TRP  27   5.623  -3.070  -3.280
  197    HE1  TRP  27           HE1      TRP  27   6.601  -2.549  -5.616
  198    HE3  TRP  27           HE3      TRP  27   6.678  -7.844  -4.791
  199    HZ2  TRP  27           HZ2      TRP  27   7.897  -4.023  -7.729
  200    HZ3  TRP  27           HZ3      TRP  27   7.627  -8.240  -7.043
  201    HH2  TRP  27           HH2      TRP  27   8.241  -6.348  -8.510
  202    H    ALA  28           H        ALA  28   7.730  -7.508  -2.676
  203    HA   ALA  28           HA       ALA  28   9.798  -6.184  -4.083
  204   1HB   ALA  28          1HB       ALA  28  11.042  -6.253  -1.920
  205   2HB   ALA  28          2HB       ALA  28  10.753  -8.008  -1.826
  206   3HB   ALA  28          3HB       ALA  28  11.767  -7.335  -3.116
  207    HA   PRO  29           HA       PRO  29   8.894  -9.891  -6.424
  208   1HB   PRO  29          1HB       PRO  29  11.342 -10.484  -7.612
  209   2HB   PRO  29          2HB       PRO  29  10.149  -9.268  -8.176
  210   1HG   PRO  29          2HG       PRO  29  12.590  -8.794  -6.443
  211   2HG   PRO  29          1HG       PRO  29  12.081  -7.871  -7.889
  212   1HD   PRO  29          2HD       PRO  29  11.469  -6.891  -5.466
  213   2HD   PRO  29          1HD       PRO  29  10.215  -6.939  -6.697
  214    H    TRP  30           H        TRP  30  11.893 -10.061  -4.441
  215    HA   TRP  30           HA       TRP  30  11.777 -12.939  -4.196
  216   1HB   TRP  30          2HB       TRP  30  13.392 -12.558  -2.346
  217   2HB   TRP  30          1HB       TRP  30  13.854 -11.862  -3.891
  218    HD1  TRP  30           HD1      TRP  30  14.488  -9.405  -3.944
  219    HE1  TRP  30           HE1      TRP  30  14.572  -7.469  -2.274
  220    HE3  TRP  30           HE3      TRP  30  12.028 -11.616  -0.023
  221    HZ2  TRP  30           HZ2      TRP  30  13.591  -6.906   0.380
  222    HZ3  TRP  30           HZ3      TRP  30  11.584 -10.335   2.042
  223    HH2  TRP  30           HH2      TRP  30  12.263  -7.959   2.219
  224    H    CYS  31           H        CYS  31   9.746 -10.495  -2.833
  225    HA   CYS  31           HA       CYS  31   9.429 -11.752  -0.210
  226   1HB   CYS  31          1HB       CYS  31   9.120  -9.294  -0.577
  227   2HB   CYS  31          2HB       CYS  31   7.743  -9.653  -1.588
  228    H    GLY  32           H        GLY  32   8.894 -13.940  -1.008
  229   1HA   GLY  32          2HA       GLY  32   6.832 -14.896  -2.448
  230   2HA   GLY  32          1HA       GLY  32   7.153 -15.565  -0.848
  231    HA   PRO  33           HA       PRO  33   3.333 -14.340   0.767
  232   1HB   PRO  33          2HB       PRO  33   3.686 -12.564   2.892
  233   2HB   PRO  33          1HB       PRO  33   3.893 -14.334   2.952
  234   1HG   PRO  33          2HG       PRO  33   6.028 -12.233   2.612
  235   2HG   PRO  33          1HG       PRO  33   6.033 -13.686   3.641
  236   1HD   PRO  33          1HD       PRO  33   7.284 -13.570   1.230
  237   2HD   PRO  33          2HD       PRO  33   6.478 -15.080   1.740
  238    H    CYS  34           H        CYS  34   5.303 -11.603  -0.340
  239    HA   CYS  34           HA       CYS  34   3.014  -9.759  -0.390
  240   1HB   CYS  34          1HB       CYS  34   5.538  -9.472  -1.979
  241   2HB   CYS  34          2HB       CYS  34   4.338  -8.311  -1.507
  242    H    ARG  35           HN       ARG  35   5.152 -11.479  -2.648
  243    HA   ARG  35           HA       ARG  35   4.080 -11.014  -5.108
  244   1HB   ARG  35          2HB       ARG  35   6.159 -12.342  -4.376
  245   2HB   ARG  35          1HB       ARG  35   5.106 -13.737  -4.192
  246   1HG   ARG  35          2HG       ARG  35   4.400 -13.320  -6.662
  247   2HG   ARG  35          1HG       ARG  35   5.788 -12.218  -6.731
  248   1HD   ARG  35          1HD       ARG  35   5.767 -15.181  -6.068
  249   2HD   ARG  35          2HD       ARG  35   6.467 -14.435  -7.510
  250    HE   ARG  35           HE       ARG  35   8.016 -13.198  -5.858
  251   1HH1  ARG  35          2HH2      ARG  35   6.973 -16.566  -5.330
  252   2HH1  ARG  35          1HH2      ARG  35   8.283 -16.897  -4.233
  253   1HH2  ARG  35          1HH1      ARG  35   9.633 -13.636  -4.531
  254   2HH2  ARG  35          2HH1      ARG  35   9.841 -15.173  -3.713
  255    H    ILE  36           H        ILE  36   3.207 -13.761  -2.967
  256    HA   ILE  36           HA       ILE  36   1.170 -14.687  -4.806
  257    HB   ILE  36           HB       ILE  36   0.557 -16.287  -3.063
  258   1HG1  ILE  36          2HG1      ILE  36   2.372 -16.243  -1.063
  259   2HG1  ILE  36          1HG1      ILE  36   2.188 -14.506  -1.258
  260   1HG2  ILE  36          1HG2      ILE  36   2.673 -17.468  -3.046
  261   2HG2  ILE  36          2HG2      ILE  36   2.476 -16.644  -4.597
  262   3HG2  ILE  36          3HG2      ILE  36   3.575 -15.978  -3.373
  263   1HD1  ILE  36          1HD1      ILE  36   0.594 -15.303   0.397
  264   2HD1  ILE  36          2HD1      ILE  36   0.037 -16.598  -0.682
  265   3HD1  ILE  36          3HD1      ILE  36  -0.349 -14.913  -1.060
  266    H    ILE  37           H        ILE  37   1.031 -12.144  -2.397
  267    HA   ILE  37           HA       ILE  37  -1.948 -12.175  -2.422
  268    HB   ILE  37           HB       ILE  37   0.087 -10.560  -0.835
  269   1HG1  ILE  37          2HG1      ILE  37  -0.081 -12.871  -0.060
  270   2HG1  ILE  37          1HG1      ILE  37  -0.820 -11.762   1.080
  271   1HG2  ILE  37          1HG2      ILE  37  -1.941  -9.817   0.484
  272   2HG2  ILE  37          2HG2      ILE  37  -2.954 -10.455  -0.826
  273   3HG2  ILE  37          3HG2      ILE  37  -1.819  -9.127  -1.129
  274   1HD1  ILE  37          1HD1      ILE  37  -2.331 -13.603  -0.819
  275   2HD1  ILE  37          2HD1      ILE  37  -3.088 -12.417   0.266
  276   3HD1  ILE  37          3HD1      ILE  37  -2.159 -13.763   0.928
  277    H    ALA  38           H        ALA  38   0.814 -10.405  -3.764
  278    HA   ALA  38           HA       ALA  38  -0.103  -8.094  -4.636
  279   1HB   ALA  38          1HB       ALA  38   1.312 -10.050  -6.495
  280   2HB   ALA  38          2HB       ALA  38   1.297  -8.287  -6.597
  281   3HB   ALA  38          3HB       ALA  38   2.087  -9.081  -5.223
  282    HA   PRO  39           HA       PRO  39  -2.657  -9.775  -8.399
  283   1HB   PRO  39          1HB       PRO  39  -3.774 -12.318  -7.248
  284   2HB   PRO  39          2HB       PRO  39  -3.308 -11.962  -8.935
  285   1HG   PRO  39          1HG       PRO  39  -1.703 -13.512  -7.384
  286   2HG   PRO  39          2HG       PRO  39  -0.969 -12.231  -8.402
  287   1HD   PRO  39          1HD       PRO  39  -1.775 -12.048  -5.490
  288   2HD   PRO  39          2HD       PRO  39  -0.189 -11.681  -6.180
  289    H    VAL  40           H        VAL  40  -3.457 -10.552  -5.041
  290    HA   VAL  40           HA       VAL  40  -6.269  -9.765  -5.244
  291    HB   VAL  40           HB       VAL  40  -4.619 -11.077  -3.277
  292   1HG1  VAL  40          1HG2      VAL  40  -6.054  -8.659  -2.097
  293   2HG1  VAL  40          2HG2      VAL  40  -4.299  -8.936  -2.086
  294   3HG1  VAL  40          3HG2      VAL  40  -5.369 -10.020  -1.198
  295   1HG2  VAL  40          1HG1      VAL  40  -6.826 -11.571  -2.282
  296   2HG2  VAL  40          2HG1      VAL  40  -6.843 -11.773  -4.048
  297   3HG2  VAL  40          3HG1      VAL  40  -7.551 -10.317  -3.314
  298    H    VAL  41           H        VAL  41  -3.202  -8.244  -4.239
  299    HA   VAL  41           HA       VAL  41  -4.408  -5.793  -3.415
  300    HB   VAL  41           HB       VAL  41  -1.622  -6.086  -4.654
  301   1HG1  VAL  41          1HG1      VAL  41  -2.499  -6.574  -1.779
  302   2HG1  VAL  41          2HG1      VAL  41  -0.814  -6.375  -2.313
  303   3HG1  VAL  41          3HG1      VAL  41  -1.754  -7.736  -2.895
  304   1HG2  VAL  41          1HG2      VAL  41  -2.843  -4.112  -2.658
  305   2HG2  VAL  41          2HG2      VAL  41  -2.322  -3.767  -4.318
  306   3HG2  VAL  41          3HG2      VAL  41  -1.126  -4.175  -3.088
  307    H    ASP  42           HN       ASP  42  -3.246  -6.967  -6.569
  308    HA   ASP  42           HA       ASP  42  -3.791  -4.604  -8.070
  309   1HB   ASP  42          1HB       ASP  42  -3.786  -7.494  -9.032
  310   2HB   ASP  42          2HB       ASP  42  -3.706  -6.027 -10.019
  311    H    GLU  43           HN       GLU  43  -5.779  -7.579  -7.581
  312    HA   GLU  43           HA       GLU  43  -7.943  -6.663  -9.147
  313   1HB   GLU  43          1HB       GLU  43  -9.032  -8.513  -8.549
  314   2HB   GLU  43          2HB       GLU  43  -7.428  -9.020  -8.043
  315   1HG   GLU  43          2HG       GLU  43  -8.158  -8.218  -5.655
  316   2HG   GLU  43          1HG       GLU  43  -9.773  -8.051  -6.339
  317    H    ILE  44           H        ILE  44  -7.246  -6.157  -5.665
  318    HA   ILE  44           HA       ILE  44  -9.608  -4.728  -4.982
  319    HB   ILE  44           HB       ILE  44  -6.735  -4.732  -4.030
  320   1HG1  ILE  44          1HG1      ILE  44  -9.337  -5.168  -2.504
  321   2HG1  ILE  44          2HG1      ILE  44  -8.574  -6.441  -3.447
  322   1HG2  ILE  44          1HG2      ILE  44  -7.251  -3.129  -2.256
  323   2HG2  ILE  44          2HG2      ILE  44  -7.379  -2.350  -3.823
  324   3HG2  ILE  44          3HG2      ILE  44  -8.857  -2.852  -2.962
  325   1HD1  ILE  44          1HD1      ILE  44  -7.868  -6.657  -1.129
  326   2HD1  ILE  44          2HD1      ILE  44  -6.472  -6.156  -2.094
  327   3HD1  ILE  44          3HD1      ILE  44  -7.327  -4.982  -1.069
  328    H    ALA  45           H        ALA  45  -6.566  -3.607  -6.503
  329    HA   ALA  45           HA       ALA  45  -7.336  -0.895  -6.848
  330   1HB   ALA  45          1HB       ALA  45  -5.103  -2.370  -7.431
  331   2HB   ALA  45          2HB       ALA  45  -5.421  -0.737  -8.033
  332   3HB   ALA  45          3HB       ALA  45  -5.755  -2.148  -9.056
  333    H    GLY  46           H        GLY  46  -7.664  -3.698  -9.069
  334   1HA   GLY  46          1HA       GLY  46  -8.990  -2.578 -11.225
  335   2HA   GLY  46          2HA       GLY  46  -9.242  -4.233 -10.640
  336    H    GLU  47           HN       GLU  47 -10.445  -3.740  -8.148
  337    HA   GLU  47           HA       GLU  47 -13.162  -3.164  -8.861
  338   1HB   GLU  47          2HB       GLU  47 -11.776  -3.433  -6.160
  339   2HB   GLU  47          1HB       GLU  47 -13.525  -3.322  -6.380
  340   1HG   GLU  47          1HG       GLU  47 -13.557  -5.378  -7.676
  341   2HG   GLU  47          2HG       GLU  47 -11.810  -5.514  -7.641
  342    H    TYR  48           H        TYR  48 -11.085  -1.435  -6.513
  343    HA   TYR  48           HA       TYR  48 -12.909   0.911  -6.713
  344   1HB   TYR  48          1HB       TYR  48 -10.491   0.688  -4.932
  345   2HB   TYR  48          2HB       TYR  48 -11.974   1.666  -4.784
  346    HD1  TYR  48           HD1      TYR  48 -14.111   0.642  -4.056
  347    HD2  TYR  48           HD2      TYR  48 -10.378  -1.496  -3.944
  348    HE1  TYR  48           HE1      TYR  48 -14.864  -0.577  -2.036
  349    HE2  TYR  48           HE2      TYR  48 -11.194  -2.818  -2.008
  350    HH   TYR  48           HH       TYR  48 -14.196  -1.941  -0.314
  351    H    LYS  49           HN       LYS  49 -11.774   0.598  -9.009
  352    HA   LYS  49           HA       LYS  49  -9.180   1.335  -9.606
  353   1HB   LYS  49          2HB       LYS  49 -10.014   1.453 -11.911
  354   2HB   LYS  49          1HB       LYS  49 -10.754   0.162 -10.948
  355   1HG   LYS  49          1HG       LYS  49 -12.742   1.829 -10.608
  356   2HG   LYS  49          2HG       LYS  49 -12.092   2.584 -12.078
  357   1HD   LYS  49          1HD       LYS  49 -13.067  -0.284 -11.646
  358   2HD   LYS  49          2HD       LYS  49 -13.863   0.991 -12.564
  359   1HE   LYS  49          2HE       LYS  49 -12.940  -0.414 -14.188
  360   2HE   LYS  49          1HE       LYS  49 -11.827   0.963 -14.150
  361   1HZ   LYS  49          1HZ       LYS  49 -10.319  -0.355 -12.908
  362   2HZ   LYS  49          2HZ       LYS  49 -10.807  -1.274 -14.182
  363   3HZ   LYS  49          3HZ       LYS  49 -11.416  -1.554 -12.669
  364    H    ASP  50           HN       ASP  50 -11.937   3.460  -9.822
  365    HA   ASP  50           HA       ASP  50 -10.359   5.729 -10.645
  366   1HB   ASP  50          2HB       ASP  50 -12.721   5.626 -11.138
  367   2HB   ASP  50          1HB       ASP  50 -13.159   5.571  -9.434
  368    H    LYS  51           HN       LYS  51 -12.164   5.485  -7.636
  369    HA   LYS  51           HA       LYS  51 -10.791   7.791  -6.620
  370   1HB   LYS  51          1HB       LYS  51 -12.205   6.459  -4.455
  371   2HB   LYS  51          2HB       LYS  51 -12.545   7.962  -5.231
  372   1HG   LYS  51          1HG       LYS  51 -13.840   6.740  -7.010
  373   2HG   LYS  51          2HG       LYS  51 -13.467   5.202  -6.169
  374   1HD   LYS  51          1HD       LYS  51 -14.560   6.144  -4.103
  375   2HD   LYS  51          2HD       LYS  51 -15.104   7.520  -5.077
  376   1HE   LYS  51          2HE       LYS  51 -15.755   4.566  -5.579
  377   2HE   LYS  51          1HE       LYS  51 -16.851   5.764  -4.877
  378   1HZ   LYS  51          1HZ       LYS  51 -15.735   5.853  -7.593
  379   2HZ   LYS  51          2HZ       LYS  51 -16.732   6.987  -6.933
  380   3HZ   LYS  51          3HZ       LYS  51 -17.280   5.454  -7.187
  381    H    LEU  52           H        LEU  52 -10.425   4.350  -5.744
  382    HA   LEU  52           HA       LEU  52  -9.298   5.357  -3.167
  383   1HB   LEU  52          1HB       LEU  52 -11.467   4.122  -3.383
  384   2HB   LEU  52          2HB       LEU  52 -10.476   2.699  -3.834
  385    HG   LEU  52           HG       LEU  52  -9.773   2.465  -1.653
  386   1HD1  LEU  52          1HD1      LEU  52 -10.875   5.261  -1.115
  387   2HD1  LEU  52          2HD1      LEU  52  -9.182   4.793  -0.994
  388   3HD1  LEU  52          3HD1      LEU  52 -10.336   4.150   0.171
  389   1HD2  LEU  52          1HD2      LEU  52 -12.039   1.765  -2.062
  390   2HD2  LEU  52          2HD2      LEU  52 -12.650   3.338  -1.513
  391   3HD2  LEU  52          3HD2      LEU  52 -11.808   2.254  -0.380
  392    H    LYS  53           HN       LYS  53  -8.101   3.701  -2.052
  393    HA   LYS  53           HA       LYS  53  -5.717   3.871  -2.626
  394   1HB   LYS  53          1HB       LYS  53  -5.710   2.480  -0.261
  395   2HB   LYS  53          2HB       LYS  53  -6.907   3.733  -0.390
  396   1HG   LYS  53          1HG       LYS  53  -8.481   2.222  -0.007
  397   2HG   LYS  53          2HG       LYS  53  -8.025   1.333  -1.503
  398   1HD   LYS  53          2HD       LYS  53  -6.506  -0.066  -0.233
  399   2HD   LYS  53          1HD       LYS  53  -6.899   0.836   1.238
  400   1HE   LYS  53          1HE       LYS  53  -8.141  -1.310   1.066
  401   2HE   LYS  53          2HE       LYS  53  -9.300   0.026   0.952
  402   1HZ   LYS  53          1HZ       LYS  53  -9.343  -0.261  -1.384
  403   2HZ   LYS  53          2HZ       LYS  53  -8.183  -1.429  -1.321
  404   3HZ   LYS  53          3HZ       LYS  53  -9.664  -1.696  -0.649
  405    H    CYS  54           H        CYS  54  -4.599   2.770  -4.417
  406    HA   CYS  54           HA       CYS  54  -3.479   0.264  -3.308
  407   1HB   CYS  54          1HB       CYS  54  -5.414  -0.565  -4.592
  408   2HB   CYS  54          2HB       CYS  54  -4.824   0.302  -6.036
  409    HG   CYS  54           HG       CYS  54  -4.329  -2.490  -5.453
  410    H    VAL  55           H        VAL  55  -1.369   0.441  -3.386
  411    HA   VAL  55           HA       VAL  55  -0.045   0.823  -5.931
  412    HB   VAL  55           HB       VAL  55   1.519   2.498  -4.292
  413   1HG1  VAL  55          1HG1      VAL  55   0.197   4.332  -3.589
  414   2HG1  VAL  55          2HG1      VAL  55  -0.391   2.863  -2.790
  415   3HG1  VAL  55          3HG1      VAL  55  -1.307   3.581  -4.144
  416   1HG2  VAL  55          1HG2      VAL  55  -0.341   3.121  -6.600
  417   2HG2  VAL  55          2HG2      VAL  55   0.856   4.254  -5.928
  418   3HG2  VAL  55          3HG2      VAL  55   1.391   2.737  -6.644
  419    H    LYS  56           HN       LYS  56   2.281   0.340  -5.725
  420    HA   LYS  56           HA       LYS  56   2.867  -1.498  -3.435
  421   1HB   LYS  56          1HB       LYS  56   2.489  -1.927  -6.281
  422   2HB   LYS  56          2HB       LYS  56   4.140  -2.302  -5.851
  423   1HG   LYS  56          2HG       LYS  56   3.096  -4.363  -5.568
  424   2HG   LYS  56          1HG       LYS  56   3.177  -3.739  -3.926
  425   1HD   LYS  56          2HD       LYS  56   0.997  -4.608  -4.121
  426   2HD   LYS  56          1HD       LYS  56   0.787  -2.859  -4.270
  427   1HE   LYS  56          1HE       LYS  56  -0.604  -3.886  -5.933
  428   2HE   LYS  56          2HE       LYS  56   0.751  -3.179  -6.812
  429   1HZ   LYS  56          1HZ       LYS  56   0.182  -5.386  -7.517
  430   2HZ   LYS  56          2HZ       LYS  56   1.725  -5.349  -6.927
  431   3HZ   LYS  56          3HZ       LYS  56   0.504  -5.998  -6.024
  432    H    LEU  57           H        LEU  57   4.657  -0.811  -2.310
  433    HA   LEU  57           HA       LEU  57   6.665   0.925  -3.685
  434   1HB   LEU  57          1HB       LEU  57   5.764   1.846  -1.704
  435   2HB   LEU  57          2HB       LEU  57   6.173   0.400  -0.742
  436    HG   LEU  57           HG       LEU  57   7.500   2.366  -0.296
  437   1HD1  LEU  57          1HD1      LEU  57   8.655   2.089  -3.086
  438   2HD1  LEU  57          2HD1      LEU  57   9.087   3.292  -1.847
  439   3HD1  LEU  57          3HD1      LEU  57   7.483   3.331  -2.591
  440   1HD2  LEU  57          1HD2      LEU  57   9.315   0.260  -1.488
  441   2HD2  LEU  57          2HD2      LEU  57   9.608   1.331  -0.107
  442   3HD2  LEU  57          3HD2      LEU  57   8.402   0.042   0.006
  443    H    ASN  58           H        ASN  58   8.177  -0.134  -4.684
  444    HA   ASN  58           HA       ASN  58   8.930  -2.872  -4.007
  445   1HB   ASN  58          2HB       ASN  58   9.092  -2.144  -6.341
  446   2HB   ASN  58          1HB       ASN  58  10.137  -0.856  -5.871
  447   1HD2  ASN  58          2HD2      ASN  58  10.005  -4.025  -7.101
  448   2HD2  ASN  58          1HD2      ASN  58  11.626  -4.541  -6.678
  449    H    THR  59           H        THR  59   9.804  -3.213  -2.169
  450    HA   THR  59           HA       THR  59  11.547  -1.351  -0.730
  451    HB   THR  59           HB       THR  59  10.430  -4.095  -0.002
  452    HG1  THR  59           HG1      THR  59   8.841  -2.418  -0.555
  453   1HG2  THR  59          1HG2      THR  59  10.623  -3.189   2.342
  454   2HG2  THR  59          2HG2      THR  59  12.191  -3.447   1.568
  455   3HG2  THR  59          3HG2      THR  59  11.522  -1.811   1.682
  456    H    ASP  60           HN       ASP  60  12.795  -1.946  -2.975
  457    HA   ASP  60           HA       ASP  60  15.163  -3.435  -2.061
  458   1HB   ASP  60          1HB       ASP  60  13.516  -5.005  -3.342
  459   2HB   ASP  60          2HB       ASP  60  14.000  -4.124  -4.791
  460    H    GLU  61           HN       GLU  61  13.530  -1.791  -4.764
  461    HA   GLU  61           HA       GLU  61  15.831  -0.148  -5.480
  462   1HB   GLU  61          1HB       GLU  61  14.406   0.846  -7.010
  463   2HB   GLU  61          2HB       GLU  61  14.042  -0.931  -7.127
  464   1HG   GLU  61          2HG       GLU  61  12.079  -0.264  -5.627
  465   2HG   GLU  61          1HG       GLU  61  12.414   1.389  -6.120
  466    H    SER  62           H        SER  62  13.000   0.117  -3.536
  467    HA   SER  62           HA       SER  62  13.674   2.852  -2.670
  468   1HB   SER  62          1HB       SER  62  10.944   1.671  -2.049
  469   2HB   SER  62          2HB       SER  62  11.419   3.315  -2.497
  470    HG   SER  62           HG       SER  62  11.077   0.979  -4.062
  471    HA   PRO  63           HA       PRO  63  14.350   0.292   1.188
  472   1HB   PRO  63          1HB       PRO  63  17.016   0.808   1.472
  473   2HB   PRO  63          2HB       PRO  63  16.403  -0.570   0.502
  474   1HG   PRO  63          1HG       PRO  63  17.327   2.148  -0.465
  475   2HG   PRO  63          2HG       PRO  63  17.716   0.544  -1.152
  476   1HD   PRO  63          2HD       PRO  63  15.715   2.126  -2.189
  477   2HD   PRO  63          1HD       PRO  63  15.541   0.391  -2.157
  478    H    ASN  64           H        ASN  64  15.217   3.359  -0.215
  479    HA   ASN  64           HA       ASN  64  15.864   5.035   1.926
  480   1HB   ASN  64          2HB       ASN  64  14.190   5.499  -0.586
  481   2HB   ASN  64          1HB       ASN  64  14.474   6.768   0.605
  482   1HD2  ASN  64          2HD2      ASN  64  15.413   7.862  -1.287
  483   2HD2  ASN  64          1HD2      ASN  64  17.111   7.544  -1.671
  484    H    VAL  65           H        VAL  65  12.623   4.855   0.559
  485    HA   VAL  65           HA       VAL  65  11.173   6.086   2.597
  486    HB   VAL  65           HB       VAL  65  10.389   3.905   0.598
  487   1HG1  VAL  65          1HG2      VAL  65   8.708   4.084   2.398
  488   2HG1  VAL  65          2HG2      VAL  65   8.100   4.703   0.862
  489   3HG1  VAL  65          3HG2      VAL  65   8.620   5.838   2.136
  490   1HG2  VAL  65          1HG1      VAL  65  10.229   6.950   0.469
  491   2HG2  VAL  65          2HG1      VAL  65   9.542   5.834  -0.732
  492   3HG2  VAL  65          3HG1      VAL  65  11.294   5.916  -0.503
  493    H    ALA  66           H        ALA  66  11.806   2.676   1.992
  494    HA   ALA  66           HA       ALA  66  10.401   1.556   4.139
  495   1HB   ALA  66          1HB       ALA  66  11.502   0.335   2.242
  496   2HB   ALA  66          2HB       ALA  66  13.059   0.513   3.084
  497   3HB   ALA  66          3HB       ALA  66  11.758  -0.422   3.832
  498    H    SER  67           H        SER  67  13.757   2.817   4.140
  499    HA   SER  67           HA       SER  67  14.288   2.118   6.889
  500   1HB   SER  67          1HB       SER  67  15.627   4.207   5.108
  501   2HB   SER  67          2HB       SER  67  16.256   3.544   6.627
  502    HG   SER  67           HG       SER  67  15.724   2.111   4.228
  503    H    GLU  68           HN       GLU  68  13.250   5.088   5.224
  504    HA   GLU  68           HA       GLU  68  13.240   6.856   7.444
  505   1HB   GLU  68          1HB       GLU  68  11.460   6.747   4.971
  506   2HB   GLU  68          2HB       GLU  68  11.465   8.088   6.118
  507   1HG   GLU  68          2HG       GLU  68  13.729   8.669   5.625
  508   2HG   GLU  68          1HG       GLU  68  14.017   7.182   4.722
  509    H    TYR  69           H        TYR  69  10.638   4.701   6.228
  510    HA   TYR  69           HA       TYR  69   8.850   5.420   8.440
  511   1HB   TYR  69          2HB       TYR  69   8.752   3.525   6.080
  512   2HB   TYR  69          1HB       TYR  69   7.627   3.347   7.410
  513    HD1  TYR  69           HD1      TYR  69   5.947   5.094   7.929
  514    HD2  TYR  69           HD2      TYR  69   8.731   5.620   4.685
  515    HE1  TYR  69           HE1      TYR  69   4.881   7.251   7.357
  516    HE2  TYR  69           HE2      TYR  69   7.724   7.804   4.172
  517    HH   TYR  69           HH       TYR  69   5.114   9.224   6.134
  518    H    GLY  70           H        GLY  70  11.129   2.778   7.761
  519   1HA   GLY  70          1HA       GLY  70  12.256   1.579   9.438
  520   2HA   GLY  70          2HA       GLY  70  11.039   2.044  10.634
  521    H    ILE  71           H        ILE  71  10.966   0.479   7.425
  522    HA   ILE  71           HA       ILE  71   8.842  -1.347   8.173
  523    HB   ILE  71           HB       ILE  71  10.713  -1.227   5.776
  524   1HG1  ILE  71          1HG1      ILE  71   9.269   0.804   6.099
  525   2HG1  ILE  71          2HG1      ILE  71   8.959  -0.113   4.630
  526   1HG2  ILE  71          1HG2      ILE  71   8.900  -2.571   4.642
  527   2HG2  ILE  71          2HG2      ILE  71   9.811  -3.452   5.875
  528   3HG2  ILE  71          3HG2      ILE  71   8.181  -2.847   6.246
  529   1HD1  ILE  71          1HD1      ILE  71   6.904   0.730   5.718
  530   2HD1  ILE  71          2HD1      ILE  71   7.238  -0.255   7.142
  531   3HD1  ILE  71          3HD1      ILE  71   6.902  -1.029   5.570
  532    H    ARG  72           HN       ARG  72   9.128  -2.998   9.506
  533    HA   ARG  72           HA       ARG  72  11.739  -4.054  10.128
  534   1HB   ARG  72          1HB       ARG  72   9.847  -3.753  11.721
  535   2HB   ARG  72          2HB       ARG  72   8.966  -5.059  10.909
  536   1HG   ARG  72          1HG       ARG  72  10.779  -6.653  11.492
  537   2HG   ARG  72          2HG       ARG  72  11.696  -5.347  12.260
  538   1HD   ARG  72          2HD       ARG  72   8.922  -6.306  13.093
  539   2HD   ARG  72          1HD       ARG  72  10.449  -6.757  13.884
  540    HE   ARG  72           HE       ARG  72  10.384  -3.957  13.846
  541   1HH1  ARG  72          1HH1      ARG  72   8.543  -6.597  15.291
  542   2HH1  ARG  72          2HH1      ARG  72   8.023  -5.676  16.676
  543   1HH2  ARG  72          1HH2      ARG  72   9.715  -2.730  15.645
  544   2HH2  ARG  72          2HH2      ARG  72   8.711  -3.433  16.882
  545    H    SER  73           H        SER  73   9.064  -5.124   8.022
  546    HA   SER  73           HA       SER  73  10.732  -6.935   6.619
  547   1HB   SER  73          1HB       SER  73  10.183  -8.410   8.608
  548   2HB   SER  73          2HB       SER  73   8.462  -8.229   8.211
  549    HG   SER  73           HG       SER  73  10.538  -9.480   6.734
  550    H    ILE  74           H        ILE  74   8.750  -8.382   5.343
  551    HA   ILE  74           HA       ILE  74   6.679  -6.504   4.543
  552    HB   ILE  74           HB       ILE  74   7.305  -6.782   2.085
  553   1HG1  ILE  74          1HG1      ILE  74  10.083  -7.387   3.130
  554   2HG1  ILE  74          2HG1      ILE  74   8.999  -8.562   2.371
  555   1HG2  ILE  74          1HG2      ILE  74   8.636  -4.781   2.097
  556   2HG2  ILE  74          2HG2      ILE  74   9.268  -5.124   3.717
  557   3HG2  ILE  74          3HG2      ILE  74   7.564  -4.676   3.490
  558   1HD1  ILE  74          1HD1      ILE  74  10.299  -7.772   0.557
  559   2HD1  ILE  74          2HD1      ILE  74   8.807  -6.865   0.410
  560   3HD1  ILE  74          3HD1      ILE  74  10.250  -6.101   1.120
  561    HA   PRO  75           HA       PRO  75   5.098  -6.737   2.645
  562   1HB   PRO  75          2HB       PRO  75   2.417  -7.286   2.871
  563   2HB   PRO  75          1HB       PRO  75   3.467  -7.823   1.549
  564   1HG   PRO  75          1HG       PRO  75   2.649  -9.292   4.053
  565   2HG   PRO  75          2HG       PRO  75   2.641  -9.956   2.392
  566   1HD   PRO  75          2HD       PRO  75   4.664 -10.471   4.192
  567   2HD   PRO  75          1HD       PRO  75   5.015 -10.235   2.467
  568    H    THR  76           H        THR  76   4.464  -4.964   3.466
  569    HA   THR  76           HA       THR  76   3.215  -4.688   6.119
  570    HB   THR  76           HB       THR  76   5.709  -3.172   5.228
  571    HG1  THR  76           HG1      THR  76   6.421  -4.852   6.378
  572   1HG2  THR  76          1HG2      THR  76   3.782  -2.690   7.547
  573   2HG2  THR  76          2HG2      THR  76   5.382  -1.944   7.399
  574   3HG2  THR  76          3HG2      THR  76   4.125  -1.573   6.205
  575    H    ILE  77           H        ILE  77   1.403  -3.633   5.652
  576    HA   ILE  77           HA       ILE  77   1.096  -2.250   3.019
  577    HB   ILE  77           HB       ILE  77  -0.672  -4.026   4.723
  578   1HG1  ILE  77          1HG1      ILE  77  -0.051  -4.235   1.754
  579   2HG1  ILE  77          2HG1      ILE  77   1.052  -4.908   2.957
  580   1HG2  ILE  77          1HG2      ILE  77  -2.389  -3.549   2.830
  581   2HG2  ILE  77          2HG2      ILE  77  -1.352  -2.137   2.495
  582   3HG2  ILE  77          3HG2      ILE  77  -2.188  -2.292   4.049
  583   1HD1  ILE  77          1HD1      ILE  77  -0.716  -6.317   3.886
  584   2HD1  ILE  77          2HD1      ILE  77  -0.433  -6.641   2.166
  585   3HD1  ILE  77          3HD1      ILE  77  -1.862  -5.719   2.663
  586    H    MET  78           H        MET  78   1.333  -0.078   3.493
  587    HA   MET  78           HA       MET  78   0.163   0.959   6.054
  588   1HB   MET  78          1HB       MET  78   1.998   2.235   4.030
  589   2HB   MET  78          2HB       MET  78   1.342   3.043   5.463
  590   1HG   MET  78          1HG       MET  78   2.372   1.266   6.882
  591   2HG   MET  78          2HG       MET  78   3.206   0.654   5.460
  592   1HE   MET  78          1HE       MET  78   5.080   0.901   7.534
  593   2HE   MET  78          2HE       MET  78   4.013   1.901   8.547
  594   3HE   MET  78          3HE       MET  78   5.637   2.480   8.137
  595    H    VAL  79           H        VAL  79  -1.498   2.391   6.066
  596    HA   VAL  79           HA       VAL  79  -2.857   2.943   3.431
  597    HB   VAL  79           HB       VAL  79  -3.973   2.969   6.245
  598   1HG1  VAL  79          1HG1      VAL  79  -4.609   1.243   3.807
  599   2HG1  VAL  79          2HG1      VAL  79  -3.741   0.700   5.261
  600   3HG1  VAL  79          3HG1      VAL  79  -5.443   1.179   5.373
  601   1HG2  VAL  79          1HG2      VAL  79  -5.185   3.825   3.581
  602   2HG2  VAL  79          2HG2      VAL  79  -4.976   4.825   5.024
  603   3HG2  VAL  79          3HG2      VAL  79  -6.139   3.508   5.048
  604    H    PHE  80           H        PHE  80  -1.981   4.815   2.717
  605    HA   PHE  80           HA       PHE  80  -1.425   7.041   4.599
  606   1HB   PHE  80          1HB       PHE  80  -0.945   6.612   1.652
  607   2HB   PHE  80          2HB       PHE  80  -0.784   8.185   2.423
  608    HD1  PHE  80           HD1      PHE  80   0.564   4.687   2.456
  609    HD2  PHE  80           HD2      PHE  80   1.069   8.744   3.833
  610    HE1  PHE  80           HE1      PHE  80   2.831   4.137   3.316
  611    HE2  PHE  80           HE2      PHE  80   3.239   8.126   4.852
  612    HZ   PHE  80           HZ       PHE  80   4.055   5.770   4.714
  613    H    LYS  81           HN       LYS  81  -2.529   8.905   4.593
  614    HA   LYS  81           HA       LYS  81  -5.124   9.067   3.114
  615   1HB   LYS  81          1HB       LYS  81  -6.392   9.472   5.042
  616   2HB   LYS  81          2HB       LYS  81  -5.422   8.054   5.430
  617   1HG   LYS  81          2HG       LYS  81  -5.134  10.901   6.452
  618   2HG   LYS  81          1HG       LYS  81  -5.428   9.421   7.363
  619   1HD   LYS  81          1HD       LYS  81  -3.123   8.619   6.655
  620   2HD   LYS  81          2HD       LYS  81  -2.849  10.225   5.946
  621   1HE   LYS  81          1HE       LYS  81  -3.543   9.879   8.880
  622   2HE   LYS  81          2HE       LYS  81  -1.893   9.952   8.250
  623   1HZ   LYS  81          1HZ       LYS  81  -2.418  12.075   7.261
  624   2HZ   LYS  81          2HZ       LYS  81  -2.595  12.102   8.904
  625   3HZ   LYS  81          3HZ       LYS  81  -3.922  12.041   7.929
  626    H    GLY  82           H        GLY  82  -2.411  10.269   2.956
  627   1HA   GLY  82          1HA       GLY  82  -1.879  12.262   2.094
  628   2HA   GLY  82          2HA       GLY  82  -3.159  13.141   2.956
  629    H    GLY  83           H        GLY  83  -0.034  13.136   2.711
  630   1HA   GLY  83          2HA       GLY  83   1.676  13.917   3.915
  631   2HA   GLY  83          1HA       GLY  83   0.591  14.216   5.286
  632    H    LYS  84           HN       LYS  84  -0.188  11.659   5.956
  633    HA   LYS  84           HA       LYS  84   2.295  10.082   6.455
  634   1HB   LYS  84          2HB       LYS  84   0.361  11.026   8.614
  635   2HB   LYS  84          1HB       LYS  84   1.764   9.970   8.860
  636   1HG   LYS  84          2HG       LYS  84   3.221  11.847   7.955
  637   2HG   LYS  84          1HG       LYS  84   1.808  12.905   8.055
  638   1HD   LYS  84          2HD       LYS  84   3.075  11.388  10.385
  639   2HD   LYS  84          1HD       LYS  84   3.275  13.109  10.023
  640   1HE   LYS  84          2HE       LYS  84   0.794  13.426  10.300
  641   2HE   LYS  84          1HE       LYS  84   0.661  11.726  10.796
  642   1HZ   LYS  84          1HZ       LYS  84   2.134  12.197  12.605
  643   2HZ   LYS  84          2HZ       LYS  84   2.254  13.778  12.153
  644   3HZ   LYS  84          3HZ       LYS  84   0.809  13.174  12.661
  645    H    LYS  85           HN       LYS  85   1.557   8.138   7.902
  646    HA   LYS  85           HA       LYS  85  -0.527   6.687   6.409
  647   1HB   LYS  85          1HB       LYS  85   0.399   4.716   7.485
  648   2HB   LYS  85          2HB       LYS  85   1.602   5.601   6.571
  649   1HG   LYS  85          1HG       LYS  85   2.911   5.912   8.331
  650   2HG   LYS  85          2HG       LYS  85   1.621   6.568   9.340
  651   1HD   LYS  85          1HD       LYS  85   2.188   3.625   8.865
  652   2HD   LYS  85          2HD       LYS  85   2.688   4.538  10.292
  653   1HE   LYS  85          2HE       LYS  85  -0.200   3.954   9.476
  654   2HE   LYS  85          1HE       LYS  85   0.693   3.234  10.815
  655   1HZ   LYS  85          1HZ       LYS  85   0.006   6.077  10.603
  656   2HZ   LYS  85          2HZ       LYS  85  -0.771   4.950  11.510
  657   3HZ   LYS  85          3HZ       LYS  85   0.795   5.351  11.859
  658    H    CYS  86           H        CYS  86  -2.178   5.577   7.477
  659    HA   CYS  86           HA       CYS  86  -2.997   6.629  10.164
  660   1HB   CYS  86          2HB       CYS  86  -4.507   7.261   8.324
  661   2HB   CYS  86          1HB       CYS  86  -4.721   5.571   7.862
  662    HG   CYS  86           HG       CYS  86  -5.563   4.792  10.255
  663    H    GLU  87           HN       GLU  87  -3.711   3.815   8.083
  664    HA   GLU  87           HA       GLU  87  -3.452   1.994  10.429
  665   1HB   GLU  87          1HB       GLU  87  -4.558   1.379   7.666
  666   2HB   GLU  87          2HB       GLU  87  -4.594   0.346   9.087
  667   1HG   GLU  87          1HG       GLU  87  -6.072   3.002   8.794
  668   2HG   GLU  87          2HG       GLU  87  -6.747   1.380   8.718
  669    H    THR  88           H        THR  88  -2.319  -0.091  10.019
  670    HA   THR  88           HA       THR  88  -0.525  -0.304   7.745
  671    HB   THR  88           HB       THR  88   0.581  -0.031  10.560
  672    HG1  THR  88           HG1      THR  88   0.198   1.706   8.606
  673   1HG2  THR  88          1HG2      THR  88   1.930  -0.871   7.948
  674   2HG2  THR  88          2HG2      THR  88   1.785  -1.847   9.425
  675   3HG2  THR  88          3HG2      THR  88   2.797  -0.396   9.425
  676    H    ILE  89           H        ILE  89  -1.064  -2.324   7.127
  677    HA   ILE  89           HA       ILE  89  -1.657  -4.399   9.191
  678    HB   ILE  89           HB       ILE  89  -2.017  -4.895   6.244
  679   1HG1  ILE  89          1HG1      ILE  89  -3.119  -2.724   6.428
  680   2HG1  ILE  89          2HG1      ILE  89  -4.248  -4.051   6.214
  681   1HG2  ILE  89          1HG2      ILE  89  -3.504  -5.749   8.766
  682   2HG2  ILE  89          2HG2      ILE  89  -2.436  -6.741   7.755
  683   3HG2  ILE  89          3HG2      ILE  89  -3.983  -6.178   7.119
  684   1HD1  ILE  89          1HD1      ILE  89  -5.022  -2.333   7.842
  685   2HD1  ILE  89          2HD1      ILE  89  -3.691  -2.764   8.926
  686   3HD1  ILE  89          3HD1      ILE  89  -4.948  -3.959   8.540
  687    H    ILE  90           H        ILE  90  -0.574  -6.572   8.656
  688    HA   ILE  90           HA       ILE  90   1.993  -6.333   7.227
  689    HB   ILE  90           HB       ILE  90   1.837  -7.117  10.179
  690   1HG1  ILE  90          1HG1      ILE  90   2.995  -4.617   8.862
  691   2HG1  ILE  90          2HG1      ILE  90   1.618  -4.690   9.978
  692   1HG2  ILE  90          1HG2      ILE  90   4.300  -7.275  10.037
  693   2HG2  ILE  90          2HG2      ILE  90   4.248  -6.821   8.321
  694   3HG2  ILE  90          3HG2      ILE  90   3.577  -8.368   8.886
  695   1HD1  ILE  90          1HD1      ILE  90   3.165  -5.567  11.753
  696   2HD1  ILE  90          2HD1      ILE  90   4.523  -5.161  10.669
  697   3HD1  ILE  90          3HD1      ILE  90   3.433  -3.892  11.233
  698    H    GLY  91           H        GLY  91   2.734  -8.341   6.526
  699   1HA   GLY  91          2HA       GLY  91   2.787 -10.651   6.310
  700   2HA   GLY  91          1HA       GLY  91   1.460 -10.827   7.465
  701    H    ALA  92           H        ALA  92   1.422 -12.411   5.289
  702    HA   ALA  92           HA       ALA  92   0.119 -11.346   2.995
  703   1HB   ALA  92          1HB       ALA  92   1.385 -13.433   2.932
  704   2HB   ALA  92          2HB       ALA  92   0.283 -14.187   4.105
  705   3HB   ALA  92          3HB       ALA  92  -0.293 -13.767   2.482
  706    H    VAL  93           H        VAL  93  -1.566 -10.029   4.030
  707    HA   VAL  93           HA       VAL  93  -3.691 -11.274   5.461
  708    HB   VAL  93           HB       VAL  93  -4.710  -8.973   4.117
  709   1HG1  VAL  93          1HG1      VAL  93  -2.056  -8.370   5.495
  710   2HG1  VAL  93          2HG1      VAL  93  -2.349  -8.227   3.738
  711   3HG1  VAL  93          3HG1      VAL  93  -3.214  -7.186   4.870
  712   1HG2  VAL  93          1HG2      VAL  93  -5.133  -8.035   6.149
  713   2HG2  VAL  93          2HG2      VAL  93  -4.004  -9.139   6.988
  714   3HG2  VAL  93          3HG2      VAL  93  -5.485  -9.757   6.221
  715    HA   PRO  94           HA       PRO  94  -6.285 -12.300   1.820
  716   1HB   PRO  94          1HB       PRO  94  -8.671 -12.412   3.535
  717   2HB   PRO  94          2HB       PRO  94  -7.833 -13.761   2.723
  718   1HG   PRO  94          1HG       PRO  94  -7.812 -13.442   5.478
  719   2HG   PRO  94          2HG       PRO  94  -6.408 -14.106   4.584
  720   1HD   PRO  94          1HD       PRO  94  -6.903 -11.226   5.362
  721   2HD   PRO  94          2HD       PRO  94  -5.472 -12.187   5.753
  722    H    LYS  95           HN       LYS  95  -7.745 -11.023   0.504
  723    HA   LYS  95           HA       LYS  95  -7.740  -8.329   0.994
  724   1HB   LYS  95          1HB       LYS  95  -9.550  -8.172  -0.747
  725   2HB   LYS  95          2HB       LYS  95  -8.214  -9.214  -1.273
  726   1HG   LYS  95          1HG       LYS  95  -9.633 -11.212  -0.706
  727   2HG   LYS  95          2HG       LYS  95 -10.956 -10.125  -0.248
  728   1HD   LYS  95          2HD       LYS  95  -9.775 -10.390  -3.023
  729   2HD   LYS  95          1HD       LYS  95 -11.324 -11.001  -2.448
  730   1HE   LYS  95          2HE       LYS  95 -11.973  -8.573  -1.922
  731   2HE   LYS  95          1HE       LYS  95 -10.511  -8.085  -2.806
  732   1HZ   LYS  95          1HZ       LYS  95 -12.752  -9.634  -3.881
  733   2HZ   LYS  95          2HZ       LYS  95 -11.363  -9.296  -4.697
  734   3HZ   LYS  95          3HZ       LYS  95 -12.373  -8.073  -4.243
  735    H    ALA  96           H        ALA  96 -10.349 -10.564   1.787
  736    HA   ALA  96           HA       ALA  96 -12.424  -8.931   2.539
  737   1HB   ALA  96          1HB       ALA  96 -12.481 -11.387   2.725
  738   2HB   ALA  96          2HB       ALA  96 -11.369 -11.331   4.111
  739   3HB   ALA  96          3HB       ALA  96 -12.998 -10.634   4.246
  740    H    THR  97           H        THR  97  -9.619  -9.733   4.677
  741    HA   THR  97           HA       THR  97 -10.430  -8.114   6.853
  742    HB   THR  97           HB       THR  97  -7.608  -8.869   5.994
  743    HG1  THR  97           HG1      THR  97  -9.574 -10.384   7.373
  744   1HG2  THR  97          1HG2      THR  97  -7.717  -7.378   7.978
  745   2HG2  THR  97          2HG2      THR  97  -8.878  -8.477   8.752
  746   3HG2  THR  97          3HG2      THR  97  -7.213  -9.012   8.443
  747    H    ILE  98           H        ILE  98  -8.231  -7.460   4.082
  748    HA   ILE  98           HA       ILE  98  -7.363  -4.862   4.867
  749    HB   ILE  98           HB       ILE  98  -7.675  -6.199   2.126
  750   1HG1  ILE  98          2HG1      ILE  98  -5.236  -5.658   3.875
  751   2HG1  ILE  98          1HG1      ILE  98  -6.080  -7.205   3.728
  752   1HG2  ILE  98          1HG2      ILE  98  -6.291  -3.570   2.839
  753   2HG2  ILE  98          2HG2      ILE  98  -7.748  -3.727   1.835
  754   3HG2  ILE  98          3HG2      ILE  98  -6.230  -4.378   1.256
  755   1HD1  ILE  98          1HD1      ILE  98  -5.592  -7.184   1.250
  756   2HD1  ILE  98          2HD1      ILE  98  -4.173  -7.323   2.300
  757   3HD1  ILE  98          3HD1      ILE  98  -4.538  -5.777   1.532
  758    H    VAL  99           H        VAL  99  -9.970  -5.856   2.668
  759    HA   VAL  99           HA       VAL  99 -11.140  -3.393   2.069
  760    HB   VAL  99           HB       VAL  99 -12.249  -6.223   2.319
  761   1HG1  VAL  99          1HG2      VAL  99 -13.702  -3.727   1.383
  762   2HG1  VAL  99          2HG2      VAL  99 -14.208  -5.377   0.972
  763   3HG1  VAL  99          3HG2      VAL  99 -14.206  -4.853   2.657
  764   1HG2  VAL  99          1HG1      VAL  99 -11.666  -4.458  -0.094
  765   2HG2  VAL  99          2HG1      VAL  99 -10.593  -5.739   0.498
  766   3HG2  VAL  99          3HG1      VAL  99 -12.199  -6.151  -0.122
  767    H    GLN 100           H        GLN 100 -12.285  -5.714   4.623
  768    HA   GLN 100           HA       GLN 100 -14.164  -3.961   5.746
  769   1HB   GLN 100          1HB       GLN 100 -12.465  -6.194   6.941
  770   2HB   GLN 100          2HB       GLN 100 -13.692  -5.373   7.891
  771   1HG   GLN 100          2HG       GLN 100 -14.182  -6.882   5.274
  772   2HG   GLN 100          1HG       GLN 100 -14.549  -7.473   6.899
  773   1HE2  GLN 100          1HE2      GLN 100 -15.568  -4.760   7.813
  774   2HE2  GLN 100          2HE2      GLN 100 -17.133  -4.635   7.028
  775    H    THR 101           H        THR 101 -10.707  -4.287   6.587
  776    HA   THR 101           HA       THR 101 -10.776  -2.517   8.813
  777    HB   THR 101           HB       THR 101  -8.426  -3.146   6.950
  778    HG1  THR 101           HG1      THR 101  -9.288  -4.982   7.892
  779   1HG2  THR 101          1HG2      THR 101  -8.579  -2.010   9.783
  780   2HG2  THR 101          2HG2      THR 101  -7.102  -2.613   9.016
  781   3HG2  THR 101          3HG2      THR 101  -7.920  -1.191   8.348
  782    H    VAL 102           H        VAL 102 -10.168  -1.835   5.287
  783    HA   VAL 102           HA       VAL 102  -9.763   0.995   5.885
  784    HB   VAL 102           HB       VAL 102 -10.265  -0.473   3.312
  785   1HG1  VAL 102          1HG1      VAL 102  -7.748   0.744   4.524
  786   2HG1  VAL 102          2HG1      VAL 102  -8.112  -1.001   4.457
  787   3HG1  VAL 102          3HG1      VAL 102  -7.845  -0.097   2.974
  788   1HG2  VAL 102          1HG2      VAL 102  -9.631   2.460   3.906
  789   2HG2  VAL 102          2HG2      VAL 102  -9.262   1.748   2.337
  790   3HG2  VAL 102          3HG2      VAL 102 -10.938   1.813   2.889
  791    H    GLU 103           HN       GLU 103 -12.504  -0.917   4.640
  792    HA   GLU 103           HA       GLU 103 -14.246   1.129   3.928
  793   1HB   GLU 103          1HB       GLU 103 -14.744  -1.602   5.156
  794   2HB   GLU 103          2HB       GLU 103 -16.047  -0.576   4.566
  795   1HG   GLU 103          2HG       GLU 103 -13.690  -1.340   2.780
  796   2HG   GLU 103          1HG       GLU 103 -15.130  -2.362   2.951
  797    H    LYS 104           HN       LYS 104 -13.724  -0.289   7.138
  798    HA   LYS 104           HA       LYS 104 -15.514   1.058   8.763
  799   1HB   LYS 104          2HB       LYS 104 -13.809  -0.586   9.506
  800   2HB   LYS 104          1HB       LYS 104 -12.544   0.594   9.142
  801   1HG   LYS 104          2HG       LYS 104 -13.570   2.116  10.928
  802   2HG   LYS 104          1HG       LYS 104 -14.570   0.722  11.393
  803   1HD   LYS 104          2HD       LYS 104 -12.456  -0.607  11.685
  804   2HD   LYS 104          1HD       LYS 104 -11.525   0.801  11.164
  805   1HE   LYS 104          2HE       LYS 104 -12.406   2.108  13.107
  806   2HE   LYS 104          1HE       LYS 104 -13.266   0.659  13.669
  807   1HZ   LYS 104          1HZ       LYS 104 -10.356   0.931  13.338
  808   2HZ   LYS 104          2HZ       LYS 104 -11.136  -0.429  13.853
  809   3HZ   LYS 104          3HZ       LYS 104 -11.175   0.941  14.768
  810    H    TYR 105           H        TYR 105 -12.500   2.375   7.350
  811    HA   TYR 105           HA       TYR 105 -12.857   5.021   8.645
  812   1HB   TYR 105          2HB       TYR 105 -10.641   3.904   6.881
  813   2HB   TYR 105          1HB       TYR 105 -10.586   5.403   7.805
  814    HD1  TYR 105           HD1      TYR 105 -11.001   5.148  10.410
  815    HD2  TYR 105           HD2      TYR 105  -9.445   2.078   7.829
  816    HE1  TYR 105           HE1      TYR 105 -10.096   3.940  12.387
  817    HE2  TYR 105           HE2      TYR 105  -8.743   0.780   9.799
  818    HH   TYR 105           HH       TYR 105  -8.097   1.063  12.071
  819    H    LEU 106           H        LEU 106 -13.837   3.494   5.726
  820    HA   LEU 106           HA       LEU 106 -14.039   6.050   4.303
  821   1HB   LEU 106          1HB       LEU 106 -11.651   5.091   4.135
  822   2HB   LEU 106          2HB       LEU 106 -12.316   3.763   3.214
  823    HG   LEU 106           HG       LEU 106 -11.153   5.547   2.041
  824   1HD1  LEU 106          1HD2      LEU 106 -12.095   7.728   1.598
  825   2HD1  LEU 106          2HD2      LEU 106 -13.568   7.341   2.500
  826   3HD1  LEU 106          3HD2      LEU 106 -12.012   7.482   3.353
  827   1HD2  LEU 106          1HD1      LEU 106 -14.045   5.263   1.065
  828   2HD2  LEU 106          2HD1      LEU 106 -12.666   5.751   0.084
  829   3HD2  LEU 106          3HD1      LEU 106 -12.724   4.119   0.769
  830    H    ASN 107           H        ASN 107 -16.328   5.564   4.388
  831    HA   ASN 107           HA       ASN 107 -17.305   3.988   2.225
  832   1HB   ASN 107          1HB       ASN 107 -17.033   2.315   4.153
  833   2HB   ASN 107          2HB       ASN 107 -18.186   3.290   5.069
  834   1HD2  ASN 107          2HD2      ASN 107 -19.926   3.821   2.633
  835   2HD2  ASN 107          1HD2      ASN 107 -20.697   2.263   2.311
  Start of MODEL   24
    1   1H    MET   1          1H        MET   1  -1.317  -3.329 -10.924
    2   2H    MET   1          2H        MET   1  -0.337  -2.035 -10.990
    3   3H    MET   1          3H        MET   1   0.115  -3.467 -11.722
    4    HA   MET   1           HA       MET   1  -0.603  -1.786 -13.312
    5   1HB   MET   1          2HB       MET   1  -2.468  -3.193 -14.382
    6   2HB   MET   1          1HB       MET   1  -0.850  -3.854 -14.251
    7   1HG   MET   1          1HG       MET   1  -3.146  -4.610 -12.399
    8   2HG   MET   1          2HG       MET   1  -2.645  -5.491 -13.822
    9   1HE   MET   1          1HE       MET   1  -0.642  -6.989 -14.089
   10   2HE   MET   1          2HE       MET   1   0.643  -7.202 -12.882
   11   3HE   MET   1          3HE       MET   1   0.525  -5.677 -13.783
   12    H    GLU   2           HN       GLU   2  -3.457  -2.940 -11.392
   13    HA   GLU   2           HA       GLU   2  -4.979  -0.506 -11.977
   14   1HB   GLU   2          1HB       GLU   2  -5.340  -2.707  -9.897
   15   2HB   GLU   2          2HB       GLU   2  -6.511  -1.434 -10.251
   16   1HG   GLU   2          2HG       GLU   2  -6.812  -2.284 -12.533
   17   2HG   GLU   2          1HG       GLU   2  -5.564  -3.513 -12.289
   18    H    ALA   3           H        ALA   3  -3.071  -2.004  -9.414
   19    HA   ALA   3           HA       ALA   3  -2.857   0.493  -7.844
   20   1HB   ALA   3          1HB       ALA   3  -1.635  -2.285  -7.477
   21   2HB   ALA   3          2HB       ALA   3  -3.081  -1.665  -6.655
   22   3HB   ALA   3          3HB       ALA   3  -1.491  -0.928  -6.338
   23    H    GLY   4           H        GLY   4  -0.989   1.792  -7.987
   24   1HA   GLY   4          2HA       GLY   4   0.744   1.364 -10.323
   25   2HA   GLY   4          1HA       GLY   4   0.775   2.718  -9.189
   26    H    ALA   5           H        ALA   5   3.204   2.197  -9.621
   27    HA   ALA   5           HA       ALA   5   4.209   0.454  -7.439
   28   1HB   ALA   5          1HB       ALA   5   4.612  -0.729  -9.565
   29   2HB   ALA   5          2HB       ALA   5   5.389   0.725 -10.235
   30   3HB   ALA   5          3HB       ALA   5   6.130  -0.130  -8.864
   31    H    VAL   6           H        VAL   6   5.851   1.520  -6.240
   32    HA   VAL   6           HA       VAL   6   6.785   4.150  -7.242
   33    HB   VAL   6           HB       VAL   6   6.403   5.009  -4.801
   34   1HG1  VAL   6          1HG1      VAL   6   4.250   2.861  -4.837
   35   2HG1  VAL   6          2HG1      VAL   6   5.655   2.953  -3.771
   36   3HG1  VAL   6          3HG1      VAL   6   4.403   4.193  -3.681
   37   1HG2  VAL   6          1HG2      VAL   6   4.146   5.827  -5.408
   38   2HG2  VAL   6          2HG2      VAL   6   4.225   4.807  -6.869
   39   3HG2  VAL   6          3HG2      VAL   6   5.405   6.097  -6.620
   40    H    ASN   7           H        ASN   7   8.342   5.118  -5.811
   41    HA   ASN   7           HA       ASN   7  10.141   3.358  -4.331
   42   1HB   ASN   7          2HB       ASN   7  10.854   4.865  -6.900
   43   2HB   ASN   7          1HB       ASN   7  12.078   4.317  -5.773
   44   1HD2  ASN   7          2HD2      ASN   7  12.358   1.996  -5.387
   45   2HD2  ASN   7          1HD2      ASN   7  11.810   0.871  -6.610
   46    H    ASP   8           HN       ASP   8  11.921   4.877  -3.514
   47    HA   ASP   8           HA       ASP   8  11.158   6.712  -1.801
   48   1HB   ASP   8          2HB       ASP   8  13.500   5.949  -2.218
   49   2HB   ASP   8          1HB       ASP   8  13.645   7.082  -3.551
   50    H    ASP   9           HN       ASP   9  12.281   7.867  -4.951
   51    HA   ASP   9           HA       ASP   9  11.559  10.553  -4.666
   52   1HB   ASP   9          1HB       ASP   9  11.721   8.935  -7.254
   53   2HB   ASP   9          2HB       ASP   9  11.896  10.683  -7.073
   54    H    THR  10           H        THR  10   9.749   7.987  -6.457
   55    HA   THR  10           HA       THR  10   7.671   9.764  -7.306
   56    HB   THR  10           HB       THR  10   6.608   7.585  -8.000
   57    HG1  THR  10           HG1      THR  10   8.095   5.774  -7.792
   58   1HG2  THR  10          1HG2      THR  10   8.317   7.037  -9.674
   59   2HG2  THR  10          2HG2      THR  10   8.241   8.795  -9.457
   60   3HG2  THR  10          3HG2      THR  10   9.567   7.863  -8.730
   61    H    PHE  11           H        PHE  11   7.977   7.497  -4.619
   62    HA   PHE  11           HA       PHE  11   5.504   7.209  -3.548
   63   1HB   PHE  11          1HB       PHE  11   7.719   6.427  -2.640
   64   2HB   PHE  11          2HB       PHE  11   7.975   8.003  -1.947
   65    HD1  PHE  11           HD1      PHE  11   6.162   4.812  -1.711
   66    HD2  PHE  11           HD2      PHE  11   6.622   8.734   0.029
   67    HE1  PHE  11           HE1      PHE  11   5.192   3.985   0.413
   68    HE2  PHE  11           HE2      PHE  11   5.604   7.912   2.132
   69    HZ   PHE  11           HZ       PHE  11   4.936   5.530   2.345
   70    H    LYS  12           HN       LYS  12   7.602   9.994  -3.115
   71    HA   LYS  12           HA       LYS  12   5.984  11.572  -1.399
   72   1HB   LYS  12          1HB       LYS  12   7.872  12.445  -3.635
   73   2HB   LYS  12          2HB       LYS  12   7.162  13.492  -2.412
   74   1HG   LYS  12          1HG       LYS  12   8.283  12.045  -0.633
   75   2HG   LYS  12          2HG       LYS  12   8.969  11.061  -1.934
   76   1HD   LYS  12          1HD       LYS  12  10.051  13.211  -2.836
   77   2HD   LYS  12          2HD       LYS  12   9.555  13.982  -1.318
   78   1HE   LYS  12          1HE       LYS  12  11.834  13.231  -1.036
   79   2HE   LYS  12          2HE       LYS  12  10.820  12.133  -0.082
   80   1HZ   LYS  12          1HZ       LYS  12  12.442  10.943  -1.390
   81   2HZ   LYS  12          2HZ       LYS  12  10.942  10.575  -1.940
   82   3HZ   LYS  12          3HZ       LYS  12  11.889  11.625  -2.776
   83    H    ASN  13           H        ASN  13   6.248  11.895  -4.953
   84    HA   ASN  13           HA       ASN  13   4.147  13.812  -5.235
   85   1HB   ASN  13          1HB       ASN  13   5.237  11.852  -7.283
   86   2HB   ASN  13          2HB       ASN  13   4.399  13.372  -7.603
   87   1HD2  ASN  13          2HD2      ASN  13   5.931  14.905  -5.421
   88   2HD2  ASN  13          1HD2      ASN  13   7.501  15.118  -6.170
   89    H    VAL  14           H        VAL  14   4.219  10.341  -5.241
   90    HA   VAL  14           HA       VAL  14   1.510  10.135  -6.460
   91    HB   VAL  14           HB       VAL  14   3.633   8.102  -5.684
   92   1HG1  VAL  14          1HG1      VAL  14   3.925   7.884  -8.129
   93   2HG1  VAL  14          2HG1      VAL  14   2.673   9.110  -8.404
   94   3HG1  VAL  14          3HG1      VAL  14   4.209   9.558  -7.647
   95   1HG2  VAL  14          1HG2      VAL  14   1.497   6.966  -5.570
   96   2HG2  VAL  14          2HG2      VAL  14   2.311   6.510  -7.075
   97   3HG2  VAL  14          3HG2      VAL  14   0.984   7.687  -7.118
   98    H    VAL  15           H        VAL  15   3.092   9.008  -3.437
   99    HA   VAL  15           HA       VAL  15   0.524   8.104  -2.357
  100    HB   VAL  15           HB       VAL  15   3.275   8.115  -1.028
  101   1HG1  VAL  15          1HG1      VAL  15   0.723   6.601  -0.426
  102   2HG1  VAL  15          2HG1      VAL  15   2.304   6.337   0.351
  103   3HG1  VAL  15          3HG1      VAL  15   1.464   7.873   0.560
  104   1HG2  VAL  15          1HG2      VAL  15   3.454   5.785  -1.764
  105   2HG2  VAL  15          2HG2      VAL  15   3.371   6.850  -3.163
  106   3HG2  VAL  15          3HG2      VAL  15   1.936   5.943  -2.681
  107    H    LEU  16           H        LEU  16   3.107  10.446  -1.353
  108    HA   LEU  16           HA       LEU  16   1.469  11.350   0.874
  109   1HB   LEU  16          1HB       LEU  16   3.914  12.695  -0.344
  110   2HB   LEU  16          2HB       LEU  16   3.189  13.036   1.217
  111    HG   LEU  16           HG       LEU  16   4.552  10.436   0.383
  112   1HD1  LEU  16          1HD1      LEU  16   5.286  12.539   2.462
  113   2HD1  LEU  16          2HD1      LEU  16   6.040  12.381   0.863
  114   3HD1  LEU  16          3HD1      LEU  16   6.215  11.080   2.057
  115   1HD2  LEU  16          1HD2      LEU  16   4.275   9.828   2.822
  116   2HD2  LEU  16          2HD2      LEU  16   2.769   9.812   1.902
  117   3HD2  LEU  16          3HD2      LEU  16   3.136  11.178   2.984
  118    H    GLU  17           HN       GLU  17   2.412  13.003  -2.207
  119    HA   GLU  17           HA       GLU  17   0.549  15.188  -1.688
  120   1HB   GLU  17          2HB       GLU  17   2.170  14.421  -4.145
  121   2HB   GLU  17          1HB       GLU  17   1.355  15.959  -3.881
  122   1HG   GLU  17          1HG       GLU  17   2.798  16.453  -1.950
  123   2HG   GLU  17          2HG       GLU  17   3.623  14.899  -2.121
  124    H    SER  18           H        SER  18  -1.023  12.979  -1.510
  125    HA   SER  18           HA       SER  18  -2.293  12.381  -4.104
  126   1HB   SER  18          1HB       SER  18  -3.579  10.800  -2.543
  127   2HB   SER  18          2HB       SER  18  -1.846  10.494  -2.765
  128    HG   SER  18           HG       SER  18  -1.496  10.950  -0.739
  129    H    SER  19           H        SER  19  -4.629  12.553  -4.319
  130    HA   SER  19           HA       SER  19  -5.808  14.935  -3.039
  131   1HB   SER  19          1HB       SER  19  -7.571  14.366  -4.826
  132   2HB   SER  19          2HB       SER  19  -5.968  14.848  -5.419
  133    HG   SER  19           HG       SER  19  -6.664  12.946  -6.477
  134    H    VAL  20           H        VAL  20  -7.014  11.779  -4.045
  135    HA   VAL  20           HA       VAL  20  -8.784  11.509  -1.704
  136    HB   VAL  20           HB       VAL  20  -9.397   9.333  -2.745
  137   1HG1  VAL  20          1HG1      VAL  20  -7.492  10.054  -5.014
  138   2HG1  VAL  20          2HG1      VAL  20  -8.608   8.682  -4.940
  139   3HG1  VAL  20          3HG1      VAL  20  -7.234   8.753  -3.834
  140   1HG2  VAL  20          1HG2      VAL  20 -10.531  10.230  -4.699
  141   2HG2  VAL  20          2HG2      VAL  20  -9.468  11.652  -4.712
  142   3HG2  VAL  20          3HG2      VAL  20 -10.597  11.391  -3.362
  143    HA   PRO  21           HA       PRO  21  -5.986   9.184   0.836
  144   1HB   PRO  21          1HB       PRO  21  -8.083   6.991   0.878
  145   2HB   PRO  21          2HB       PRO  21  -7.151   7.633   2.262
  146   1HG   PRO  21          2HG       PRO  21  -9.661   8.413   1.854
  147   2HG   PRO  21          1HG       PRO  21  -8.438   9.660   2.250
  148   1HD   PRO  21          1HD       PRO  21  -9.623   9.003  -0.459
  149   2HD   PRO  21          2HD       PRO  21  -9.225  10.587   0.261
  150    H    VAL  22           H        VAL  22  -4.812   7.062   0.980
  151    HA   VAL  22           HA       VAL  22  -4.671   5.601  -1.583
  152    HB   VAL  22           HB       VAL  22  -2.235   6.688  -0.115
  153   1HG1  VAL  22          1HG2      VAL  22  -1.156   6.187  -2.304
  154   2HG1  VAL  22          2HG2      VAL  22  -1.823   4.751  -1.504
  155   3HG1  VAL  22          3HG2      VAL  22  -2.696   5.489  -2.855
  156   1HG2  VAL  22          1HG1      VAL  22  -1.990   8.342  -1.933
  157   2HG2  VAL  22          2HG1      VAL  22  -3.377   8.684  -0.896
  158   3HG2  VAL  22          3HG1      VAL  22  -3.626   7.962  -2.500
  159    H    LEU  23           H        LEU  23  -4.005   3.438  -1.325
  160    HA   LEU  23           HA       LEU  23  -3.141   2.517   1.401
  161   1HB   LEU  23          1HB       LEU  23  -5.377   1.796   0.942
  162   2HB   LEU  23          2HB       LEU  23  -4.938   1.104  -0.621
  163    HG   LEU  23           HG       LEU  23  -3.550   0.171   1.920
  164   1HD1  LEU  23          1HD1      LEU  23  -2.655  -0.848  -0.120
  165   2HD1  LEU  23          2HD1      LEU  23  -4.294  -1.177  -0.728
  166   3HD1  LEU  23          3HD1      LEU  23  -3.658  -2.057   0.667
  167   1HD2  LEU  23          1HD2      LEU  23  -5.953   0.128   2.437
  168   2HD2  LEU  23          2HD2      LEU  23  -5.300  -1.508   2.288
  169   3HD2  LEU  23          3HD2      LEU  23  -6.260  -0.823   0.962
  170    H    VAL  24           H        VAL  24  -0.924   2.244   1.138
  171    HA   VAL  24           HA       VAL  24  -0.010   1.242  -1.513
  172    HB   VAL  24           HB       VAL  24   2.136   2.072  -1.082
  173   1HG1  VAL  24          1HG2      VAL  24   0.419   3.710  -1.829
  174   2HG1  VAL  24          2HG2      VAL  24   1.768   4.424  -0.933
  175   3HG1  VAL  24          3HG2      VAL  24   0.197   4.221  -0.137
  176   1HG2  VAL  24          1HG1      VAL  24   2.468   1.594   1.280
  177   2HG2  VAL  24          2HG1      VAL  24   2.750   3.312   0.981
  178   3HG2  VAL  24          3HG1      VAL  24   1.220   2.785   1.714
  179    H    ASP  25           HN       ASP  25   1.381  -0.561  -1.587
  180    HA   ASP  25           HA       ASP  25   1.566  -2.195   0.931
  181   1HB   ASP  25          1HB       ASP  25   0.173  -3.290  -0.751
  182   2HB   ASP  25          2HB       ASP  25   1.457  -3.101  -1.960
  183    H    PHE  26           H        PHE  26   3.604  -2.281   1.755
  184    HA   PHE  26           HA       PHE  26   5.953  -1.587   0.081
  185   1HB   PHE  26          1HB       PHE  26   5.580  -2.369   2.992
  186   2HB   PHE  26          2HB       PHE  26   7.146  -2.254   2.223
  187    HD1  PHE  26           HD1      PHE  26   8.325  -0.289   2.407
  188    HD2  PHE  26           HD2      PHE  26   4.025  -0.117   2.672
  189    HE1  PHE  26           HE1      PHE  26   8.445   2.147   2.756
  190    HE2  PHE  26           HE2      PHE  26   4.155   2.311   3.099
  191    HZ   PHE  26           HZ       PHE  26   6.352   3.455   3.172
  192    H    TRP  27           H        TRP  27   6.662  -3.173  -1.281
  193    HA   TRP  27           HA       TRP  27   6.428  -6.029  -0.415
  194   1HB   TRP  27          2HB       TRP  27   5.696  -6.623  -2.624
  195   2HB   TRP  27          1HB       TRP  27   4.642  -5.348  -2.054
  196    HD1  TRP  27           HD1      TRP  27   5.402  -2.816  -3.035
  197    HE1  TRP  27           HE1      TRP  27   6.461  -2.114  -5.295
  198    HE3  TRP  27           HE3      TRP  27   6.915  -7.414  -4.646
  199    HZ2  TRP  27           HZ2      TRP  27   7.947  -3.384  -7.381
  200    HZ3  TRP  27           HZ3      TRP  27   8.040  -7.641  -6.850
  201    HH2  TRP  27           HH2      TRP  27   8.619  -5.644  -8.187
  202    H    ALA  28           H        ALA  28   7.616  -7.315  -2.401
  203    HA   ALA  28           HA       ALA  28   9.907  -6.043  -3.523
  204   1HB   ALA  28          1HB       ALA  28  10.425  -8.100  -1.306
  205   2HB   ALA  28          2HB       ALA  28  11.666  -7.343  -2.298
  206   3HB   ALA  28          3HB       ALA  28  10.757  -6.359  -1.154
  207    HA   PRO  29           HA       PRO  29   9.148  -9.403  -6.297
  208   1HB   PRO  29          1HB       PRO  29  11.610 -10.170  -7.254
  209   2HB   PRO  29          2HB       PRO  29  10.743  -8.664  -7.694
  210   1HG   PRO  29          1HG       PRO  29  12.916  -8.985  -5.602
  211   2HG   PRO  29          2HG       PRO  29  12.809  -7.755  -6.894
  212   1HD   PRO  29          1HD       PRO  29  11.961  -7.145  -4.409
  213   2HD   PRO  29          2HD       PRO  29  10.969  -6.670  -5.797
  214    H    TRP  30           H        TRP  30  11.799 -10.165  -4.049
  215    HA   TRP  30           HA       TRP  30  11.344 -13.020  -4.096
  216   1HB   TRP  30          1HB       TRP  30  12.830 -12.949  -2.088
  217   2HB   TRP  30          2HB       TRP  30  13.499 -12.175  -3.519
  218    HD1  TRP  30           HD1      TRP  30  14.195  -9.701  -3.356
  219    HE1  TRP  30           HE1      TRP  30  14.324  -7.966  -1.486
  220    HE3  TRP  30           HE3      TRP  30  11.370 -12.115   0.189
  221    HZ2  TRP  30           HZ2      TRP  30  13.129  -7.553   1.114
  222    HZ3  TRP  30           HZ3      TRP  30  10.761 -10.955   2.281
  223    HH2  TRP  30           HH2      TRP  30  11.541  -8.640   2.710
  224    H    CYS  31           H        CYS  31   9.478 -10.442  -2.722
  225    HA   CYS  31           HA       CYS  31   8.798 -11.865  -0.243
  226   1HB   CYS  31          1HB       CYS  31   8.780  -9.390  -0.360
  227   2HB   CYS  31          2HB       CYS  31   7.485  -9.477  -1.535
  228    H    GLY  32           H        GLY  32   8.234 -13.893  -1.377
  229   1HA   GLY  32          1HA       GLY  32   6.190 -14.487  -3.070
  230   2HA   GLY  32          2HA       GLY  32   6.472 -15.436  -1.606
  231    HA   PRO  33           HA       PRO  33   2.694 -14.115   0.239
  232   1HB   PRO  33          2HB       PRO  33   3.982 -12.239   2.203
  233   2HB   PRO  33          1HB       PRO  33   2.804 -13.546   2.514
  234   1HG   PRO  33          1HG       PRO  33   5.374 -13.905   3.101
  235   2HG   PRO  33          2HG       PRO  33   4.472 -15.215   2.277
  236   1HD   PRO  33          1HD       PRO  33   6.350 -13.206   1.010
  237   2HD   PRO  33          2HD       PRO  33   6.245 -14.970   0.736
  238    H    CYS  34           H        CYS  34   4.828 -11.440  -0.684
  239    HA   CYS  34           HA       CYS  34   2.692  -9.404  -0.722
  240   1HB   CYS  34          2HB       CYS  34   5.355  -9.264  -2.122
  241   2HB   CYS  34          1HB       CYS  34   4.174  -8.008  -1.792
  242    H    ARG  35           HN       ARG  35   4.678 -11.237  -3.058
  243    HA   ARG  35           HA       ARG  35   3.519 -10.451  -5.459
  244   1HB   ARG  35          2HB       ARG  35   4.699 -13.131  -4.612
  245   2HB   ARG  35          1HB       ARG  35   4.368 -12.691  -6.278
  246   1HG   ARG  35          2HG       ARG  35   6.235 -11.062  -4.493
  247   2HG   ARG  35          1HG       ARG  35   6.768 -12.427  -5.465
  248   1HD   ARG  35          1HD       ARG  35   5.405  -9.917  -6.558
  249   2HD   ARG  35          2HD       ARG  35   7.130 -10.209  -6.556
  250    HE   ARG  35           HE       ARG  35   5.163 -11.297  -8.369
  251   1HH1  ARG  35          1HH2      ARG  35   8.338 -12.007  -6.896
  252   2HH1  ARG  35          2HH2      ARG  35   8.883 -12.938  -8.257
  253   1HH2  ARG  35          2HH1      ARG  35   5.891 -12.542 -10.113
  254   2HH2  ARG  35          1HH1      ARG  35   7.474 -13.271 -10.098
  255    H    ILE  36           H        ILE  36   2.521 -13.255  -3.405
  256    HA   ILE  36           HA       ILE  36   0.406 -13.942  -5.264
  257    HB   ILE  36           HB       ILE  36  -0.326 -15.539  -3.576
  258   1HG1  ILE  36          2HG1      ILE  36   1.508 -15.632  -1.559
  259   2HG1  ILE  36          1HG1      ILE  36   1.363 -13.884  -1.736
  260   1HG2  ILE  36          1HG2      ILE  36   1.695 -16.884  -3.564
  261   2HG2  ILE  36          2HG2      ILE  36   2.710 -15.464  -3.866
  262   3HG2  ILE  36          3HG2      ILE  36   1.565 -16.019  -5.102
  263   1HD1  ILE  36          1HD1      ILE  36  -0.248 -14.691  -0.087
  264   2HD1  ILE  36          2HD1      ILE  36  -1.171 -14.195  -1.523
  265   3HD1  ILE  36          3HD1      ILE  36  -0.863 -15.912  -1.217
  266    H    ILE  37           H        ILE  37   0.518 -11.500  -2.726
  267    HA   ILE  37           HA       ILE  37  -2.439 -11.299  -2.671
  268    HB   ILE  37           HB       ILE  37  -0.222  -9.827  -1.195
  269   1HG1  ILE  37          1HG1      ILE  37  -0.601 -12.198  -0.497
  270   2HG1  ILE  37          2HG1      ILE  37  -0.950 -11.002   0.746
  271   1HG2  ILE  37          1HG2      ILE  37  -2.134  -8.996   0.260
  272   2HG2  ILE  37          2HG2      ILE  37  -2.027  -8.263  -1.331
  273   3HG2  ILE  37          3HG2      ILE  37  -3.249  -9.507  -1.024
  274   1HD1  ILE  37          1HD1      ILE  37  -3.035 -12.479  -0.926
  275   2HD1  ILE  37          2HD1      ILE  37  -3.378 -11.307   0.372
  276   3HD1  ILE  37          3HD1      ILE  37  -2.574 -12.837   0.740
  277    H    ALA  38           H        ALA  38   0.368  -9.747  -4.161
  278    HA   ALA  38           HA       ALA  38  -0.436  -7.330  -4.952
  279   1HB   ALA  38          1HB       ALA  38   0.754  -9.348  -6.902
  280   2HB   ALA  38          2HB       ALA  38   0.829  -7.586  -6.996
  281   3HB   ALA  38          3HB       ALA  38   1.650  -8.432  -5.672
  282    HA   PRO  39           HA       PRO  39  -3.294  -8.722  -8.597
  283   1HB   PRO  39          2HB       PRO  39  -4.461 -11.289  -7.597
  284   2HB   PRO  39          1HB       PRO  39  -3.955 -10.863  -9.254
  285   1HG   PRO  39          1HG       PRO  39  -2.465 -12.576  -7.738
  286   2HG   PRO  39          2HG       PRO  39  -1.661 -11.331  -8.746
  287   1HD   PRO  39          1HD       PRO  39  -2.407 -11.134  -5.811
  288   2HD   PRO  39          2HD       PRO  39  -0.796 -10.893  -6.547
  289    H    VAL  40           H        VAL  40  -3.876  -9.706  -5.259
  290    HA   VAL  40           HA       VAL  40  -6.679  -9.032  -5.151
  291    HB   VAL  40           HB       VAL  40  -4.780  -9.346  -2.795
  292   1HG1  VAL  40          1HG1      VAL  40  -7.030  -8.487  -2.357
  293   2HG1  VAL  40          2HG1      VAL  40  -7.721  -9.921  -3.164
  294   3HG1  VAL  40          3HG1      VAL  40  -6.770 -10.101  -1.666
  295   1HG2  VAL  40          1HG2      VAL  40  -4.449 -11.377  -4.187
  296   2HG2  VAL  40          2HG2      VAL  40  -6.207 -11.536  -4.380
  297   3HG2  VAL  40          3HG2      VAL  40  -5.451 -11.758  -2.788
  298    H    VAL  41           H        VAL  41  -3.557  -7.500  -4.226
  299    HA   VAL  41           HA       VAL  41  -4.575  -5.084  -3.131
  300    HB   VAL  41           HB       VAL  41  -2.055  -5.411  -4.848
  301   1HG1  VAL  41          1HG1      VAL  41  -2.442  -5.719  -1.850
  302   2HG1  VAL  41          2HG1      VAL  41  -1.894  -6.937  -3.023
  303   3HG1  VAL  41          3HG1      VAL  41  -0.865  -5.563  -2.662
  304   1HG2  VAL  41          1HG2      VAL  41  -2.612  -3.083  -4.629
  305   2HG2  VAL  41          2HG2      VAL  41  -2.844  -3.249  -2.869
  306   3HG2  VAL  41          3HG2      VAL  41  -1.234  -3.434  -3.591
  307    H    ASP  42           HN       ASP  42  -3.649  -5.870  -6.490
  308    HA   ASP  42           HA       ASP  42  -4.486  -3.465  -7.714
  309   1HB   ASP  42          1HB       ASP  42  -4.099  -6.317  -8.666
  310   2HB   ASP  42          2HB       ASP  42  -4.704  -5.084  -9.768
  311    H    GLU  43           HN       GLU  43  -6.422  -6.575  -7.479
  312    HA   GLU  43           HA       GLU  43  -8.633  -5.361  -8.789
  313   1HB   GLU  43          1HB       GLU  43  -9.772  -7.263  -8.421
  314   2HB   GLU  43          2HB       GLU  43  -8.115  -7.858  -8.346
  315   1HG   GLU  43          2HG       GLU  43  -8.378  -7.627  -5.753
  316   2HG   GLU  43          1HG       GLU  43 -10.098  -7.396  -6.073
  317    H    ILE  44           H        ILE  44  -7.780  -5.536  -5.311
  318    HA   ILE  44           HA       ILE  44 -10.224  -4.366  -4.350
  319    HB   ILE  44           HB       ILE  44  -7.391  -4.513  -3.261
  320   1HG1  ILE  44          1HG1      ILE  44 -10.103  -5.621  -2.338
  321   2HG1  ILE  44          2HG1      ILE  44  -8.917  -6.523  -3.276
  322   1HG2  ILE  44          1HG2      ILE  44  -9.751  -3.222  -1.846
  323   2HG2  ILE  44          2HG2      ILE  44  -8.129  -3.496  -1.178
  324   3HG2  ILE  44          3HG2      ILE  44  -8.336  -2.341  -2.474
  325   1HD1  ILE  44          1HD1      ILE  44  -8.656  -7.169  -0.967
  326   2HD1  ILE  44          2HD1      ILE  44  -8.633  -5.500  -0.429
  327   3HD1  ILE  44          3HD1      ILE  44  -7.262  -6.149  -1.372
  328    H    ALA  45           H        ALA  45  -7.102  -2.922  -5.436
  329    HA   ALA  45           HA       ALA  45  -7.799  -0.231  -5.082
  330   1HB   ALA  45          1HB       ALA  45  -6.259  -1.310  -7.485
  331   2HB   ALA  45          2HB       ALA  45  -6.161   0.279  -6.736
  332   3HB   ALA  45          3HB       ALA  45  -5.580  -1.168  -5.855
  333    H    GLY  46           H        GLY  46  -8.494  -2.409  -7.883
  334   1HA   GLY  46          2HA       GLY  46  -9.855  -0.571  -9.528
  335   2HA   GLY  46          1HA       GLY  46 -10.182  -2.312  -9.440
  336    H    GLU  47           HN       GLU  47 -11.184  -2.752  -7.005
  337    HA   GLU  47           HA       GLU  47 -13.889  -1.957  -7.261
  338   1HB   GLU  47          2HB       GLU  47 -12.349  -3.216  -4.961
  339   2HB   GLU  47          1HB       GLU  47 -14.109  -3.033  -4.980
  340   1HG   GLU  47          1HG       GLU  47 -14.285  -4.407  -6.996
  341   2HG   GLU  47          2HG       GLU  47 -12.535  -4.572  -7.099
  342    H    TYR  48           H        TYR  48 -11.464  -0.783  -4.915
  343    HA   TYR  48           HA       TYR  48 -13.453   1.185  -3.839
  344   1HB   TYR  48          1HB       TYR  48 -10.759   0.249  -2.765
  345   2HB   TYR  48          2HB       TYR  48 -11.823   1.407  -1.989
  346    HD1  TYR  48           HD1      TYR  48 -13.737   0.757  -0.709
  347    HD2  TYR  48           HD2      TYR  48 -11.553  -2.198  -2.955
  348    HE1  TYR  48           HE1      TYR  48 -15.254  -0.995   0.119
  349    HE2  TYR  48           HE2      TYR  48 -13.114  -3.945  -2.181
  350    HH   TYR  48           HH       TYR  48 -15.787  -3.262   0.080
  351    H    LYS  49           HN       LYS  49 -11.410   1.336  -6.323
  352    HA   LYS  49           HA       LYS  49  -9.559   3.161  -6.287
  353   1HB   LYS  49          1HB       LYS  49 -10.643   2.028  -8.251
  354   2HB   LYS  49          2HB       LYS  49 -11.862   3.301  -8.291
  355   1HG   LYS  49          2HG       LYS  49  -9.912   4.949  -8.568
  356   2HG   LYS  49          1HG       LYS  49  -8.858   3.538  -8.740
  357   1HD   LYS  49          2HD       LYS  49 -11.215   4.323 -10.535
  358   2HD   LYS  49          1HD       LYS  49  -9.496   4.435 -10.914
  359   1HE   LYS  49          2HE       LYS  49 -10.106   2.515 -12.050
  360   2HE   LYS  49          1HE       LYS  49  -9.436   1.841 -10.558
  361   1HZ   LYS  49          1HZ       LYS  49 -12.300   2.303 -11.101
  362   2HZ   LYS  49          2HZ       LYS  49 -11.687   1.519  -9.788
  363   3HZ   LYS  49          3HZ       LYS  49 -11.529   0.859 -11.277
  364    H    ASP  50           HN       ASP  50 -12.922   4.203  -6.686
  365    HA   ASP  50           HA       ASP  50 -12.859   6.888  -6.753
  366   1HB   ASP  50          1HB       ASP  50 -14.728   5.136  -5.086
  367   2HB   ASP  50          2HB       ASP  50 -15.045   6.814  -5.527
  368    H    LYS  51           HN       LYS  51 -12.531   5.013  -3.771
  369    HA   LYS  51           HA       LYS  51 -12.264   7.517  -2.144
  370   1HB   LYS  51          1HB       LYS  51 -12.398   4.820  -0.873
  371   2HB   LYS  51          2HB       LYS  51 -13.086   6.352  -0.356
  372   1HG   LYS  51          1HG       LYS  51 -14.812   6.038  -2.261
  373   2HG   LYS  51          2HG       LYS  51 -14.128   4.407  -2.466
  374   1HD   LYS  51          1HD       LYS  51 -14.594   4.061   0.054
  375   2HD   LYS  51          2HD       LYS  51 -15.555   5.546  -0.050
  376   1HE   LYS  51          2HE       LYS  51 -17.161   3.842  -0.429
  377   2HE   LYS  51          1HE       LYS  51 -16.754   4.360  -2.070
  378   1HZ   LYS  51          1HZ       LYS  51 -15.758   2.015  -0.598
  379   2HZ   LYS  51          2HZ       LYS  51 -15.167   2.475  -2.074
  380   3HZ   LYS  51          3HZ       LYS  51 -16.743   2.011  -1.914
  381    H    LEU  52           H        LEU  52 -10.312   5.104  -3.644
  382    HA   LEU  52           HA       LEU  52  -8.130   5.532  -1.676
  383   1HB   LEU  52          1HB       LEU  52  -9.809   3.628  -1.066
  384   2HB   LEU  52          2HB       LEU  52  -9.173   2.783  -2.463
  385    HG   LEU  52           HG       LEU  52  -6.858   2.951  -1.357
  386   1HD1  LEU  52          1HD1      LEU  52  -8.647   3.962   0.903
  387   2HD1  LEU  52          2HD1      LEU  52  -7.244   4.795   0.205
  388   3HD1  LEU  52          3HD1      LEU  52  -7.015   3.335   1.172
  389   1HD2  LEU  52          1HD2      LEU  52  -9.172   1.536   0.046
  390   2HD2  LEU  52          2HD2      LEU  52  -8.219   0.904  -1.313
  391   3HD2  LEU  52          3HD2      LEU  52  -7.467   1.122   0.275
  392    H    LYS  53           HN       LYS  53  -6.369   6.053  -2.922
  393    HA   LYS  53           HA       LYS  53  -6.069   4.872  -5.609
  394   1HB   LYS  53          2HB       LYS  53  -4.959   7.130  -4.104
  395   2HB   LYS  53          1HB       LYS  53  -3.649   6.124  -4.718
  396   1HG   LYS  53          1HG       LYS  53  -5.886   7.150  -6.490
  397   2HG   LYS  53          2HG       LYS  53  -4.321   7.950  -6.261
  398   1HD   LYS  53          2HD       LYS  53  -3.144   5.870  -7.023
  399   2HD   LYS  53          1HD       LYS  53  -4.715   5.125  -7.377
  400   1HE   LYS  53          2HE       LYS  53  -5.222   6.948  -8.986
  401   2HE   LYS  53          1HE       LYS  53  -3.640   7.680  -8.650
  402   1HZ   LYS  53          1HZ       LYS  53  -3.598   6.335 -10.609
  403   2HZ   LYS  53          2HZ       LYS  53  -2.614   5.682  -9.461
  404   3HZ   LYS  53          3HZ       LYS  53  -4.082   5.001  -9.772
  405    H    CYS  54           H        CYS  54  -3.978   3.504  -5.975
  406    HA   CYS  54           HA       CYS  54  -3.081   2.204  -3.494
  407   1HB   CYS  54          1HB       CYS  54  -5.112   0.920  -4.359
  408   2HB   CYS  54          2HB       CYS  54  -4.132   0.594  -5.824
  409    HG   CYS  54           HG       CYS  54  -3.440  -0.021  -2.656
  410    H    VAL  55           H        VAL  55  -1.080   1.167  -3.653
  411    HA   VAL  55           HA       VAL  55   0.383   1.400  -6.114
  412    HB   VAL  55           HB       VAL  55   1.697   3.058  -4.009
  413   1HG1  VAL  55          1HG1      VAL  55  -0.570   4.396  -5.545
  414   2HG1  VAL  55          2HG1      VAL  55   0.581   5.136  -4.437
  415   3HG1  VAL  55          3HG1      VAL  55  -0.628   4.028  -3.807
  416   1HG2  VAL  55          1HG2      VAL  55   1.163   3.488  -6.981
  417   2HG2  VAL  55          2HG2      VAL  55   2.594   2.675  -6.314
  418   3HG2  VAL  55          3HG2      VAL  55   2.291   4.390  -5.959
  419    H    LYS  56           HN       LYS  56   2.570   0.568  -5.883
  420    HA   LYS  56           HA       LYS  56   2.960  -1.076  -3.418
  421   1HB   LYS  56          2HB       LYS  56   3.385  -1.730  -6.360
  422   2HB   LYS  56          1HB       LYS  56   3.732  -2.810  -4.998
  423   1HG   LYS  56          2HG       LYS  56   1.340  -2.575  -4.252
  424   2HG   LYS  56          1HG       LYS  56   0.984  -1.739  -5.769
  425   1HD   LYS  56          1HD       LYS  56   2.208  -4.515  -5.617
  426   2HD   LYS  56          2HD       LYS  56   0.464  -4.191  -5.693
  427   1HE   LYS  56          2HE       LYS  56   0.848  -2.874  -7.830
  428   2HE   LYS  56          1HE       LYS  56   2.535  -3.413  -7.796
  429   1HZ   LYS  56          1HZ       LYS  56   1.686  -5.686  -7.838
  430   2HZ   LYS  56          2HZ       LYS  56   1.255  -4.826  -9.174
  431   3HZ   LYS  56          3HZ       LYS  56   0.142  -5.117  -7.999
  432    H    LEU  57           H        LEU  57   4.706  -0.506  -2.333
  433    HA   LEU  57           HA       LEU  57   6.850   1.087  -3.671
  434   1HB   LEU  57          1HB       LEU  57   5.908   2.051  -1.699
  435   2HB   LEU  57          2HB       LEU  57   6.288   0.603  -0.730
  436    HG   LEU  57           HG       LEU  57   7.630   2.581  -0.292
  437   1HD1  LEU  57          1HD1      LEU  57   8.958   2.080  -2.964
  438   2HD1  LEU  57          2HD1      LEU  57   7.775   3.377  -2.685
  439   3HD1  LEU  57          3HD1      LEU  57   9.302   3.380  -1.797
  440   1HD2  LEU  57          1HD2      LEU  57   8.424   0.174   0.091
  441   2HD2  LEU  57          2HD2      LEU  57   9.436   0.402  -1.328
  442   3HD2  LEU  57          3HD2      LEU  57   9.652   1.454   0.076
  443    H    ASN  58           H        ASN  58   8.565   0.046  -4.457
  444    HA   ASN  58           HA       ASN  58   9.063  -2.737  -3.683
  445   1HB   ASN  58          1HB       ASN  58   9.497  -1.945  -5.977
  446   2HB   ASN  58          2HB       ASN  58  10.796  -0.909  -5.372
  447   1HD2  ASN  58          2HD2      ASN  58  10.160  -3.946  -6.664
  448   2HD2  ASN  58          1HD2      ASN  58  11.633  -4.745  -6.137
  449    H    THR  59           H        THR  59   9.678  -2.990  -1.705
  450    HA   THR  59           HA       THR  59  10.964  -1.177   0.049
  451    HB   THR  59           HB       THR  59  10.792  -4.229   0.092
  452    HG1  THR  59           HG1      THR  59   8.786  -3.425  -0.045
  453   1HG2  THR  59          1HG2      THR  59  12.393  -3.524   1.735
  454   2HG2  THR  59          2HG2      THR  59  11.314  -2.225   2.302
  455   3HG2  THR  59          3HG2      THR  59  10.882  -3.942   2.553
  456    H    ASP  60           HN       ASP  60  12.263  -3.654  -2.089
  457    HA   ASP  60           HA       ASP  60  14.840  -3.917  -0.766
  458   1HB   ASP  60          2HB       ASP  60  13.563  -5.686  -1.869
  459   2HB   ASP  60          1HB       ASP  60  13.634  -4.830  -3.389
  460    H    GLU  61           HN       GLU  61  13.499  -2.243  -3.560
  461    HA   GLU  61           HA       GLU  61  16.014  -0.965  -4.343
  462   1HB   GLU  61          2HB       GLU  61  14.304  -1.750  -5.970
  463   2HB   GLU  61          1HB       GLU  61  13.124  -0.644  -5.253
  464   1HG   GLU  61          1HG       GLU  61  14.014   0.258  -7.332
  465   2HG   GLU  61          2HG       GLU  61  14.447   1.306  -5.984
  466    H    SER  62           H        SER  62  13.185  -0.195  -2.382
  467    HA   SER  62           HA       SER  62  14.105   2.600  -1.937
  468   1HB   SER  62          2HB       SER  62  11.998   2.209  -3.337
  469   2HB   SER  62          1HB       SER  62  11.198   1.663  -1.856
  470    HG   SER  62           HG       SER  62  11.694   3.638  -0.923
  471    HA   PRO  63           HA       PRO  63  13.875  -0.115   2.008
  472   1HB   PRO  63          2HB       PRO  63  16.465   0.326   2.839
  473   2HB   PRO  63          1HB       PRO  63  15.973  -0.954   1.703
  474   1HG   PRO  63          2HG       PRO  63  17.194   1.680   0.942
  475   2HG   PRO  63          1HG       PRO  63  17.643   0.042   0.402
  476   1HD   PRO  63          1HD       PRO  63  15.954   1.592  -1.061
  477   2HD   PRO  63          2HD       PRO  63  15.714  -0.180  -0.934
  478    H    ASN  64           H        ASN  64  15.522   2.729   1.136
  479    HA   ASN  64           HA       ASN  64  15.807   4.505   3.134
  480   1HB   ASN  64          2HB       ASN  64  14.331   5.024   0.512
  481   2HB   ASN  64          1HB       ASN  64  14.735   6.298   1.670
  482   1HD2  ASN  64          2HD2      ASN  64  15.820   7.099  -0.321
  483   2HD2  ASN  64          1HD2      ASN  64  17.493   6.586  -0.605
  484    H    VAL  65           H        VAL  65  12.658   4.700   1.544
  485    HA   VAL  65           HA       VAL  65  11.279   6.073   3.547
  486    HB   VAL  65           HB       VAL  65  10.361   4.160   1.347
  487   1HG1  VAL  65          1HG2      VAL  65   8.569   4.366   2.984
  488   2HG1  VAL  65          2HG2      VAL  65   8.723   6.136   2.973
  489   3HG1  VAL  65          3HG2      VAL  65   8.172   5.261   1.518
  490   1HG2  VAL  65          1HG1      VAL  65   9.852   6.273   0.147
  491   2HG2  VAL  65          2HG1      VAL  65  11.580   6.155   0.525
  492   3HG2  VAL  65          3HG1      VAL  65  10.531   7.205   1.498
  493    H    ALA  66           H        ALA  66  11.471   2.614   2.892
  494    HA   ALA  66           HA       ALA  66   9.675   1.772   4.983
  495   1HB   ALA  66          1HB       ALA  66  11.970   0.144   3.854
  496   2HB   ALA  66          2HB       ALA  66  10.478  -0.435   4.616
  497   3HB   ALA  66          3HB       ALA  66  10.407   0.373   3.035
  498    H    SER  67           H        SER  67  13.096   2.666   5.047
  499    HA   SER  67           HA       SER  67  13.601   1.536   7.694
  500   1HB   SER  67          2HB       SER  67  15.258   3.522   6.075
  501   2HB   SER  67          1HB       SER  67  15.784   2.559   7.464
  502    HG   SER  67           HG       SER  67  14.806   1.491   5.012
  503    H    GLU  68           HN       GLU  68  12.959   4.712   6.239
  504    HA   GLU  68           HA       GLU  68  13.076   6.315   8.602
  505   1HB   GLU  68          2HB       GLU  68  11.361   6.553   6.088
  506   2HB   GLU  68          1HB       GLU  68  11.466   7.795   7.331
  507   1HG   GLU  68          1HG       GLU  68  13.781   8.209   6.893
  508   2HG   GLU  68          2HG       GLU  68  13.963   6.740   5.933
  509    H    TYR  69           H        TYR  69  10.443   4.428   7.116
  510    HA   TYR  69           HA       TYR  69   8.574   4.919   9.295
  511   1HB   TYR  69          1HB       TYR  69   8.665   3.218   6.793
  512   2HB   TYR  69          2HB       TYR  69   7.487   2.837   8.013
  513    HD1  TYR  69           HD1      TYR  69   6.121   4.935   8.997
  514    HD2  TYR  69           HD2      TYR  69   7.953   4.730   5.109
  515    HE1  TYR  69           HE1      TYR  69   4.808   6.906   8.278
  516    HE2  TYR  69           HE2      TYR  69   6.608   6.689   4.373
  517    HH   TYR  69           HH       TYR  69   4.503   8.474   6.631
  518    H    GLY  70           H        GLY  70  10.944   2.384   8.557
  519   1HA   GLY  70          2HA       GLY  70  12.007   0.996  10.055
  520   2HA   GLY  70          1HA       GLY  70  10.941   1.545  11.357
  521    H    ILE  71           H        ILE  71  10.272   0.073   8.139
  522    HA   ILE  71           HA       ILE  71   8.973  -2.295   9.397
  523    HB   ILE  71           HB       ILE  71   7.366  -2.014   7.472
  524   1HG1  ILE  71          1HG1      ILE  71   8.163   0.897   7.506
  525   2HG1  ILE  71          2HG1      ILE  71   8.852  -0.190   6.324
  526   1HG2  ILE  71          1HG2      ILE  71   5.944  -0.414   8.785
  527   2HG2  ILE  71          2HG2      ILE  71   6.791  -1.540   9.849
  528   3HG2  ILE  71          3HG2      ILE  71   7.372   0.126   9.668
  529   1HD1  ILE  71          1HD1      ILE  71   6.690  -0.754   5.408
  530   2HD1  ILE  71          2HD1      ILE  71   6.922   1.007   5.418
  531   3HD1  ILE  71          3HD1      ILE  71   5.871   0.250   6.617
  532    H    ARG  72           HN       ARG  72  11.157  -3.277   8.941
  533    HA   ARG  72           HA       ARG  72  11.887  -3.544   6.137
  534   1HB   ARG  72          1HB       ARG  72  13.666  -4.850   6.846
  535   2HB   ARG  72          2HB       ARG  72  13.515  -3.568   8.036
  536   1HG   ARG  72          2HG       ARG  72  12.684  -6.500   8.362
  537   2HG   ARG  72          1HG       ARG  72  14.124  -5.731   9.011
  538   1HD   ARG  72          1HD       ARG  72  11.267  -5.245   9.874
  539   2HD   ARG  72          2HD       ARG  72  12.562  -5.983  10.797
  540    HE   ARG  72           HE       ARG  72  13.757  -3.711  10.500
  541   1HH1  ARG  72          2HH1      ARG  72  10.284  -4.150  11.227
  542   2HH1  ARG  72          1HH1      ARG  72  10.075  -2.458  11.630
  543   1HH2  ARG  72          2HH2      ARG  72  13.474  -1.627  11.402
  544   2HH2  ARG  72          1HH2      ARG  72  11.887  -1.130  11.949
  545    H    SER  73           H        SER  73   9.908  -5.421   8.430
  546    HA   SER  73           HA       SER  73   9.794  -7.818   6.863
  547   1HB   SER  73          2HB       SER  73   7.566  -6.920   8.661
  548   2HB   SER  73          1HB       SER  73   8.275  -8.527   8.500
  549    HG   SER  73           HG       SER  73  10.135  -7.739   9.596
  550    H    ILE  74           H        ILE  74   8.067  -8.439   5.444
  551    HA   ILE  74           HA       ILE  74   6.099  -6.456   4.664
  552    HB   ILE  74           HB       ILE  74   6.843  -6.731   2.200
  553   1HG1  ILE  74          1HG1      ILE  74   9.548  -7.364   3.394
  554   2HG1  ILE  74          2HG1      ILE  74   8.483  -8.556   2.623
  555   1HG2  ILE  74          1HG2      ILE  74   8.759  -5.122   3.932
  556   2HG2  ILE  74          2HG2      ILE  74   8.162  -4.752   2.310
  557   3HG2  ILE  74          3HG2      ILE  74   7.066  -4.646   3.679
  558   1HD1  ILE  74          1HD1      ILE  74   9.672  -6.071   1.319
  559   2HD1  ILE  74          2HD1      ILE  74   9.993  -7.759   0.930
  560   3HD1  ILE  74          3HD1      ILE  74   8.410  -7.083   0.574
  561    HA   PRO  75           HA       PRO  75   4.667  -6.568   2.466
  562   1HB   PRO  75          1HB       PRO  75   1.949  -6.929   2.527
  563   2HB   PRO  75          2HB       PRO  75   3.039  -7.547   1.277
  564   1HG   PRO  75          1HG       PRO  75   1.935  -8.956   3.721
  565   2HG   PRO  75          2HG       PRO  75   2.028  -9.613   2.060
  566   1HD   PRO  75          1HD       PRO  75   3.868 -10.247   4.002
  567   2HD   PRO  75          2HD       PRO  75   4.343 -10.049   2.293
  568    H    THR  76           H        THR  76   4.069  -4.731   3.262
  569    HA   THR  76           HA       THR  76   2.752  -4.501   5.905
  570    HB   THR  76           HB       THR  76   5.361  -3.121   5.172
  571    HG1  THR  76           HG1      THR  76   6.022  -4.677   6.436
  572   1HG2  THR  76          1HG2      THR  76   3.934  -1.391   6.084
  573   2HG2  THR  76          2HG2      THR  76   4.968  -1.965   7.402
  574   3HG2  THR  76          3HG2      THR  76   3.281  -2.492   7.315
  575    H    ILE  77           H        ILE  77   0.927  -3.590   5.340
  576    HA   ILE  77           HA       ILE  77   0.730  -1.898   2.924
  577    HB   ILE  77           HB       ILE  77  -1.339  -3.232   4.708
  578   1HG1  ILE  77          1HG1      ILE  77  -0.548  -3.742   1.799
  579   2HG1  ILE  77          2HG1      ILE  77  -0.035  -4.729   3.171
  580   1HG2  ILE  77          1HG2      ILE  77  -2.208  -1.066   3.844
  581   2HG2  ILE  77          2HG2      ILE  77  -1.743  -1.549   2.199
  582   3HG2  ILE  77          3HG2      ILE  77  -3.021  -2.418   3.079
  583   1HD1  ILE  77          1HD1      ILE  77  -1.843  -5.864   2.131
  584   2HD1  ILE  77          2HD1      ILE  77  -2.879  -4.433   2.151
  585   3HD1  ILE  77          3HD1      ILE  77  -2.436  -5.234   3.680
  586    H    MET  78           H        MET  78   0.240   0.311   3.142
  587    HA   MET  78           HA       MET  78  -0.232   1.382   5.887
  588   1HB   MET  78          1HB       MET  78   1.809   2.412   3.888
  589   2HB   MET  78          2HB       MET  78   1.232   3.305   5.309
  590   1HG   MET  78          2HG       MET  78   1.963   1.350   6.720
  591   2HG   MET  78          1HG       MET  78   2.754   0.692   5.294
  592   1HE   MET  78          1HE       MET  78   3.499   2.491   8.528
  593   2HE   MET  78          2HE       MET  78   5.223   2.319   8.155
  594   3HE   MET  78          3HE       MET  78   4.114   0.949   7.903
  595    H    VAL  79           H        VAL  79  -1.712   2.959   5.960
  596    HA   VAL  79           HA       VAL  79  -3.021   3.690   3.371
  597    HB   VAL  79           HB       VAL  79  -4.131   3.702   6.193
  598   1HG1  VAL  79          1HG1      VAL  79  -5.752   2.072   5.263
  599   2HG1  VAL  79          2HG1      VAL  79  -4.094   1.465   5.111
  600   3HG1  VAL  79          3HG1      VAL  79  -4.925   2.140   3.693
  601   1HG2  VAL  79          1HG2      VAL  79  -6.258   4.473   5.085
  602   2HG2  VAL  79          2HG2      VAL  79  -5.334   4.749   3.593
  603   3HG2  VAL  79          3HG2      VAL  79  -4.991   5.687   5.052
  604    H    PHE  80           H        PHE  80  -3.237   5.830   2.879
  605    HA   PHE  80           HA       PHE  80  -2.249   7.871   4.789
  606   1HB   PHE  80          2HB       PHE  80  -1.686   7.795   1.811
  607   2HB   PHE  80          1HB       PHE  80  -1.370   9.115   2.895
  608    HD1  PHE  80           HD1      PHE  80  -0.429   5.482   2.416
  609    HD2  PHE  80           HD2      PHE  80   0.755   9.380   3.829
  610    HE1  PHE  80           HE1      PHE  80   1.774   4.580   3.097
  611    HE2  PHE  80           HE2      PHE  80   2.936   8.463   4.529
  612    HZ   PHE  80           HZ       PHE  80   3.432   6.036   4.229
  613    H    LYS  81           HN       LYS  81  -3.110   9.858   4.403
  614    HA   LYS  81           HA       LYS  81  -5.617  10.130   2.827
  615   1HB   LYS  81          1HB       LYS  81  -6.962  10.739   4.654
  616   2HB   LYS  81          2HB       LYS  81  -6.207   9.205   5.058
  617   1HG   LYS  81          2HG       LYS  81  -5.814  11.920   6.287
  618   2HG   LYS  81          1HG       LYS  81  -6.208  10.381   7.046
  619   1HD   LYS  81          1HD       LYS  81  -3.807   9.630   6.461
  620   2HD   LYS  81          2HD       LYS  81  -3.494  11.316   6.027
  621   1HE   LYS  81          1HE       LYS  81  -4.416  10.290   8.754
  622   2HE   LYS  81          2HE       LYS  81  -2.790  10.844   8.335
  623   1HZ   LYS  81          1HZ       LYS  81  -5.211  12.496   8.313
  624   2HZ   LYS  81          2HZ       LYS  81  -4.001  12.545   9.429
  625   3HZ   LYS  81          3HZ       LYS  81  -3.707  13.005   7.873
  626    H    GLY  82           H        GLY  82  -3.449  11.104   1.918
  627   1HA   GLY  82          2HA       GLY  82  -3.021  13.319   1.027
  628   2HA   GLY  82          1HA       GLY  82  -3.343  13.994   2.645
  629    H    GLY  83           H        GLY  83  -1.162  14.893   2.682
  630   1HA   GLY  83          2HA       GLY  83   1.166  13.223   2.418
  631   2HA   GLY  83          1HA       GLY  83   1.097  14.881   3.012
  632    H    LYS  84           HN       LYS  84  -0.542  12.048   4.412
  633    HA   LYS  84           HA       LYS  84   1.347  11.740   6.578
  634   1HB   LYS  84          2HB       LYS  84  -1.488  12.651   7.187
  635   2HB   LYS  84          1HB       LYS  84  -0.360  12.041   8.384
  636   1HG   LYS  84          2HG       LYS  84   0.058  14.618   6.815
  637   2HG   LYS  84          1HG       LYS  84  -0.594  14.494   8.447
  638   1HD   LYS  84          1HD       LYS  84   1.496  13.438   9.254
  639   2HD   LYS  84          2HD       LYS  84   2.195  13.552   7.629
  640   1HE   LYS  84          1HE       LYS  84   1.958  16.015   7.676
  641   2HE   LYS  84          2HE       LYS  84   1.286  15.923   9.318
  642   1HZ   LYS  84          1HZ       LYS  84   3.966  15.042   8.503
  643   2HZ   LYS  84          2HZ       LYS  84   3.609  16.420   9.333
  644   3HZ   LYS  84          3HZ       LYS  84   3.350  14.950  10.030
  645    H    LYS  85           HN       LYS  85   0.766   9.942   7.868
  646    HA   LYS  85           HA       LYS  85  -0.522   7.799   6.284
  647   1HB   LYS  85          2HB       LYS  85   1.871   7.652   7.249
  648   2HB   LYS  85          1HB       LYS  85   1.092   7.522   8.833
  649   1HG   LYS  85          1HG       LYS  85  -0.263   5.533   7.713
  650   2HG   LYS  85          2HG       LYS  85   0.923   5.676   6.419
  651   1HD   LYS  85          1HD       LYS  85   1.750   3.995   7.820
  652   2HD   LYS  85          2HD       LYS  85   2.719   5.399   8.275
  653   1HE   LYS  85          1HE       LYS  85   1.210   5.760  10.264
  654   2HE   LYS  85          2HE       LYS  85   0.210   4.402   9.745
  655   1HZ   LYS  85          1HZ       LYS  85   3.040   4.218  10.493
  656   2HZ   LYS  85          2HZ       LYS  85   1.760   3.830  11.461
  657   3HZ   LYS  85          3HZ       LYS  85   2.032   2.971  10.080
  658    H    CYS  86           H        CYS  86  -2.206   6.579   7.204
  659    HA   CYS  86           HA       CYS  86  -3.581   7.749   9.603
  660   1HB   CYS  86          1HB       CYS  86  -4.753   7.874   7.356
  661   2HB   CYS  86          2HB       CYS  86  -4.831   6.129   7.343
  662    HG   CYS  86           HG       CYS  86  -5.777   6.249  10.031
  663    H    GLU  87           HN       GLU  87  -3.137   4.691   7.802
  664    HA   GLU  87           HA       GLU  87  -3.164   3.155  10.376
  665   1HB   GLU  87          1HB       GLU  87  -4.665   2.311   7.862
  666   2HB   GLU  87          2HB       GLU  87  -4.664   1.506   9.423
  667   1HG   GLU  87          1HG       GLU  87  -5.830   4.279   8.867
  668   2HG   GLU  87          2HG       GLU  87  -6.744   2.807   8.992
  669    H    THR  88           H        THR  88  -2.487   0.791   9.954
  670    HA   THR  88           HA       THR  88  -0.753   0.302   7.701
  671    HB   THR  88           HB       THR  88   0.325   0.786  10.515
  672    HG1  THR  88           HG1      THR  88   0.197   2.292   8.458
  673   1HG2  THR  88          1HG2      THR  88   1.370  -1.328   9.758
  674   2HG2  THR  88          2HG2      THR  88   2.535  -0.006   9.646
  675   3HG2  THR  88          3HG2      THR  88   1.734  -0.602   8.177
  676    H    ILE  89           H        ILE  89  -0.443  -1.942   7.430
  677    HA   ILE  89           HA       ILE  89  -1.375  -3.806   9.533
  678    HB   ILE  89           HB       ILE  89  -2.379  -3.718   6.645
  679   1HG1  ILE  89          1HG1      ILE  89  -3.636  -2.223   8.167
  680   2HG1  ILE  89          2HG1      ILE  89  -4.567  -3.558   7.511
  681   1HG2  ILE  89          1HG2      ILE  89  -3.709  -5.772   7.303
  682   2HG2  ILE  89          2HG2      ILE  89  -2.675  -5.911   8.740
  683   3HG2  ILE  89          3HG2      ILE  89  -1.980  -6.040   7.111
  684   1HD1  ILE  89          1HD1      ILE  89  -4.474  -4.765   9.649
  685   2HD1  ILE  89          2HD1      ILE  89  -3.432  -3.505  10.346
  686   3HD1  ILE  89          3HD1      ILE  89  -5.094  -3.129   9.888
  687    H    ILE  90           H        ILE  90  -0.443  -5.960   9.148
  688    HA   ILE  90           HA       ILE  90   1.849  -6.007   7.269
  689    HB   ILE  90           HB       ILE  90   2.020  -6.717  10.233
  690   1HG1  ILE  90          2HG1      ILE  90   3.184  -4.371   8.669
  691   2HG1  ILE  90          1HG1      ILE  90   1.967  -4.283   9.952
  692   1HG2  ILE  90          1HG2      ILE  90   4.160  -6.696   8.048
  693   2HG2  ILE  90          2HG2      ILE  90   4.421  -7.099   9.759
  694   3HG2  ILE  90          3HG2      ILE  90   3.443  -8.154   8.766
  695   1HD1  ILE  90          1HD1      ILE  90   3.666  -5.227  11.553
  696   2HD1  ILE  90          2HD1      ILE  90   4.893  -4.989  10.279
  697   3HD1  ILE  90          3HD1      ILE  90   4.006  -3.604  10.920
  698    H    GLY  91           H        GLY  91   2.242  -8.020   6.441
  699   1HA   GLY  91          2HA       GLY  91   2.196 -10.359   6.402
  700   2HA   GLY  91          1HA       GLY  91   0.878 -10.408   7.577
  701    H    ALA  92           H        ALA  92   1.159 -11.772   4.971
  702    HA   ALA  92           HA       ALA  92  -0.641 -10.563   3.064
  703   1HB   ALA  92          1HB       ALA  92  -0.476 -12.869   2.030
  704   2HB   ALA  92          2HB       ALA  92   1.079 -12.084   2.355
  705   3HB   ALA  92          3HB       ALA  92   0.481 -13.375   3.428
  706    H    VAL  93           H        VAL  93  -2.333 -10.072   4.808
  707    HA   VAL  93           HA       VAL  93  -3.916 -12.324   5.718
  708    HB   VAL  93           HB       VAL  93  -5.441 -10.718   6.631
  709   1HG1  VAL  93          1HG2      VAL  93  -5.077  -8.249   6.334
  710   2HG1  VAL  93          2HG2      VAL  93  -5.691  -9.082   4.910
  711   3HG1  VAL  93          3HG2      VAL  93  -3.979  -8.611   4.985
  712   1HG2  VAL  93          1HG1      VAL  93  -3.978  -9.537   8.136
  713   2HG2  VAL  93          2HG1      VAL  93  -3.270 -11.124   7.789
  714   3HG2  VAL  93          3HG1      VAL  93  -2.612  -9.664   7.020
  715    HA   PRO  94           HA       PRO  94  -6.352 -12.991   2.076
  716   1HB   PRO  94          2HB       PRO  94  -8.714 -13.165   3.968
  717   2HB   PRO  94          1HB       PRO  94  -8.312 -14.250   2.610
  718   1HG   PRO  94          1HG       PRO  94  -7.702 -14.987   5.148
  719   2HG   PRO  94          2HG       PRO  94  -6.486 -15.209   3.853
  720   1HD   PRO  94          1HD       PRO  94  -6.613 -13.017   5.930
  721   2HD   PRO  94          2HD       PRO  94  -5.223 -13.948   5.309
  722    H    LYS  95           HN       LYS  95  -7.943 -12.131   0.695
  723    HA   LYS  95           HA       LYS  95  -8.291  -9.453   0.455
  724   1HB   LYS  95          1HB       LYS  95  -8.866 -11.323  -1.211
  725   2HB   LYS  95          2HB       LYS  95 -10.380 -11.559  -0.354
  726   1HG   LYS  95          1HG       LYS  95 -10.938  -9.117  -0.789
  727   2HG   LYS  95          2HG       LYS  95  -9.487  -9.038  -1.802
  728   1HD   LYS  95          2HD       LYS  95 -10.437 -10.932  -3.184
  729   2HD   LYS  95          1HD       LYS  95 -11.936 -10.798  -2.247
  730   1HE   LYS  95          1HE       LYS  95 -10.646  -8.614  -3.957
  731   2HE   LYS  95          2HE       LYS  95 -12.096  -9.548  -4.370
  732   1HZ   LYS  95          1HZ       LYS  95 -12.615  -7.395  -3.534
  733   2HZ   LYS  95          2HZ       LYS  95 -13.197  -8.554  -2.510
  734   3HZ   LYS  95          3HZ       LYS  95 -11.843  -7.696  -2.114
  735    H    ALA  96           H        ALA  96 -10.635 -11.717   1.870
  736    HA   ALA  96           HA       ALA  96 -12.718  -9.989   2.545
  737   1HB   ALA  96          1HB       ALA  96 -11.664 -12.349   4.176
  738   2HB   ALA  96          2HB       ALA  96 -13.272 -11.610   4.334
  739   3HB   ALA  96          3HB       ALA  96 -12.821 -12.437   2.830
  740    H    THR  97           H        THR  97  -9.798 -10.736   4.560
  741    HA   THR  97           HA       THR  97 -10.511  -8.997   6.692
  742    HB   THR  97           HB       THR  97  -7.644  -9.261   6.453
  743    HG1  THR  97           HG1      THR  97  -7.898 -10.926   5.034
  744   1HG2  THR  97          1HG2      THR  97  -9.665 -10.811   8.125
  745   2HG2  THR  97          2HG2      THR  97  -8.933  -9.247   8.564
  746   3HG2  THR  97          3HG2      THR  97  -7.919 -10.698   8.425
  747    H    ILE  98           H        ILE  98  -8.392  -8.557   3.786
  748    HA   ILE  98           HA       ILE  98  -7.542  -5.925   4.415
  749    HB   ILE  98           HB       ILE  98  -8.040  -7.147   1.652
  750   1HG1  ILE  98          2HG1      ILE  98  -5.519  -6.989   3.362
  751   2HG1  ILE  98          1HG1      ILE  98  -6.447  -8.439   2.954
  752   1HG2  ILE  98          1HG2      ILE  98  -6.347  -4.736   2.518
  753   2HG2  ILE  98          2HG2      ILE  98  -6.495  -5.349   0.863
  754   3HG2  ILE  98          3HG2      ILE  98  -7.880  -4.610   1.641
  755   1HD1  ILE  98          1HD1      ILE  98  -4.562  -8.446   1.542
  756   2HD1  ILE  98          2HD1      ILE  98  -5.961  -8.044   0.529
  757   3HD1  ILE  98          3HD1      ILE  98  -4.812  -6.776   1.030
  758    H    VAL  99           H        VAL  99 -10.348  -6.951   2.425
  759    HA   VAL  99           HA       VAL  99 -11.422  -4.428   1.841
  760    HB   VAL  99           HB       VAL  99 -12.672  -7.186   2.195
  761   1HG1  VAL  99          1HG1      VAL  99 -14.645  -6.189   0.924
  762   2HG1  VAL  99          2HG1      VAL  99 -13.992  -4.590   1.345
  763   3HG1  VAL  99          3HG1      VAL  99 -14.524  -5.708   2.618
  764   1HG2  VAL  99          1HG2      VAL  99 -11.098  -6.794   0.266
  765   2HG2  VAL  99          2HG2      VAL  99 -12.137  -5.461  -0.268
  766   3HG2  VAL  99          3HG2      VAL  99 -12.763  -7.123  -0.244
  767    H    GLN 100           H        GLN 100 -12.366  -6.611   4.582
  768    HA   GLN 100           HA       GLN 100 -14.177  -4.786   5.778
  769   1HB   GLN 100          1HB       GLN 100 -12.407  -6.978   6.923
  770   2HB   GLN 100          2HB       GLN 100 -13.563  -6.076   7.916
  771   1HG   GLN 100          1HG       GLN 100 -15.437  -6.780   6.618
  772   2HG   GLN 100          2HG       GLN 100 -14.421  -7.494   5.361
  773   1HE2  GLN 100          1HE2      GLN 100 -12.904  -9.225   6.091
  774   2HE2  GLN 100          2HE2      GLN 100 -13.506 -10.391   7.283
  775    H    THR 101           H        THR 101 -10.672  -5.212   6.310
  776    HA   THR 101           HA       THR 101 -10.342  -3.286   8.354
  777    HB   THR 101           HB       THR 101  -8.353  -4.208   6.247
  778    HG1  THR 101           HG1      THR 101  -9.158  -5.898   7.466
  779   1HG2  THR 101          1HG2      THR 101  -6.725  -3.661   8.084
  780   2HG2  THR 101          2HG2      THR 101  -8.021  -2.801   8.930
  781   3HG2  THR 101          3HG2      THR 101  -7.469  -2.243   7.328
  782    H    VAL 102           H        VAL 102 -10.191  -2.872   4.749
  783    HA   VAL 102           HA       VAL 102  -9.578  -0.066   4.854
  784    HB   VAL 102           HB       VAL 102 -10.905  -1.854   2.774
  785   1HG1  VAL 102          1HG1      VAL 102  -8.778  -1.565   1.596
  786   2HG1  VAL 102          2HG1      VAL 102  -8.449  -2.157   3.233
  787   3HG1  VAL 102          3HG1      VAL 102  -8.209  -0.444   2.851
  788   1HG2  VAL 102          1HG2      VAL 102 -11.814   0.391   2.363
  789   2HG2  VAL 102          2HG2      VAL 102 -10.184   1.093   2.484
  790   3HG2  VAL 102          3HG2      VAL 102 -10.602  -0.011   1.153
  791    H    GLU 103           HN       GLU 103 -12.667  -1.775   4.409
  792    HA   GLU 103           HA       GLU 103 -14.341   0.436   4.266
  793   1HB   GLU 103          2HB       GLU 103 -14.786  -2.400   5.279
  794   2HB   GLU 103          1HB       GLU 103 -16.106  -1.237   5.074
  795   1HG   GLU 103          1HG       GLU 103 -15.605  -0.929   2.731
  796   2HG   GLU 103          2HG       GLU 103 -14.197  -1.985   2.808
  797    H    LYS 104           HN       LYS 104 -13.401  -1.299   7.248
  798    HA   LYS 104           HA       LYS 104 -15.072   0.270   8.958
  799   1HB   LYS 104          1HB       LYS 104 -13.618  -0.359  10.808
  800   2HB   LYS 104          2HB       LYS 104 -14.022  -1.757   9.805
  801   1HG   LYS 104          2HG       LYS 104 -11.869  -1.912   8.947
  802   2HG   LYS 104          1HG       LYS 104 -11.432  -0.255   9.310
  803   1HD   LYS 104          1HD       LYS 104 -10.212  -1.652  10.771
  804   2HD   LYS 104          2HD       LYS 104 -11.355  -0.660  11.677
  805   1HE   LYS 104          1HE       LYS 104 -11.310  -2.982  12.549
  806   2HE   LYS 104          2HE       LYS 104 -12.906  -2.600  11.889
  807   1HZ   LYS 104          1HZ       LYS 104 -12.137  -4.751  11.208
  808   2HZ   LYS 104          2HZ       LYS 104 -12.294  -3.766   9.897
  809   3HZ   LYS 104          3HZ       LYS 104 -10.796  -4.105  10.499
  810    H    TYR 105           H        TYR 105 -11.965   1.119   7.448
  811    HA   TYR 105           HA       TYR 105 -11.537   3.403   9.262
  812   1HB   TYR 105          1HB       TYR 105 -10.172   2.886   6.600
  813   2HB   TYR 105          2HB       TYR 105  -9.624   3.852   7.970
  814    HD1  TYR 105           HD1      TYR 105  -8.290   1.560   6.277
  815    HD2  TYR 105           HD2      TYR 105  -9.985   1.918  10.217
  816    HE1  TYR 105           HE1      TYR 105  -6.536   0.041   7.171
  817    HE2  TYR 105           HE2      TYR 105  -8.259   0.373  11.107
  818    HH   TYR 105           HH       TYR 105  -6.290  -0.734  10.644
  819    H    LEU 106           H        LEU 106 -12.434   2.718   5.904
  820    HA   LEU 106           HA       LEU 106 -13.404   5.529   5.515
  821   1HB   LEU 106          1HB       LEU 106 -12.006   3.550   3.669
  822   2HB   LEU 106          2HB       LEU 106 -12.739   5.051   3.112
  823    HG   LEU 106           HG       LEU 106 -10.496   4.914   5.175
  824   1HD1  LEU 106          1HD2      LEU 106 -10.206   7.322   4.579
  825   2HD1  LEU 106          2HD2      LEU 106 -11.679   7.242   3.591
  826   3HD1  LEU 106          3HD2      LEU 106 -11.762   7.016   5.353
  827   1HD2  LEU 106          1HD1      LEU 106  -9.022   5.609   3.330
  828   2HD2  LEU 106          2HD1      LEU 106 -10.379   5.485   2.187
  829   3HD2  LEU 106          3HD1      LEU 106  -9.765   4.032   3.010
  830    H    ASN 107           H        ASN 107 -13.888   3.024   3.103
  831    HA   ASN 107           HA       ASN 107 -16.314   1.925   3.798
  832   1HB   ASN 107          2HB       ASN 107 -16.999   4.453   3.472
  833   2HB   ASN 107          1HB       ASN 107 -16.631   4.189   1.780
  834   1HD2  ASN 107          1HD2      ASN 107 -17.735   1.630   1.344
  835   2HD2  ASN 107          2HD2      ASN 107 -19.480   1.709   1.647
  Start of MODEL   25
    1   1H    MET   1          1H        MET   1  -0.073  -3.606 -11.899
    2   2H    MET   1          2H        MET   1  -1.274  -3.919 -10.790
    3   3H    MET   1          3H        MET   1  -0.804  -2.385 -11.016
    4    HA   MET   1           HA       MET   1  -1.701  -2.357 -13.209
    5   1HB   MET   1          1HB       MET   1  -1.370  -4.673 -13.865
    6   2HB   MET   1          2HB       MET   1  -2.370  -5.264 -12.529
    7   1HG   MET   1          1HG       MET   1  -3.538  -5.284 -14.765
    8   2HG   MET   1          2HG       MET   1  -4.372  -4.430 -13.503
    9   1HE   MET   1          1HE       MET   1  -1.312  -3.145 -15.763
   10   2HE   MET   1          2HE       MET   1  -2.258  -2.428 -17.085
   11   3HE   MET   1          3HE       MET   1  -2.335  -4.180 -16.793
   12    H    GLU   2           HN       GLU   2  -3.569  -1.147 -13.027
   13    HA   GLU   2           HA       GLU   2  -5.322  -0.096 -12.059
   14   1HB   GLU   2          1HB       GLU   2  -5.822  -2.527 -10.270
   15   2HB   GLU   2          2HB       GLU   2  -6.892  -1.168 -10.622
   16   1HG   GLU   2          1HG       GLU   2  -6.820  -1.922 -13.080
   17   2HG   GLU   2          2HG       GLU   2  -6.011  -3.384 -12.502
   18    H    ALA   3           H        ALA   3  -3.832  -2.028  -9.472
   19    HA   ALA   3           HA       ALA   3  -3.225   0.273  -7.801
   20   1HB   ALA   3          1HB       ALA   3  -2.080  -2.550  -7.844
   21   2HB   ALA   3          2HB       ALA   3  -3.434  -2.037  -6.837
   22   3HB   ALA   3          3HB       ALA   3  -1.825  -1.354  -6.550
   23    H    GLY   4           H        GLY   4  -1.326   1.590  -8.052
   24   1HA   GLY   4          2HA       GLY   4   0.292   1.092 -10.456
   25   2HA   GLY   4          1HA       GLY   4   0.387   2.461  -9.345
   26    H    ALA   5           H        ALA   5   2.716   1.611 -10.147
   27    HA   ALA   5           HA       ALA   5   3.922   0.055  -7.907
   28   1HB   ALA   5          1HB       ALA   5   4.266  -1.093 -10.056
   29   2HB   ALA   5          2HB       ALA   5   5.786  -0.398  -9.454
   30   3HB   ALA   5          3HB       ALA   5   4.904   0.406 -10.771
   31    H    VAL   6           H        VAL   6   5.264   1.395  -6.652
   32    HA   VAL   6           HA       VAL   6   6.013   4.061  -7.762
   33    HB   VAL   6           HB       VAL   6   5.353   5.198  -5.833
   34   1HG1  VAL   6          1HG2      VAL   6   6.076   3.733  -4.030
   35   2HG1  VAL   6          2HG2      VAL   6   4.377   4.148  -3.804
   36   3HG1  VAL   6          3HG2      VAL   6   4.795   2.555  -4.451
   37   1HG2  VAL   6          1HG1      VAL   6   2.981   4.774  -5.545
   38   2HG2  VAL   6          2HG1      VAL   6   3.167   3.127  -6.158
   39   3HG2  VAL   6          3HG1      VAL   6   3.389   4.511  -7.258
   40    H    ASN   7           H        ASN   7   7.716   5.046  -6.651
   41    HA   ASN   7           HA       ASN   7   9.578   3.431  -5.030
   42   1HB   ASN   7          1HB       ASN   7  10.137   4.840  -7.687
   43   2HB   ASN   7          2HB       ASN   7  11.430   4.542  -6.540
   44   1HD2  ASN   7          2HD2      ASN   7  11.538   2.252  -5.635
   45   2HD2  ASN   7          1HD2      ASN   7  11.348   0.961  -6.841
   46    H    ASP   8           HN       ASP   8  11.376   5.083  -4.371
   47    HA   ASP   8           HA       ASP   8  10.289   6.890  -2.585
   48   1HB   ASP   8          2HB       ASP   8  12.676   6.035  -2.740
   49   2HB   ASP   8          1HB       ASP   8  12.997   7.260  -3.960
   50    H    ASP   9           HN       ASP   9  11.747   7.775  -5.696
   51    HA   ASP   9           HA       ASP   9  11.323  10.472  -5.826
   52   1HB   ASP   9          2HB       ASP   9  10.935   8.483  -8.119
   53   2HB   ASP   9          1HB       ASP   9  11.355  10.193  -8.257
   54    H    THR  10           H        THR  10   8.981   7.972  -6.935
   55    HA   THR  10           HA       THR  10   6.938   9.911  -7.600
   56    HB   THR  10           HB       THR  10   5.606   7.708  -7.834
   57    HG1  THR  10           HG1      THR  10   7.387   6.736  -6.391
   58   1HG2  THR  10          1HG2      THR  10   8.225   8.031  -9.380
   59   2HG2  THR  10          2HG2      THR  10   6.687   8.834  -9.765
   60   3HG2  THR  10          3HG2      THR  10   6.824   7.069  -9.889
   61    H    PHE  11           H        PHE  11   7.614   7.846  -4.786
   62    HA   PHE  11           HA       PHE  11   5.239   7.582  -3.451
   63   1HB   PHE  11          2HB       PHE  11   7.455   6.721  -2.750
   64   2HB   PHE  11          1HB       PHE  11   7.966   8.332  -2.323
   65    HD1  PHE  11           HD1      PHE  11   7.725   9.190  -0.175
   66    HD2  PHE  11           HD2      PHE  11   5.515   5.690  -1.377
   67    HE1  PHE  11           HE1      PHE  11   7.045   8.836   2.150
   68    HE2  PHE  11           HE2      PHE  11   4.702   5.422   0.953
   69    HZ   PHE  11           HZ       PHE  11   5.486   6.962   2.730
   70    H    LYS  12           HN       LYS  12   7.432  10.256  -3.404
   71    HA   LYS  12           HA       LYS  12   6.220  12.042  -1.626
   72   1HB   LYS  12          1HB       LYS  12   8.011  12.278  -4.045
   73   2HB   LYS  12          2HB       LYS  12   7.163  13.716  -3.515
   74   1HG   LYS  12          2HG       LYS  12   9.306  13.637  -2.377
   75   2HG   LYS  12          1HG       LYS  12   8.053  13.292  -1.165
   76   1HD   LYS  12          1HD       LYS  12   8.534  10.796  -1.587
   77   2HD   LYS  12          2HD       LYS  12   9.969  11.309  -2.470
   78   1HE   LYS  12          1HE       LYS  12   9.280  11.991   0.442
   79   2HE   LYS  12          2HE       LYS  12  10.344  10.677  -0.069
   80   1HZ   LYS  12          1HZ       LYS  12  10.805  13.527  -0.609
   81   2HZ   LYS  12          2HZ       LYS  12  11.783  12.284  -1.079
   82   3HZ   LYS  12          3HZ       LYS  12  11.583  12.614   0.522
   83    H    ASN  13           H        ASN  13   5.518  11.699  -5.102
   84    HA   ASN  13           HA       ASN  13   3.467  13.848  -5.057
   85   1HB   ASN  13          2HB       ASN  13   4.744  12.034  -7.112
   86   2HB   ASN  13          1HB       ASN  13   3.100  12.558  -7.422
   87   1HD2  ASN  13          2HD2      ASN  13   5.982  14.209  -5.944
   88   2HD2  ASN  13          1HD2      ASN  13   5.951  15.557  -7.072
   89    H    VAL  14           H        VAL  14   3.689  10.410  -5.508
   90    HA   VAL  14           HA       VAL  14   0.858  10.024  -6.046
   91    HB   VAL  14           HB       VAL  14   3.108   8.030  -5.497
   92   1HG1  VAL  14          1HG1      VAL  14   1.885   9.054  -8.103
   93   2HG1  VAL  14          2HG1      VAL  14   3.509   9.446  -7.513
   94   3HG1  VAL  14          3HG1      VAL  14   3.118   7.787  -7.972
   95   1HG2  VAL  14          1HG2      VAL  14   0.979   6.868  -5.180
   96   2HG2  VAL  14          2HG2      VAL  14   1.645   6.424  -6.757
   97   3HG2  VAL  14          3HG2      VAL  14   0.324   7.598  -6.665
   98    H    VAL  15           H        VAL  15   2.844   9.684  -3.131
   99    HA   VAL  15           HA       VAL  15   0.482   8.640  -1.642
  100    HB   VAL  15           HB       VAL  15   3.410   8.421  -0.876
  101   1HG1  VAL  15          1HG1      VAL  15   1.774   8.254   0.946
  102   2HG1  VAL  15          2HG1      VAL  15   2.598   6.726   0.656
  103   3HG1  VAL  15          3HG1      VAL  15   0.934   6.953   0.077
  104   1HG2  VAL  15          1HG2      VAL  15   3.276   6.095  -1.685
  105   2HG2  VAL  15          2HG2      VAL  15   1.679   6.424  -2.382
  106   3HG2  VAL  15          3HG2      VAL  15   3.116   7.238  -3.009
  107    H    LEU  16           H        LEU  16   3.385  10.727  -1.077
  108    HA   LEU  16           HA       LEU  16   2.209  11.746   1.348
  109   1HB   LEU  16          1HB       LEU  16   4.486  12.968  -0.269
  110   2HB   LEU  16          2HB       LEU  16   4.049  13.362   1.378
  111    HG   LEU  16           HG       LEU  16   5.156  10.711   0.363
  112   1HD1  LEU  16          1HD2      LEU  16   7.081  11.305   1.757
  113   2HD1  LEU  16          2HD2      LEU  16   6.747  12.632   0.631
  114   3HD1  LEU  16          3HD2      LEU  16   6.258  12.771   2.328
  115   1HD2  LEU  16          1HD1      LEU  16   4.200  11.493   3.149
  116   2HD2  LEU  16          2HD1      LEU  16   5.246  10.110   2.824
  117   3HD2  LEU  16          3HD1      LEU  16   3.616  10.137   2.147
  118    H    GLU  17           HN       GLU  17   2.953  13.730  -1.568
  119    HA   GLU  17           HA       GLU  17   0.880  15.655  -0.755
  120   1HB   GLU  17          2HB       GLU  17   3.236  16.232  -1.611
  121   2HB   GLU  17          1HB       GLU  17   2.693  15.692  -3.204
  122   1HG   GLU  17          1HG       GLU  17   2.495  18.102  -3.065
  123   2HG   GLU  17          2HG       GLU  17   0.859  17.439  -3.092
  124    H    SER  18           H        SER  18  -0.516  13.527  -1.056
  125    HA   SER  18           HA       SER  18  -1.370  13.061  -3.847
  126   1HB   SER  18          2HB       SER  18  -2.698  11.231  -2.720
  127   2HB   SER  18          1HB       SER  18  -0.965  11.165  -2.468
  128    HG   SER  18           HG       SER  18  -1.220  11.442  -0.422
  129    H    SER  19           H        SER  19  -4.183  12.510  -2.414
  130    HA   SER  19           HA       SER  19  -5.266  15.154  -2.029
  131   1HB   SER  19          2HB       SER  19  -6.776  14.991  -4.092
  132   2HB   SER  19          1HB       SER  19  -5.090  15.431  -4.413
  133    HG   SER  19           HG       SER  19  -4.671  13.351  -5.070
  134    H    VAL  20           H        VAL  20  -6.379  12.228  -3.632
  135    HA   VAL  20           HA       VAL  20  -8.449  11.643  -1.608
  136    HB   VAL  20           HB       VAL  20  -8.696   9.513  -2.955
  137   1HG1  VAL  20          1HG1      VAL  20  -6.351   9.332  -3.801
  138   2HG1  VAL  20          2HG1      VAL  20  -7.586   9.203  -5.057
  139   3HG1  VAL  20          3HG1      VAL  20  -6.668  10.704  -4.887
  140   1HG2  VAL  20          1HG2      VAL  20  -9.583  10.621  -5.005
  141   2HG2  VAL  20          2HG2      VAL  20 -10.112  11.367  -3.490
  142   3HG2  VAL  20          3HG2      VAL  20  -8.838  12.133  -4.478
  143    HA   PRO  21           HA       PRO  21  -5.597   9.406   0.915
  144   1HB   PRO  21          1HB       PRO  21  -6.875   7.180   1.867
  145   2HB   PRO  21          2HB       PRO  21  -7.270   8.839   2.397
  146   1HG   PRO  21          1HG       PRO  21  -8.662   7.193   0.283
  147   2HG   PRO  21          2HG       PRO  21  -9.391   8.105   1.628
  148   1HD   PRO  21          1HD       PRO  21  -9.258   9.094  -0.904
  149   2HD   PRO  21          2HD       PRO  21  -9.049  10.186   0.489
  150    H    VAL  22           H        VAL  22  -4.397   7.355   1.040
  151    HA   VAL  22           HA       VAL  22  -4.196   5.933  -1.563
  152    HB   VAL  22           HB       VAL  22  -1.964   7.188   0.074
  153   1HG1  VAL  22          1HG2      VAL  22  -0.560   6.659  -1.845
  154   2HG1  VAL  22          2HG2      VAL  22  -1.310   5.177  -1.222
  155   3HG1  VAL  22          3HG2      VAL  22  -1.918   5.947  -2.690
  156   1HG2  VAL  22          1HG1      VAL  22  -3.289   8.203  -2.465
  157   2HG2  VAL  22          2HG1      VAL  22  -1.729   8.773  -1.863
  158   3HG2  VAL  22          3HG1      VAL  22  -3.173   9.030  -0.899
  159    H    LEU  23           H        LEU  23  -3.387   3.822  -1.389
  160    HA   LEU  23           HA       LEU  23  -2.850   2.722   1.328
  161   1HB   LEU  23          1HB       LEU  23  -5.103   2.159   0.707
  162   2HB   LEU  23          2HB       LEU  23  -4.599   1.479  -0.840
  163    HG   LEU  23           HG       LEU  23  -3.498   0.423   1.799
  164   1HD1  LEU  23          1HD2      LEU  23  -3.939  -0.790  -0.981
  165   2HD1  LEU  23          2HD2      LEU  23  -2.383  -0.549  -0.158
  166   3HD1  LEU  23          3HD2      LEU  23  -3.515  -1.757   0.435
  167   1HD2  LEU  23          1HD1      LEU  23  -5.932   0.418   2.042
  168   2HD2  LEU  23          2HD1      LEU  23  -5.328  -1.232   1.849
  169   3HD2  LEU  23          3HD1      LEU  23  -6.108  -0.415   0.477
  170    H    VAL  24           H        VAL  24  -0.660   2.381   1.169
  171    HA   VAL  24           HA       VAL  24   0.467   1.540  -1.494
  172    HB   VAL  24           HB       VAL  24   2.495   2.351  -0.932
  173   1HG1  VAL  24          1HG2      VAL  24   0.896   4.201  -1.316
  174   2HG1  VAL  24          2HG2      VAL  24   0.640   4.345   0.441
  175   3HG1  VAL  24          3HG2      VAL  24   2.238   4.648  -0.258
  176   1HG2  VAL  24          1HG1      VAL  24   3.189   3.162   1.306
  177   2HG2  VAL  24          2HG1      VAL  24   2.909   1.423   1.232
  178   3HG2  VAL  24          3HG1      VAL  24   1.684   2.484   1.976
  179    H    ASP  25           HN       ASP  25   1.464  -0.478  -1.573
  180    HA   ASP  25           HA       ASP  25   1.638  -2.128   0.925
  181   1HB   ASP  25          1HB       ASP  25   0.170  -3.144  -0.721
  182   2HB   ASP  25          2HB       ASP  25   1.387  -2.928  -1.983
  183    H    PHE  26           H        PHE  26   3.709  -2.084   1.738
  184    HA   PHE  26           HA       PHE  26   5.992  -1.463  -0.062
  185   1HB   PHE  26          2HB       PHE  26   5.725  -2.184   2.885
  186   2HB   PHE  26          1HB       PHE  26   7.268  -2.033   2.067
  187    HD1  PHE  26           HD1      PHE  26   4.162  -0.076   2.923
  188    HD2  PHE  26           HD2      PHE  26   8.312   0.060   1.746
  189    HE1  PHE  26           HE1      PHE  26   4.251   2.321   3.501
  190    HE2  PHE  26           HE2      PHE  26   8.417   2.429   2.421
  191    HZ   PHE  26           HZ       PHE  26   6.365   3.589   3.259
  192    H    TRP  27           H        TRP  27   6.650  -3.005  -1.408
  193    HA   TRP  27           HA       TRP  27   6.578  -5.877  -0.450
  194   1HB   TRP  27          2HB       TRP  27   5.892  -6.645  -2.523
  195   2HB   TRP  27          1HB       TRP  27   4.817  -5.311  -2.187
  196    HD1  TRP  27           HD1      TRP  27   5.609  -2.967  -3.536
  197    HE1  TRP  27           HE1      TRP  27   6.838  -2.625  -5.805
  198    HE3  TRP  27           HE3      TRP  27   7.104  -7.774  -4.370
  199    HZ2  TRP  27           HZ2      TRP  27   8.472  -4.231  -7.566
  200    HZ3  TRP  27           HZ3      TRP  27   8.321  -8.366  -6.422
  201    HH2  TRP  27           HH2      TRP  27   8.981  -6.610  -8.054
  202    H    ALA  28           H        ALA  28   7.915  -7.144  -2.302
  203    HA   ALA  28           HA       ALA  28  10.134  -5.868  -3.501
  204   1HB   ALA  28          1HB       ALA  28  10.846  -7.455  -0.999
  205   2HB   ALA  28          2HB       ALA  28  11.043  -5.693  -1.171
  206   3HB   ALA  28          3HB       ALA  28  11.994  -6.796  -2.172
  207    HA   PRO  29           HA       PRO  29   9.845  -9.970  -5.367
  208   1HB   PRO  29          1HB       PRO  29  11.975 -10.059  -6.891
  209   2HB   PRO  29          2HB       PRO  29  10.567  -9.042  -7.356
  210   1HG   PRO  29          1HG       PRO  29  13.154  -8.109  -6.058
  211   2HG   PRO  29          2HG       PRO  29  12.230  -7.308  -7.358
  212   1HD   PRO  29          2HD       PRO  29  11.979  -6.585  -4.690
  213   2HD   PRO  29          1HD       PRO  29  10.625  -6.495  -5.822
  214    H    TRP  30           H        TRP  30  10.240 -11.477  -4.055
  215    HA   TRP  30           HA       TRP  30  11.886 -13.281  -3.384
  216   1HB   TRP  30          2HB       TRP  30  13.366 -12.753  -1.554
  217   2HB   TRP  30          1HB       TRP  30  13.856 -11.875  -2.977
  218    HD1  TRP  30           HD1      TRP  30  14.420  -9.407  -2.563
  219    HE1  TRP  30           HE1      TRP  30  14.110  -7.696  -0.665
  220    HE3  TRP  30           HE3      TRP  30  11.667 -12.243   0.701
  221    HZ2  TRP  30           HZ2      TRP  30  12.811  -7.549   1.863
  222    HZ3  TRP  30           HZ3      TRP  30  10.826 -11.249   2.801
  223    HH2  TRP  30           HH2      TRP  30  11.301  -8.871   3.345
  224    H    CYS  31           H        CYS  31  10.023 -10.589  -2.159
  225    HA   CYS  31           HA       CYS  31   9.267 -11.744   0.384
  226   1HB   CYS  31          1HB       CYS  31   9.155  -9.340  -0.073
  227   2HB   CYS  31          2HB       CYS  31   7.883  -9.640  -1.265
  228    H    GLY  32           H        GLY  32   8.756 -13.871  -0.162
  229   1HA   GLY  32          1HA       GLY  32   6.988 -15.152  -1.613
  230   2HA   GLY  32          2HA       GLY  32   7.048 -15.458   0.126
  231    HA   PRO  33           HA       PRO  33   2.903 -14.121   0.667
  232   1HB   PRO  33          1HB       PRO  33   2.887 -11.926   2.400
  233   2HB   PRO  33          2HB       PRO  33   2.948 -13.649   2.868
  234   1HG   PRO  33          2HG       PRO  33   5.276 -11.740   2.560
  235   2HG   PRO  33          1HG       PRO  33   4.912 -12.859   3.888
  236   1HD   PRO  33          1HD       PRO  33   6.695 -13.429   1.866
  237   2HD   PRO  33          2HD       PRO  33   5.600 -14.722   2.428
  238    H    CYS  34           H        CYS  34   5.012 -11.254   0.173
  239    HA   CYS  34           HA       CYS  34   3.021  -9.472  -0.746
  240   1HB   CYS  34          1HB       CYS  34   5.759  -9.553  -1.949
  241   2HB   CYS  34          2HB       CYS  34   4.611  -8.258  -1.799
  242    H    ARG  35           HN       ARG  35   5.016 -11.918  -2.470
  243    HA   ARG  35           HA       ARG  35   4.298 -11.282  -5.095
  244   1HB   ARG  35          1HB       ARG  35   6.039 -12.915  -4.336
  245   2HB   ARG  35          2HB       ARG  35   4.788 -14.064  -3.923
  246   1HG   ARG  35          2HG       ARG  35   5.857 -14.603  -6.037
  247   2HG   ARG  35          1HG       ARG  35   4.119 -14.372  -6.214
  248   1HD   ARG  35          1HD       ARG  35   6.119 -12.155  -6.827
  249   2HD   ARG  35          2HD       ARG  35   5.663 -13.395  -8.018
  250    HE   ARG  35           HE       ARG  35   3.274 -12.319  -6.966
  251   1HH1  ARG  35          2HH1      ARG  35   5.976 -11.291  -8.994
  252   2HH1  ARG  35          1HH1      ARG  35   5.040 -10.114  -9.877
  253   1HH2  ARG  35          2HH2      ARG  35   2.057 -10.832  -8.078
  254   2HH2  ARG  35          1HH2      ARG  35   2.740  -9.848  -9.348
  255    H    ILE  36           H        ILE  36   2.795 -13.660  -2.936
  256    HA   ILE  36           HA       ILE  36   0.622 -14.241  -4.809
  257    HB   ILE  36           HB       ILE  36  -0.321 -15.599  -2.983
  258   1HG1  ILE  36          1HG1      ILE  36   2.142 -14.889  -1.347
  259   2HG1  ILE  36          2HG1      ILE  36   0.595 -14.049  -1.142
  260   1HG2  ILE  36          1HG2      ILE  36   1.497 -17.261  -2.976
  261   2HG2  ILE  36          2HG2      ILE  36   2.682 -16.018  -3.418
  262   3HG2  ILE  36          3HG2      ILE  36   1.404 -16.480  -4.559
  263   1HD1  ILE  36          1HD1      ILE  36   1.001 -16.996  -0.730
  264   2HD1  ILE  36          2HD1      ILE  36  -0.548 -16.107  -0.624
  265   3HD1  ILE  36          3HD1      ILE  36   0.772 -15.736   0.508
  266    H    ILE  37           H        ILE  37   0.944 -12.044  -2.062
  267    HA   ILE  37           HA       ILE  37  -1.845 -11.277  -2.008
  268    HB   ILE  37           HB       ILE  37   0.711 -10.347  -0.739
  269   1HG1  ILE  37          1HG1      ILE  37  -0.628 -10.446   1.265
  270   2HG1  ILE  37          2HG1      ILE  37  -2.130 -10.621   0.345
  271   1HG2  ILE  37          1HG2      ILE  37  -0.025  -8.190  -1.466
  272   2HG2  ILE  37          2HG2      ILE  37  -1.694  -8.518  -0.904
  273   3HG2  ILE  37          3HG2      ILE  37  -0.358  -8.366   0.250
  274   1HD1  ILE  37          1HD1      ILE  37  -1.344 -12.894  -0.384
  275   2HD1  ILE  37          2HD1      ILE  37  -1.501 -12.723   1.366
  276   3HD1  ILE  37          3HD1      ILE  37   0.106 -12.663   0.633
  277    H    ALA  38           H        ALA  38   0.965  -9.875  -3.748
  278    HA   ALA  38           HA       ALA  38   0.117  -7.547  -4.675
  279   1HB   ALA  38          1HB       ALA  38   2.230  -8.530  -5.336
  280   2HB   ALA  38          2HB       ALA  38   1.361  -7.958  -6.768
  281   3HB   ALA  38          3HB       ALA  38   1.417  -9.690  -6.399
  282    HA   PRO  39           HA       PRO  39  -2.703  -9.150  -8.286
  283   1HB   PRO  39          1HB       PRO  39  -3.840 -11.671  -7.165
  284   2HB   PRO  39          2HB       PRO  39  -3.314 -11.326  -8.834
  285   1HG   PRO  39          2HG       PRO  39  -1.831 -12.937  -7.195
  286   2HG   PRO  39          1HG       PRO  39  -1.027 -11.751  -8.274
  287   1HD   PRO  39          1HD       PRO  39  -1.829 -11.338  -5.373
  288   2HD   PRO  39          2HD       PRO  39  -0.193 -11.175  -6.081
  289    H    VAL  40           H        VAL  40  -3.306  -9.986  -4.893
  290    HA   VAL  40           HA       VAL  40  -6.116  -9.329  -4.842
  291    HB   VAL  40           HB       VAL  40  -4.233  -9.378  -2.450
  292   1HG1  VAL  40          1HG1      VAL  40  -6.519  -8.549  -2.088
  293   2HG1  VAL  40          2HG1      VAL  40  -6.236 -10.105  -1.282
  294   3HG1  VAL  40          3HG1      VAL  40  -7.164 -10.051  -2.798
  295   1HG2  VAL  40          1HG2      VAL  40  -5.592 -11.741  -3.837
  296   2HG2  VAL  40          2HG2      VAL  40  -4.849 -11.795  -2.226
  297   3HG2  VAL  40          3HG2      VAL  40  -3.841 -11.522  -3.644
  298    H    VAL  41           H        VAL  41  -3.015  -7.691  -4.071
  299    HA   VAL  41           HA       VAL  41  -4.139  -5.189  -3.270
  300    HB   VAL  41           HB       VAL  41  -1.473  -5.584  -4.713
  301   1HG1  VAL  41          1HG1      VAL  41  -1.540  -7.096  -2.809
  302   2HG1  VAL  41          2HG1      VAL  41  -0.470  -5.749  -2.466
  303   3HG1  VAL  41          3HG1      VAL  41  -2.094  -5.798  -1.738
  304   1HG2  VAL  41          1HG2      VAL  41  -2.098  -3.235  -4.529
  305   2HG2  VAL  41          2HG2      VAL  41  -2.509  -3.442  -2.809
  306   3HG2  VAL  41          3HG2      VAL  41  -0.830  -3.590  -3.349
  307    H    ASP  42           HN       ASP  42  -3.182  -6.430  -6.487
  308    HA   ASP  42           HA       ASP  42  -3.775  -4.119  -8.024
  309   1HB   ASP  42          1HB       ASP  42  -3.903  -7.069  -8.796
  310   2HB   ASP  42          2HB       ASP  42  -4.085  -5.734  -9.919
  311    H    GLU  43           HN       GLU  43  -5.934  -7.038  -7.565
  312    HA   GLU  43           HA       GLU  43  -8.102  -5.757  -8.870
  313   1HB   GLU  43          1HB       GLU  43  -9.379  -7.587  -8.269
  314   2HB   GLU  43          2HB       GLU  43  -7.741  -8.229  -8.388
  315   1HG   GLU  43          2HG       GLU  43  -7.682  -7.836  -5.780
  316   2HG   GLU  43          1HG       GLU  43  -9.434  -7.701  -5.917
  317    H    ILE  44           H        ILE  44  -7.155  -5.773  -5.419
  318    HA   ILE  44           HA       ILE  44  -9.419  -4.528  -4.314
  319    HB   ILE  44           HB       ILE  44  -6.470  -4.618  -3.678
  320   1HG1  ILE  44          2HG1      ILE  44  -8.204  -6.428  -3.128
  321   2HG1  ILE  44          1HG1      ILE  44  -7.158  -5.884  -1.811
  322   1HG2  ILE  44          1HG2      ILE  44  -8.351  -2.791  -2.203
  323   2HG2  ILE  44          2HG2      ILE  44  -6.854  -2.369  -3.062
  324   3HG2  ILE  44          3HG2      ILE  44  -6.783  -3.373  -1.608
  325   1HD1  ILE  44          1HD1      ILE  44  -9.469  -6.222  -1.087
  326   2HD1  ILE  44          2HD1      ILE  44  -9.021  -4.525  -0.897
  327   3HD1  ILE  44          3HD1      ILE  44 -10.058  -5.028  -2.250
  328    H    ALA  45           H        ALA  45  -6.717  -3.084  -6.200
  329    HA   ALA  45           HA       ALA  45  -7.539  -0.368  -5.814
  330   1HB   ALA  45          1HB       ALA  45  -6.197   0.126  -7.729
  331   2HB   ALA  45          2HB       ALA  45  -5.399  -1.235  -6.899
  332   3HB   ALA  45          3HB       ALA  45  -6.355  -1.521  -8.351
  333    H    GLY  46           H        GLY  46  -8.628  -2.947  -8.084
  334   1HA   GLY  46          2HA       GLY  46 -10.179  -1.286  -9.836
  335   2HA   GLY  46          1HA       GLY  46 -10.365  -3.031  -9.558
  336    H    GLU  47           HN       GLU  47 -10.801  -3.016  -6.770
  337    HA   GLU  47           HA       GLU  47 -13.607  -2.387  -6.657
  338   1HB   GLU  47          2HB       GLU  47 -11.766  -2.937  -4.291
  339   2HB   GLU  47          1HB       GLU  47 -13.515  -3.104  -4.387
  340   1HG   GLU  47          2HG       GLU  47 -12.994  -4.835  -6.303
  341   2HG   GLU  47          1HG       GLU  47 -11.352  -4.798  -5.684
  342    H    TYR  48           H        TYR  48 -10.806  -0.923  -5.034
  343    HA   TYR  48           HA       TYR  48 -12.531   1.245  -3.966
  344   1HB   TYR  48          2HB       TYR  48  -9.735   0.326  -3.243
  345   2HB   TYR  48          1HB       TYR  48 -10.596   1.655  -2.470
  346    HD1  TYR  48           HD1      TYR  48 -10.322  -1.989  -2.574
  347    HD2  TYR  48           HD2      TYR  48 -12.759   1.319  -1.301
  348    HE1  TYR  48           HE1      TYR  48 -11.645  -3.516  -1.142
  349    HE2  TYR  48           HE2      TYR  48 -14.103  -0.207   0.098
  350    HH   TYR  48           HH       TYR  48 -14.550  -2.411   0.596
  351    H    LYS  49           HN       LYS  49 -10.887   1.091  -6.782
  352    HA   LYS  49           HA       LYS  49  -9.255   3.173  -7.109
  353   1HB   LYS  49          1HB       LYS  49 -10.217   3.472  -9.396
  354   2HB   LYS  49          2HB       LYS  49  -9.942   1.786  -8.979
  355   1HG   LYS  49          1HG       LYS  49 -12.396   1.610  -8.353
  356   2HG   LYS  49          2HG       LYS  49 -12.615   3.259  -8.975
  357   1HD   LYS  49          2HD       LYS  49 -11.719   2.504 -11.190
  358   2HD   LYS  49          1HD       LYS  49 -11.592   0.853 -10.552
  359   1HE   LYS  49          2HE       LYS  49 -14.157   2.481 -10.882
  360   2HE   LYS  49          1HE       LYS  49 -13.643   1.095 -11.860
  361   1HZ   LYS  49          1HZ       LYS  49 -15.188   0.367 -10.260
  362   2HZ   LYS  49          2HZ       LYS  49 -13.709  -0.218  -9.803
  363   3HZ   LYS  49          3HZ       LYS  49 -14.362   1.065  -9.017
  364    H    ASP  50           HN       ASP  50  -9.310   5.358  -7.534
  365    HA   ASP  50           HA       ASP  50  -9.887   7.531  -7.482
  366   1HB   ASP  50          1HB       ASP  50 -12.802   6.593  -7.550
  367   2HB   ASP  50          2HB       ASP  50 -12.231   8.240  -7.690
  368    H    LYS  51           HN       LYS  51 -11.933   5.646  -5.273
  369    HA   LYS  51           HA       LYS  51 -12.133   7.737  -3.291
  370   1HB   LYS  51          2HB       LYS  51 -12.480   4.749  -3.017
  371   2HB   LYS  51          1HB       LYS  51 -13.134   5.989  -1.947
  372   1HG   LYS  51          1HG       LYS  51 -14.740   6.712  -3.574
  373   2HG   LYS  51          2HG       LYS  51 -13.964   5.842  -4.895
  374   1HD   LYS  51          2HD       LYS  51 -15.391   4.520  -2.554
  375   2HD   LYS  51          1HD       LYS  51 -16.001   4.716  -4.208
  376   1HE   LYS  51          1HE       LYS  51 -13.892   3.424  -4.981
  377   2HE   LYS  51          2HE       LYS  51 -13.680   2.996  -3.269
  378   1HZ   LYS  51          1HZ       LYS  51 -14.834   1.333  -4.510
  379   2HZ   LYS  51          2HZ       LYS  51 -16.044   2.387  -4.875
  380   3HZ   LYS  51          3HZ       LYS  51 -15.786   1.944  -3.306
  381    H    LEU  52           H        LEU  52  -9.765   5.278  -4.035
  382    HA   LEU  52           HA       LEU  52  -8.057   6.045  -1.787
  383   1HB   LEU  52          1HB       LEU  52  -9.604   4.201  -0.987
  384   2HB   LEU  52          2HB       LEU  52  -8.999   3.203  -2.311
  385    HG   LEU  52           HG       LEU  52  -6.720   3.251  -1.286
  386   1HD1  LEU  52          1HD2      LEU  52  -6.556   3.996   1.108
  387   2HD1  LEU  52          2HD2      LEU  52  -8.182   4.695   0.982
  388   3HD1  LEU  52          3HD2      LEU  52  -6.848   5.340   0.004
  389   1HD2  LEU  52          1HD1      LEU  52  -9.056   2.308   0.442
  390   2HD2  LEU  52          2HD1      LEU  52  -8.280   1.400  -0.872
  391   3HD2  LEU  52          3HD1      LEU  52  -7.387   1.750   0.618
  392    H    LYS  53           HN       LYS  53  -5.878   6.088  -2.650
  393    HA   LYS  53           HA       LYS  53  -5.602   5.076  -5.404
  394   1HB   LYS  53          2HB       LYS  53  -4.763   7.379  -4.072
  395   2HB   LYS  53          1HB       LYS  53  -3.302   6.422  -4.135
  396   1HG   LYS  53          1HG       LYS  53  -4.980   7.016  -6.579
  397   2HG   LYS  53          2HG       LYS  53  -3.507   7.866  -6.083
  398   1HD   LYS  53          1HD       LYS  53  -2.189   5.773  -6.243
  399   2HD   LYS  53          2HD       LYS  53  -3.634   4.857  -6.676
  400   1HE   LYS  53          1HE       LYS  53  -2.363   5.326  -8.679
  401   2HE   LYS  53          2HE       LYS  53  -3.910   6.183  -8.742
  402   1HZ   LYS  53          1HZ       LYS  53  -2.763   8.170  -8.077
  403   2HZ   LYS  53          2HZ       LYS  53  -1.327   7.366  -7.989
  404   3HZ   LYS  53          3HZ       LYS  53  -2.083   7.548  -9.441
  405    H    CYS  54           H        CYS  54  -5.397   2.843  -5.237
  406    HA   CYS  54           HA       CYS  54  -3.766   1.644  -3.144
  407   1HB   CYS  54          1HB       CYS  54  -5.756   0.507  -4.008
  408   2HB   CYS  54          2HB       CYS  54  -5.006   0.476  -5.624
  409    HG   CYS  54           HG       CYS  54  -4.728  -1.905  -4.729
  410    H    VAL  55           H        VAL  55  -1.564   1.065  -3.302
  411    HA   VAL  55           HA       VAL  55  -0.293   0.811  -5.925
  412    HB   VAL  55           HB       VAL  55   1.530   2.503  -4.614
  413   1HG1  VAL  55          1HG1      VAL  55  -1.093   3.970  -4.394
  414   2HG1  VAL  55          2HG1      VAL  55  -0.247   3.235  -3.009
  415   3HG1  VAL  55          3HG1      VAL  55   0.538   4.509  -3.955
  416   1HG2  VAL  55          1HG2      VAL  55   1.190   2.503  -6.940
  417   2HG2  VAL  55          2HG2      VAL  55  -0.479   3.079  -6.807
  418   3HG2  VAL  55          3HG2      VAL  55   0.872   4.144  -6.384
  419    H    LYS  56           HN       LYS  56   2.006   0.316  -5.761
  420    HA   LYS  56           HA       LYS  56   2.701  -1.293  -3.348
  421   1HB   LYS  56          2HB       LYS  56   2.652  -1.807  -6.329
  422   2HB   LYS  56          1HB       LYS  56   3.782  -2.708  -5.332
  423   1HG   LYS  56          1HG       LYS  56   2.073  -3.684  -4.000
  424   2HG   LYS  56          2HG       LYS  56   0.811  -2.639  -4.675
  425   1HD   LYS  56          2HD       LYS  56   2.376  -4.509  -6.492
  426   2HD   LYS  56          1HD       LYS  56   1.096  -5.140  -5.453
  427   1HE   LYS  56          2HE       LYS  56   0.134  -4.683  -7.590
  428   2HE   LYS  56          1HE       LYS  56  -0.539  -3.555  -6.408
  429   1HZ   LYS  56          1HZ       LYS  56   0.033  -2.516  -8.501
  430   2HZ   LYS  56          2HZ       LYS  56   0.911  -1.866  -7.277
  431   3HZ   LYS  56          3HZ       LYS  56   1.616  -2.937  -8.311
  432    H    LEU  57           H        LEU  57   4.798  -0.919  -2.592
  433    HA   LEU  57           HA       LEU  57   6.646   0.488  -4.445
  434   1HB   LEU  57          2HB       LEU  57   7.179   1.960  -3.111
  435   2HB   LEU  57          1HB       LEU  57   5.562   1.815  -2.435
  436    HG   LEU  57           HG       LEU  57   6.747   0.759  -0.449
  437   1HD1  LEU  57          1HD1      LEU  57   7.691   3.046   0.206
  438   2HD1  LEU  57          2HD1      LEU  57   6.078   3.097  -0.513
  439   3HD1  LEU  57          3HD1      LEU  57   7.508   3.539  -1.470
  440   1HD2  LEU  57          1HD2      LEU  57   9.243   1.455  -0.288
  441   2HD2  LEU  57          2HD2      LEU  57   9.239   1.484  -2.058
  442   3HD2  LEU  57          3HD2      LEU  57   8.908  -0.020  -1.159
  443    H    ASN  58           H        ASN  58   8.661  -0.110  -4.730
  444    HA   ASN  58           HA       ASN  58   9.294  -2.768  -3.692
  445   1HB   ASN  58          1HB       ASN  58   9.669  -2.219  -6.043
  446   2HB   ASN  58          2HB       ASN  58  10.789  -0.931  -5.590
  447   1HD2  ASN  58          2HD2      ASN  58  10.748  -4.047  -6.730
  448   2HD2  ASN  58          1HD2      ASN  58  12.296  -4.577  -6.089
  449    H    THR  59           H        THR  59  10.161  -3.048  -1.833
  450    HA   THR  59           HA       THR  59  11.495  -0.960  -0.314
  451    HB   THR  59           HB       THR  59  10.783  -3.859   0.397
  452    HG1  THR  59           HG1      THR  59   8.942  -2.867  -0.270
  453   1HG2  THR  59          1HG2      THR  59  11.462  -1.399   1.997
  454   2HG2  THR  59          2HG2      THR  59  12.147  -3.026   2.140
  455   3HG2  THR  59          3HG2      THR  59  10.496  -2.732   2.693
  456    H    ASP  60           HN       ASP  60  13.050  -1.612  -2.450
  457    HA   ASP  60           HA       ASP  60  15.562  -2.451  -1.141
  458   1HB   ASP  60          2HB       ASP  60  14.957  -4.616  -1.642
  459   2HB   ASP  60          1HB       ASP  60  13.973  -4.167  -3.003
  460    H    GLU  61           HN       GLU  61  13.855  -1.717  -4.135
  461    HA   GLU  61           HA       GLU  61  15.914  -0.028  -5.296
  462   1HB   GLU  61          2HB       GLU  61  14.217  -1.377  -6.548
  463   2HB   GLU  61          1HB       GLU  61  12.944  -0.382  -5.818
  464   1HG   GLU  61          2HG       GLU  61  13.811   1.614  -7.016
  465   2HG   GLU  61          1HG       GLU  61  15.121   0.625  -7.681
  466    H    SER  62           H        SER  62  13.215   0.320  -3.032
  467    HA   SER  62           HA       SER  62  13.913   3.135  -2.527
  468   1HB   SER  62          1HB       SER  62  11.181   2.032  -3.294
  469   2HB   SER  62          2HB       SER  62  11.401   3.592  -2.514
  470    HG   SER  62           HG       SER  62  13.167   3.286  -4.568
  471    HA   PRO  63           HA       PRO  63  13.290   0.543   1.296
  472   1HB   PRO  63          1HB       PRO  63  15.835   0.415   2.185
  473   2HB   PRO  63          2HB       PRO  63  15.301  -0.634   0.834
  474   1HG   PRO  63          2HG       PRO  63  16.762   2.035   0.646
  475   2HG   PRO  63          1HG       PRO  63  17.177   0.516  -0.167
  476   1HD   PRO  63          2HD       PRO  63  15.701   2.374  -1.487
  477   2HD   PRO  63          1HD       PRO  63  15.326   0.654  -1.614
  478    H    ASN  64           H        ASN  64  15.150   3.408   0.465
  479    HA   ASN  64           HA       ASN  64  15.654   4.844   2.657
  480   1HB   ASN  64          1HB       ASN  64  14.019   6.012   0.351
  481   2HB   ASN  64          2HB       ASN  64  15.063   6.902   1.466
  482   1HD2  ASN  64          2HD2      ASN  64  15.399   7.248  -1.220
  483   2HD2  ASN  64          1HD2      ASN  64  16.892   6.455  -1.731
  484    H    VAL  65           H        VAL  65  12.440   4.959   1.175
  485    HA   VAL  65           HA       VAL  65  11.061   6.317   3.215
  486    HB   VAL  65           HB       VAL  65  10.103   4.291   1.134
  487   1HG1  VAL  65          1HG2      VAL  65   7.924   5.316   1.388
  488   2HG1  VAL  65          2HG2      VAL  65   8.549   6.412   2.655
  489   3HG1  VAL  65          3HG2      VAL  65   8.438   4.670   2.950
  490   1HG2  VAL  65          1HG1      VAL  65  11.255   6.189   0.070
  491   2HG2  VAL  65          2HG1      VAL  65   9.512   6.344  -0.165
  492   3HG2  VAL  65          3HG1      VAL  65  10.332   7.335   1.060
  493    H    ALA  66           H        ALA  66  11.322   2.840   2.529
  494    HA   ALA  66           HA       ALA  66   9.684   1.915   4.667
  495   1HB   ALA  66          1HB       ALA  66  10.478   0.542   2.747
  496   2HB   ALA  66          2HB       ALA  66  10.757  -0.245   4.313
  497   3HB   ALA  66          3HB       ALA  66  12.108   0.511   3.460
  498    H    SER  67           H        SER  67  13.088   2.871   4.626
  499    HA   SER  67           HA       SER  67  13.710   1.912   7.286
  500   1HB   SER  67          1HB       SER  67  15.184   3.992   5.608
  501   2HB   SER  67          2HB       SER  67  15.816   3.045   6.963
  502    HG   SER  67           HG       SER  67  14.873   2.004   4.480
  503    H    GLU  68           HN       GLU  68  12.923   5.061   5.822
  504    HA   GLU  68           HA       GLU  68  13.089   6.697   8.136
  505   1HB   GLU  68          2HB       GLU  68  11.276   6.847   5.691
  506   2HB   GLU  68          1HB       GLU  68  11.375   8.119   6.905
  507   1HG   GLU  68          2HG       GLU  68  13.590   8.689   6.355
  508   2HG   GLU  68          1HG       GLU  68  13.914   7.155   5.554
  509    H    TYR  69           H        TYR  69  10.348   4.768   6.847
  510    HA   TYR  69           HA       TYR  69   8.634   5.462   9.122
  511   1HB   TYR  69          2HB       TYR  69   8.406   3.677   6.690
  512   2HB   TYR  69          1HB       TYR  69   7.310   3.469   8.046
  513    HD1  TYR  69           HD1      TYR  69   8.372   5.857   5.390
  514    HD2  TYR  69           HD2      TYR  69   5.693   5.183   8.696
  515    HE1  TYR  69           HE1      TYR  69   7.296   8.032   4.954
  516    HE2  TYR  69           HE2      TYR  69   4.601   7.363   8.243
  517    HH   TYR  69           HH       TYR  69   5.848   9.646   5.811
  518    H    GLY  70           H        GLY  70  10.770   2.727   8.302
  519   1HA   GLY  70          1HA       GLY  70  11.919   1.476   9.914
  520   2HA   GLY  70          2HA       GLY  70  10.776   1.965  11.169
  521    H    ILE  71           H        ILE  71  10.484   0.408   7.948
  522    HA   ILE  71           HA       ILE  71   8.452  -1.455   8.936
  523    HB   ILE  71           HB       ILE  71   9.833  -1.107   6.253
  524   1HG1  ILE  71          2HG1      ILE  71   7.113  -0.292   7.401
  525   2HG1  ILE  71          1HG1      ILE  71   8.437   0.799   6.962
  526   1HG2  ILE  71          1HG2      ILE  71   7.414  -2.823   6.959
  527   2HG2  ILE  71          2HG2      ILE  71   9.020  -3.451   6.534
  528   3HG2  ILE  71          3HG2      ILE  71   8.086  -2.575   5.335
  529   1HD1  ILE  71          1HD1      ILE  71   6.916   0.949   5.204
  530   2HD1  ILE  71          2HD1      ILE  71   8.238  -0.075   4.598
  531   3HD1  ILE  71          3HD1      ILE  71   6.689  -0.805   5.091
  532    H    ARG  72           HN       ARG  72   9.061  -3.109  10.183
  533    HA   ARG  72           HA       ARG  72  11.723  -4.211  10.094
  534   1HB   ARG  72          2HB       ARG  72  11.105  -5.491  11.917
  535   2HB   ARG  72          1HB       ARG  72  10.343  -3.931  12.181
  536   1HG   ARG  72          1HG       ARG  72   8.717  -6.233  10.997
  537   2HG   ARG  72          2HG       ARG  72   9.181  -6.255  12.671
  538   1HD   ARG  72          2HD       ARG  72   6.951  -5.388  12.518
  539   2HD   ARG  72          1HD       ARG  72   8.061  -4.191  13.176
  540    HE   ARG  72           HE       ARG  72   7.418  -2.778  11.551
  541   1HH1  ARG  72          2HH1      ARG  72   6.817  -6.045  10.273
  542   2HH1  ARG  72          1HH1      ARG  72   6.121  -5.434   8.780
  543   1HH2  ARG  72          2HH2      ARG  72   6.279  -2.061   9.699
  544   2HH2  ARG  72          1HH2      ARG  72   5.715  -3.240   8.530
  545    H    SER  73           H        SER  73   8.660  -5.111   8.564
  546    HA   SER  73           HA       SER  73   9.980  -7.210   7.056
  547   1HB   SER  73          1HB       SER  73   7.590  -7.985   8.795
  548   2HB   SER  73          2HB       SER  73   8.550  -9.037   7.747
  549    HG   SER  73           HG       SER  73  10.333  -8.100   9.298
  550    H    ILE  74           H        ILE  74   8.366  -8.094   5.379
  551    HA   ILE  74           HA       ILE  74   6.199  -6.184   4.815
  552    HB   ILE  74           HB       ILE  74   6.983  -6.423   2.357
  553   1HG1  ILE  74          1HG1      ILE  74   9.699  -6.958   3.572
  554   2HG1  ILE  74          2HG1      ILE  74   8.675  -8.225   2.871
  555   1HG2  ILE  74          1HG2      ILE  74   8.736  -4.810   4.264
  556   2HG2  ILE  74          2HG2      ILE  74   7.093  -4.343   3.776
  557   3HG2  ILE  74          3HG2      ILE  74   8.374  -4.425   2.570
  558   1HD1  ILE  74          1HD1      ILE  74   8.564  -6.923   0.735
  559   2HD1  ILE  74          2HD1      ILE  74  10.188  -7.453   1.170
  560   3HD1  ILE  74          3HD1      ILE  74   9.732  -5.767   1.415
  561    HA   PRO  75           HA       PRO  75   4.860  -6.223   2.728
  562   1HB   PRO  75          1HB       PRO  75   2.204  -6.647   2.420
  563   2HB   PRO  75          2HB       PRO  75   3.465  -7.193   1.309
  564   1HG   PRO  75          1HG       PRO  75   2.117  -8.758   3.554
  565   2HG   PRO  75          2HG       PRO  75   2.379  -9.323   1.877
  566   1HD   PRO  75          2HD       PRO  75   4.006  -9.990   4.005
  567   2HD   PRO  75          1HD       PRO  75   4.657  -9.730   2.364
  568    H    THR  76           H        THR  76   4.248  -4.500   3.617
  569    HA   THR  76           HA       THR  76   2.608  -4.436   6.111
  570    HB   THR  76           HB       THR  76   5.112  -2.778   5.578
  571    HG1  THR  76           HG1      THR  76   5.676  -4.671   6.606
  572   1HG2  THR  76          1HG2      THR  76   3.056  -2.602   7.829
  573   2HG2  THR  76          2HG2      THR  76   4.555  -1.661   7.714
  574   3HG2  THR  76          3HG2      THR  76   3.264  -1.393   6.545
  575    H    ILE  77           H        ILE  77   0.773  -3.775   5.141
  576    HA   ILE  77           HA       ILE  77   0.784  -1.897   2.872
  577    HB   ILE  77           HB       ILE  77  -1.417  -3.299   4.452
  578   1HG1  ILE  77          2HG1      ILE  77  -0.462  -3.618   1.564
  579   2HG1  ILE  77          1HG1      ILE  77  -0.020  -4.689   2.897
  580   1HG2  ILE  77          1HG2      ILE  77  -1.649  -1.428   2.057
  581   2HG2  ILE  77          2HG2      ILE  77  -2.236  -1.086   3.697
  582   3HG2  ILE  77          3HG2      ILE  77  -2.988  -2.364   2.762
  583   1HD1  ILE  77          1HD1      ILE  77  -2.797  -4.319   1.719
  584   2HD1  ILE  77          2HD1      ILE  77  -1.778  -5.762   1.705
  585   3HD1  ILE  77          3HD1      ILE  77  -2.468  -5.188   3.238
  586    H    MET  78           H        MET  78   0.300   0.315   3.176
  587    HA   MET  78           HA       MET  78  -0.420   1.191   5.934
  588   1HB   MET  78          2HB       MET  78   1.562   2.658   4.230
  589   2HB   MET  78          1HB       MET  78   0.990   3.100   5.829
  590   1HG   MET  78          2HG       MET  78   1.995   0.964   6.717
  591   2HG   MET  78          1HG       MET  78   2.795   0.760   5.151
  592   1HE   MET  78          1HE       MET  78   4.961   0.528   6.616
  593   2HE   MET  78          2HE       MET  78   5.626   1.800   7.669
  594   3HE   MET  78          3HE       MET  78   4.142   0.939   8.144
  595    H    VAL  79           H        VAL  79  -1.576   3.035   5.995
  596    HA   VAL  79           HA       VAL  79  -2.977   3.808   3.463
  597    HB   VAL  79           HB       VAL  79  -3.931   3.841   6.344
  598   1HG1  VAL  79          1HG1      VAL  79  -4.146   1.662   5.194
  599   2HG1  VAL  79          2HG1      VAL  79  -4.994   2.452   3.846
  600   3HG1  VAL  79          3HG1      VAL  79  -5.732   2.402   5.461
  601   1HG2  VAL  79          1HG2      VAL  79  -6.029   4.846   5.420
  602   2HG2  VAL  79          2HG2      VAL  79  -5.203   5.072   3.861
  603   3HG2  VAL  79          3HG2      VAL  79  -4.656   5.942   5.303
  604    H    PHE  80           H        PHE  80  -2.625   5.868   2.856
  605    HA   PHE  80           HA       PHE  80  -1.417   7.825   4.750
  606   1HB   PHE  80          1HB       PHE  80  -0.729   7.230   1.864
  607   2HB   PHE  80          2HB       PHE  80  -0.496   8.833   2.542
  608    HD1  PHE  80           HD1      PHE  80   1.472   9.362   3.706
  609    HD2  PHE  80           HD2      PHE  80   0.450   5.223   3.045
  610    HE1  PHE  80           HE1      PHE  80   3.653   8.675   4.632
  611    HE2  PHE  80           HE2      PHE  80   2.681   4.549   3.919
  612    HZ   PHE  80           HZ       PHE  80   4.243   6.247   4.791
  613    H    LYS  81           HN       LYS  81  -2.235   9.824   4.667
  614    HA   LYS  81           HA       LYS  81  -4.684  10.262   2.979
  615   1HB   LYS  81          2HB       LYS  81  -6.022  10.784   4.822
  616   2HB   LYS  81          1HB       LYS  81  -5.196   9.301   5.289
  617   1HG   LYS  81          1HG       LYS  81  -4.783  12.127   6.301
  618   2HG   LYS  81          2HG       LYS  81  -5.215  10.672   7.196
  619   1HD   LYS  81          1HD       LYS  81  -2.854   9.788   6.656
  620   2HD   LYS  81          2HD       LYS  81  -2.497  11.398   6.008
  621   1HE   LYS  81          1HE       LYS  81  -1.683  11.439   8.214
  622   2HE   LYS  81          2HE       LYS  81  -3.178  12.389   8.238
  623   1HZ   LYS  81          1HZ       LYS  81  -3.076  10.930  10.085
  624   2HZ   LYS  81          2HZ       LYS  81  -2.771   9.625   9.132
  625   3HZ   LYS  81          3HZ       LYS  81  -4.258  10.356   9.086
  626    H    GLY  82           H        GLY  82  -1.730  11.273   3.326
  627   1HA   GLY  82          1HA       GLY  82  -1.863  13.756   2.349
  628   2HA   GLY  82          2HA       GLY  82  -1.916  14.024   4.111
  629    H    GLY  83           H        GLY  83   0.330  14.872   4.012
  630   1HA   GLY  83          2HA       GLY  83   2.513  13.319   3.049
  631   2HA   GLY  83          1HA       GLY  83   2.598  14.695   4.146
  632    H    LYS  84           HN       LYS  84   0.741  11.852   5.125
  633    HA   LYS  84           HA       LYS  84   2.846  10.609   6.616
  634   1HB   LYS  84          1HB       LYS  84   0.632  12.029   8.167
  635   2HB   LYS  84          2HB       LYS  84   1.794  10.884   8.838
  636   1HG   LYS  84          1HG       LYS  84   3.649  12.436   8.146
  637   2HG   LYS  84          2HG       LYS  84   2.414  13.645   7.732
  638   1HD   LYS  84          2HD       LYS  84   1.518  13.511  10.057
  639   2HD   LYS  84          1HD       LYS  84   2.815  12.384  10.485
  640   1HE   LYS  84          1HE       LYS  84   3.186  15.259   9.505
  641   2HE   LYS  84          2HE       LYS  84   3.339  14.704  11.179
  642   1HZ   LYS  84          1HZ       LYS  84   5.457  14.886  10.144
  643   2HZ   LYS  84          2HZ       LYS  84   5.028  13.858   8.932
  644   3HZ   LYS  84          3HZ       LYS  84   5.152  13.302  10.479
  645    H    LYS  85           HN       LYS  85   1.984   8.783   7.797
  646    HA   LYS  85           HA       LYS  85  -0.039   7.396   6.237
  647   1HB   LYS  85          2HB       LYS  85   0.568   5.458   7.392
  648   2HB   LYS  85          1HB       LYS  85   2.049   6.286   6.932
  649   1HG   LYS  85          2HG       LYS  85   2.384   7.104   9.202
  650   2HG   LYS  85          1HG       LYS  85   0.840   6.457   9.745
  651   1HD   LYS  85          1HD       LYS  85   3.159   4.791   8.674
  652   2HD   LYS  85          2HD       LYS  85   2.785   5.039  10.384
  653   1HE   LYS  85          2HE       LYS  85   1.046   3.570   8.339
  654   2HE   LYS  85          1HE       LYS  85   1.955   2.878   9.674
  655   1HZ   LYS  85          1HZ       LYS  85  -0.317   4.710   9.946
  656   2HZ   LYS  85          2HZ       LYS  85   0.561   4.092  11.195
  657   3HZ   LYS  85          3HZ       LYS  85  -0.326   3.093  10.232
  658    H    CYS  86           H        CYS  86  -1.528   5.940   7.703
  659    HA   CYS  86           HA       CYS  86  -2.689   7.444  10.026
  660   1HB   CYS  86          2HB       CYS  86  -4.022   8.008   8.020
  661   2HB   CYS  86          1HB       CYS  86  -4.255   6.298   7.657
  662    HG   CYS  86           HG       CYS  86  -4.975   7.782  10.517
  663    H    GLU  87           HN       GLU  87  -3.261   4.530   8.097
  664    HA   GLU  87           HA       GLU  87  -3.108   2.802  10.544
  665   1HB   GLU  87          2HB       GLU  87  -5.007   2.747   8.158
  666   2HB   GLU  87          1HB       GLU  87  -4.787   1.368   9.228
  667   1HG   GLU  87          1HG       GLU  87  -5.581   4.131  10.258
  668   2HG   GLU  87          2HG       GLU  87  -6.754   2.932   9.755
  669    H    THR  88           H        THR  88  -2.718   0.424   9.870
  670    HA   THR  88           HA       THR  88  -1.344  -0.006   7.424
  671    HB   THR  88           HB       THR  88   0.498   1.088   8.613
  672    HG1  THR  88           HG1      THR  88   0.918  -0.936   7.478
  673   1HG2  THR  88          1HG2      THR  88  -0.282   0.814  10.959
  674   2HG2  THR  88          2HG2      THR  88   0.043  -0.930  10.863
  675   3HG2  THR  88          3HG2      THR  88   1.377   0.230  10.760
  676    H    ILE  89           H        ILE  89  -0.847  -2.283   7.110
  677    HA   ILE  89           HA       ILE  89  -2.109  -4.137   9.036
  678    HB   ILE  89           HB       ILE  89  -2.716  -4.645   6.142
  679   1HG1  ILE  89          1HG1      ILE  89  -4.332  -2.517   7.587
  680   2HG1  ILE  89          2HG1      ILE  89  -3.200  -2.246   6.248
  681   1HG2  ILE  89          1HG2      ILE  89  -3.380  -6.128   8.051
  682   2HG2  ILE  89          2HG2      ILE  89  -4.761  -5.588   7.106
  683   3HG2  ILE  89          3HG2      ILE  89  -4.412  -4.825   8.673
  684   1HD1  ILE  89          1HD1      ILE  89  -5.432  -2.296   5.361
  685   2HD1  ILE  89          2HD1      ILE  89  -5.710  -3.921   5.999
  686   3HD1  ILE  89          3HD1      ILE  89  -4.484  -3.662   4.744
  687    H    ILE  90           H        ILE  90  -1.334  -6.282   8.717
  688    HA   ILE  90           HA       ILE  90   1.283  -6.493   7.320
  689    HB   ILE  90           HB       ILE  90  -0.306  -8.491   8.998
  690   1HG1  ILE  90          2HG1      ILE  90   2.293  -6.976   9.566
  691   2HG1  ILE  90          1HG1      ILE  90   0.712  -6.554  10.233
  692   1HG2  ILE  90          1HG2      ILE  90   1.036  -9.621   7.228
  693   2HG2  ILE  90          2HG2      ILE  90   2.478  -8.728   7.753
  694   3HG2  ILE  90          3HG2      ILE  90   1.712  -9.927   8.818
  695   1HD1  ILE  90          1HD1      ILE  90   0.592  -8.814  11.315
  696   2HD1  ILE  90          2HD1      ILE  90   1.893  -7.765  11.912
  697   3HD1  ILE  90          3HD1      ILE  90   2.278  -9.093  10.811
  698    H    GLY  91           H        GLY  91   1.191  -7.016   5.165
  699   1HA   GLY  91          1HA       GLY  91  -1.289  -7.218   3.843
  700   2HA   GLY  91          2HA       GLY  91   0.256  -7.564   3.090
  701    H    ALA  92           H        ALA  92   0.866  -9.854   4.889
  702    HA   ALA  92           HA       ALA  92  -0.373 -11.953   3.448
  703   1HB   ALA  92          1HB       ALA  92   0.874 -13.386   4.990
  704   2HB   ALA  92          2HB       ALA  92   1.122 -12.026   6.106
  705   3HB   ALA  92          3HB       ALA  92   1.882 -12.009   4.507
  706    H    VAL  93           H        VAL  93  -2.703 -11.029   3.942
  707    HA   VAL  93           HA       VAL  93  -3.911 -12.874   5.862
  708    HB   VAL  93           HB       VAL  93  -5.456 -11.137   6.697
  709   1HG1  VAL  93          1HG2      VAL  93  -5.320  -9.478   4.894
  710   2HG1  VAL  93          2HG2      VAL  93  -3.632  -9.127   5.313
  711   3HG1  VAL  93          3HG2      VAL  93  -4.933  -8.738   6.451
  712   1HG2  VAL  93          1HG1      VAL  93  -3.447 -11.749   8.019
  713   2HG2  VAL  93          2HG1      VAL  93  -2.572 -10.381   7.292
  714   3HG2  VAL  93          3HG1      VAL  93  -3.994 -10.088   8.304
  715    HA   PRO  94           HA       PRO  94  -6.505 -13.512   2.374
  716   1HB   PRO  94          1HB       PRO  94  -8.906 -13.287   4.189
  717   2HB   PRO  94          2HB       PRO  94  -8.548 -14.556   2.984
  718   1HG   PRO  94          2HG       PRO  94  -8.115 -15.035   5.620
  719   2HG   PRO  94          1HG       PRO  94  -6.893 -15.535   4.413
  720   1HD   PRO  94          2HD       PRO  94  -6.858 -13.093   6.196
  721   2HD   PRO  94          1HD       PRO  94  -5.553 -14.240   5.789
  722    H    LYS  95           HN       LYS  95  -7.928 -12.553   0.876
  723    HA   LYS  95           HA       LYS  95  -8.012  -9.789   0.632
  724   1HB   LYS  95          2HB       LYS  95  -8.419 -11.425  -1.216
  725   2HB   LYS  95          1HB       LYS  95  -9.984 -11.835  -0.496
  726   1HG   LYS  95          1HG       LYS  95 -10.709  -9.449  -0.767
  727   2HG   LYS  95          2HG       LYS  95  -9.162  -9.082  -1.545
  728   1HD   LYS  95          2HD       LYS  95  -9.722 -10.659  -3.378
  729   2HD   LYS  95          1HD       LYS  95 -11.207 -11.134  -2.524
  730   1HE   LYS  95          2HE       LYS  95 -11.995  -8.743  -2.627
  731   2HE   LYS  95          1HE       LYS  95 -10.558  -8.342  -3.585
  732   1HZ   LYS  95          1HZ       LYS  95 -12.468  -8.734  -4.919
  733   2HZ   LYS  95          2HZ       LYS  95 -11.318  -9.876  -5.240
  734   3HZ   LYS  95          3HZ       LYS  95 -12.647 -10.269  -4.337
  735    H    ALA  96           H        ALA  96 -10.432 -12.000   2.000
  736    HA   ALA  96           HA       ALA  96 -12.548 -10.203   2.496
  737   1HB   ALA  96          1HB       ALA  96 -11.605 -12.548   4.216
  738   2HB   ALA  96          2HB       ALA  96 -13.197 -11.765   4.305
  739   3HB   ALA  96          3HB       ALA  96 -12.723 -12.640   2.837
  740    H    THR  97           H        THR  97  -9.675 -10.961   4.559
  741    HA   THR  97           HA       THR  97 -10.372  -9.215   6.690
  742    HB   THR  97           HB       THR  97  -7.569 -10.048   5.828
  743    HG1  THR  97           HG1      THR  97  -9.555 -11.524   7.220
  744   1HG2  THR  97          1HG2      THR  97  -7.702  -8.500   7.758
  745   2HG2  THR  97          2HG2      THR  97  -8.853  -9.586   8.564
  746   3HG2  THR  97          3HG2      THR  97  -7.184 -10.115   8.272
  747    H    ILE  98           H        ILE  98  -8.293  -8.829   3.765
  748    HA   ILE  98           HA       ILE  98  -7.458  -6.160   4.272
  749    HB   ILE  98           HB       ILE  98  -8.012  -7.559   1.605
  750   1HG1  ILE  98          1HG1      ILE  98  -6.282  -8.700   2.907
  751   2HG1  ILE  98          2HG1      ILE  98  -5.645  -7.933   1.464
  752   1HG2  ILE  98          1HG2      ILE  98  -8.020  -5.181   1.189
  753   2HG2  ILE  98          2HG2      ILE  98  -6.608  -4.922   2.223
  754   3HG2  ILE  98          3HG2      ILE  98  -6.446  -5.801   0.686
  755   1HD1  ILE  98          1HD1      ILE  98  -4.746  -6.062   2.847
  756   2HD1  ILE  98          2HD1      ILE  98  -5.340  -6.880   4.311
  757   3HD1  ILE  98          3HD1      ILE  98  -4.101  -7.642   3.304
  758    H    VAL  99           H        VAL  99 -10.281  -7.254   2.338
  759    HA   VAL  99           HA       VAL  99 -11.448  -4.791   1.745
  760    HB   VAL  99           HB       VAL  99 -12.599  -7.559   2.271
  761   1HG1  VAL  99          1HG2      VAL  99 -14.468  -6.072   2.774
  762   2HG1  VAL  99          2HG2      VAL  99 -14.134  -5.113   1.316
  763   3HG1  VAL  99          3HG2      VAL  99 -14.700  -6.787   1.179
  764   1HG2  VAL  99          1HG1      VAL  99 -12.854  -7.602  -0.156
  765   2HG2  VAL  99          2HG1      VAL  99 -12.311  -5.916  -0.281
  766   3HG2  VAL  99          3HG1      VAL  99 -11.180  -7.180   0.234
  767    H    GLN 100           H        GLN 100 -12.248  -6.898   4.585
  768    HA   GLN 100           HA       GLN 100 -14.011  -5.056   5.791
  769   1HB   GLN 100          2HB       GLN 100 -12.174  -7.204   6.940
  770   2HB   GLN 100          1HB       GLN 100 -13.299  -6.314   7.954
  771   1HG   GLN 100          2HG       GLN 100 -14.047  -8.016   5.522
  772   2HG   GLN 100          1HG       GLN 100 -14.243  -8.483   7.215
  773   1HE2  GLN 100          1HE2      GLN 100 -15.192  -5.751   8.062
  774   2HE2  GLN 100          2HE2      GLN 100 -16.824  -5.661   7.419
  775    H    THR 101           H        THR 101 -10.495  -5.405   6.274
  776    HA   THR 101           HA       THR 101 -10.258  -3.359   8.248
  777    HB   THR 101           HB       THR 101  -8.156  -4.326   6.261
  778    HG1  THR 101           HG1      THR 101  -8.991  -6.045   7.409
  779   1HG2  THR 101          1HG2      THR 101  -7.387  -2.337   7.439
  780   2HG2  THR 101          2HG2      THR 101  -6.620  -3.744   8.193
  781   3HG2  THR 101          3HG2      THR 101  -7.990  -2.960   8.992
  782    H    VAL 102           H        VAL 102 -10.153  -3.185   4.635
  783    HA   VAL 102           HA       VAL 102  -9.452  -0.380   4.585
  784    HB   VAL 102           HB       VAL 102 -10.806  -2.229   2.569
  785   1HG1  VAL 102          1HG1      VAL 102  -8.671  -2.105   1.412
  786   2HG1  VAL 102          2HG1      VAL 102  -8.056  -0.921   2.588
  787   3HG1  VAL 102          3HG1      VAL 102  -8.355  -2.593   3.085
  788   1HG2  VAL 102          1HG2      VAL 102 -11.613   0.007   2.042
  789   2HG2  VAL 102          2HG2      VAL 102  -9.981   0.687   2.240
  790   3HG2  VAL 102          3HG2      VAL 102 -10.338  -0.418   0.897
  791    H    GLU 103           HN       GLU 103 -12.552  -2.105   4.263
  792    HA   GLU 103           HA       GLU 103 -14.306  -0.018   3.955
  793   1HB   GLU 103          2HB       GLU 103 -14.563  -2.656   5.446
  794   2HB   GLU 103          1HB       GLU 103 -15.921  -1.557   5.279
  795   1HG   GLU 103          2HG       GLU 103 -14.323  -2.632   2.915
  796   2HG   GLU 103          1HG       GLU 103 -15.815  -3.370   3.521
  797    H    LYS 104           HN       LYS 104 -13.413  -1.361   7.150
  798    HA   LYS 104           HA       LYS 104 -14.893   0.455   8.691
  799   1HB   LYS 104          2HB       LYS 104 -13.290  -0.002  10.523
  800   2HB   LYS 104          1HB       LYS 104 -13.850  -1.470   9.716
  801   1HG   LYS 104          2HG       LYS 104 -11.788  -1.856   8.725
  802   2HG   LYS 104          1HG       LYS 104 -11.283  -0.172   8.797
  803   1HD   LYS 104          2HD       LYS 104  -9.961  -1.427  10.318
  804   2HD   LYS 104          1HD       LYS 104 -10.976  -0.277  11.202
  805   1HE   LYS 104          2HE       LYS 104 -12.560  -2.117  11.780
  806   2HE   LYS 104          1HE       LYS 104 -11.593  -3.259  10.826
  807   1HZ   LYS 104          1HZ       LYS 104 -10.674  -1.811  13.209
  808   2HZ   LYS 104          2HZ       LYS 104 -11.106  -3.400  13.147
  809   3HZ   LYS 104          3HZ       LYS 104  -9.778  -2.877  12.325
  810    H    TYR 105           H        TYR 105 -11.909   1.214   6.925
  811    HA   TYR 105           HA       TYR 105 -11.405   3.633   8.551
  812   1HB   TYR 105          1HB       TYR 105 -10.111   2.782   5.948
  813   2HB   TYR 105          2HB       TYR 105  -9.512   3.931   7.147
  814    HD1  TYR 105           HD1      TYR 105  -8.087   1.500   5.878
  815    HD2  TYR 105           HD2      TYR 105 -10.017   2.213   9.672
  816    HE1  TYR 105           HE1      TYR 105  -6.477  -0.018   6.995
  817    HE2  TYR 105           HE2      TYR 105  -8.452   0.656  10.760
  818    HH   TYR 105           HH       TYR 105  -6.288  -0.259  10.473
  819    H    LEU 106           H        LEU 106 -13.274   2.693   5.778
  820    HA   LEU 106           HA       LEU 106 -13.437   5.462   4.715
  821   1HB   LEU 106          2HB       LEU 106 -14.532   2.835   3.644
  822   2HB   LEU 106          1HB       LEU 106 -14.585   4.400   2.829
  823    HG   LEU 106           HG       LEU 106 -12.054   2.824   3.497
  824   1HD1  LEU 106          1HD2      LEU 106 -11.532   5.217   3.513
  825   2HD1  LEU 106          2HD2      LEU 106 -10.923   4.496   2.021
  826   3HD1  LEU 106          3HD2      LEU 106 -12.419   5.452   1.989
  827   1HD2  LEU 106          1HD1      LEU 106 -13.425   1.816   1.710
  828   2HD2  LEU 106          2HD1      LEU 106 -11.911   2.483   1.070
  829   3HD2  LEU 106          3HD1      LEU 106 -13.436   3.364   0.837
  830    H    ASN 107           H        ASN 107 -15.411   2.871   6.190
  831    HA   ASN 107           HA       ASN 107 -17.391   4.775   7.114
  832   1HB   ASN 107          1HB       ASN 107 -19.271   3.511   5.953
  833   2HB   ASN 107          2HB       ASN 107 -18.332   4.615   4.953
  834   1HD2  ASN 107          1HD2      ASN 107 -17.226   1.293   5.844
  835   2HD2  ASN 107          2HD2      ASN 107 -17.345   0.670   4.185
  Start of MODEL   26
    1   1H    MET   1          1H        MET   1   0.464  -2.593 -11.929
    2   2H    MET   1          2H        MET   1  -0.978  -2.752 -11.117
    3   3H    MET   1          3H        MET   1  -0.301  -1.282 -11.240
    4    HA   MET   1           HA       MET   1  -0.568  -1.316 -13.634
    5   1HB   MET   1          2HB       MET   1  -0.619  -3.713 -13.998
    6   2HB   MET   1          1HB       MET   1  -2.042  -3.920 -12.980
    7   1HG   MET   1          1HG       MET   1  -2.608  -4.014 -15.368
    8   2HG   MET   1          2HG       MET   1  -3.416  -2.662 -14.595
    9   1HE   MET   1          1HE       MET   1  -3.514  -2.724 -17.589
   10   2HE   MET   1          2HE       MET   1  -4.031  -1.297 -16.655
   11   3HE   MET   1          3HE       MET   1  -2.955  -1.101 -18.057
   12    H    GLU   2           HN       GLU   2  -3.498  -2.711 -11.995
   13    HA   GLU   2           HA       GLU   2  -4.937  -0.224 -12.349
   14   1HB   GLU   2          2HB       GLU   2  -5.495  -2.567 -10.483
   15   2HB   GLU   2          1HB       GLU   2  -6.619  -1.271 -10.920
   16   1HG   GLU   2          2HG       GLU   2  -6.590  -1.995 -13.275
   17   2HG   GLU   2          1HG       GLU   2  -5.433  -3.278 -12.898
   18    H    ALA   3           H        ALA   3  -3.053  -1.769  -9.774
   19    HA   ALA   3           HA       ALA   3  -3.228   0.625  -8.058
   20   1HB   ALA   3          1HB       ALA   3  -3.320  -1.562  -6.965
   21   2HB   ALA   3          2HB       ALA   3  -1.759  -2.019  -7.707
   22   3HB   ALA   3          3HB       ALA   3  -1.840  -0.722  -6.507
   23    H    GLY   4           H        GLY   4  -1.416   1.864  -7.596
   24   1HA   GLY   4          2HA       GLY   4   0.487   2.458  -9.636
   25   2HA   GLY   4          1HA       GLY   4   0.469   3.087  -8.031
   26    H    ALA   5           H        ALA   5   2.816   2.562  -9.356
   27    HA   ALA   5           HA       ALA   5   4.053   0.520  -7.588
   28   1HB   ALA   5          1HB       ALA   5   4.806   1.151 -10.472
   29   2HB   ALA   5          2HB       ALA   5   4.118  -0.380  -9.871
   30   3HB   ALA   5          3HB       ALA   5   5.733   0.139  -9.342
   31    H    VAL   6           H        VAL   6   5.406   1.666  -6.233
   32    HA   VAL   6           HA       VAL   6   6.370   4.351  -7.158
   33    HB   VAL   6           HB       VAL   6   6.047   5.083  -4.726
   34   1HG1  VAL   6          1HG1      VAL   6   4.000   2.826  -4.690
   35   2HG1  VAL   6          2HG1      VAL   6   4.265   4.059  -3.442
   36   3HG1  VAL   6          3HG1      VAL   6   5.516   2.857  -3.770
   37   1HG2  VAL   6          1HG2      VAL   6   3.604   4.629  -6.461
   38   2HG2  VAL   6          2HG2      VAL   6   3.743   5.771  -5.105
   39   3HG2  VAL   6          3HG2      VAL   6   4.742   5.996  -6.554
   40    H    ASN   7           H        ASN   7   8.062   5.237  -5.907
   41    HA   ASN   7           HA       ASN   7   9.842   3.467  -4.423
   42   1HB   ASN   7          2HB       ASN   7  10.518   4.638  -7.149
   43   2HB   ASN   7          1HB       ASN   7  11.775   4.294  -5.983
   44   1HD2  ASN   7          2HD2      ASN   7  11.590   2.053  -4.874
   45   2HD2  ASN   7          1HD2      ASN   7  11.299   0.715  -5.955
   46    H    ASP   8           HN       ASP   8  11.806   4.890  -3.806
   47    HA   ASP   8           HA       ASP   8  10.631   7.224  -2.503
   48   1HB   ASP   8          1HB       ASP   8  12.588   7.495  -1.362
   49   2HB   ASP   8          2HB       ASP   8  11.822   5.889  -1.305
   50    H    ASP   9           HN       ASP   9  10.217   8.055  -4.108
   51    HA   ASP   9           HA       ASP   9  11.238  10.588  -4.876
   52   1HB   ASP   9          1HB       ASP   9  12.809   9.409  -6.259
   53   2HB   ASP   9          2HB       ASP   9  11.572   8.426  -7.023
   54    H    THR  10           H        THR  10   9.577   8.181  -6.948
   55    HA   THR  10           HA       THR  10   7.413   9.774  -7.702
   56    HB   THR  10           HB       THR  10   6.362   7.536  -8.260
   57    HG1  THR  10           HG1      THR  10   7.878   5.762  -7.957
   58   1HG2  THR  10          1HG2      THR  10   7.963   8.684  -9.807
   59   2HG2  THR  10          2HG2      THR  10   9.310   7.817  -9.047
   60   3HG2  THR  10          3HG2      THR  10   8.063   6.917  -9.924
   61    H    PHE  11           H        PHE  11   7.770   7.607  -4.933
   62    HA   PHE  11           HA       PHE  11   5.308   7.468  -3.762
   63   1HB   PHE  11          1HB       PHE  11   7.554   6.657  -2.945
   64   2HB   PHE  11          2HB       PHE  11   7.867   8.238  -2.296
   65    HD1  PHE  11           HD1      PHE  11   6.210   9.133  -0.460
   66    HD2  PHE  11           HD2      PHE  11   6.498   4.996  -1.662
   67    HE1  PHE  11           HE1      PHE  11   5.310   8.423   1.730
   68    HE2  PHE  11           HE2      PHE  11   5.788   4.298   0.599
   69    HZ   PHE  11           HZ       PHE  11   5.182   6.008   2.299
   70    H    LYS  12           HN       LYS  12   7.516  10.221  -3.676
   71    HA   LYS  12           HA       LYS  12   6.143  11.867  -1.782
   72   1HB   LYS  12          2HB       LYS  12   7.791  12.722  -4.201
   73   2HB   LYS  12          1HB       LYS  12   7.343  13.749  -2.844
   74   1HG   LYS  12          2HG       LYS  12   8.660  12.413  -1.289
   75   2HG   LYS  12          1HG       LYS  12   9.002  11.199  -2.535
   76   1HD   LYS  12          1HD       LYS  12  10.182  12.894  -3.899
   77   2HD   LYS  12          2HD       LYS  12   9.916  14.101  -2.623
   78   1HE   LYS  12          1HE       LYS  12  11.209  12.710  -1.026
   79   2HE   LYS  12          2HE       LYS  12  11.424  11.459  -2.267
   80   1HZ   LYS  12          1HZ       LYS  12  12.447  14.204  -2.426
   81   2HZ   LYS  12          2HZ       LYS  12  13.331  12.854  -2.093
   82   3HZ   LYS  12          3HZ       LYS  12  12.636  13.036  -3.574
   83    H    ASN  13           H        ASN  13   5.913  11.740  -5.362
   84    HA   ASN  13           HA       ASN  13   3.865  13.770  -5.513
   85   1HB   ASN  13          1HB       ASN  13   4.632  11.658  -7.565
   86   2HB   ASN  13          2HB       ASN  13   3.786  13.178  -7.848
   87   1HD2  ASN  13          2HD2      ASN  13   5.442  15.015  -6.304
   88   2HD2  ASN  13          1HD2      ASN  13   6.994  15.023  -7.119
   89    H    VAL  14           H        VAL  14   3.899  10.246  -5.895
   90    HA   VAL  14           HA       VAL  14   1.115   9.992  -6.488
   91    HB   VAL  14           HB       VAL  14   3.312   8.049  -5.660
   92   1HG1  VAL  14          1HG1      VAL  14   3.670   9.207  -7.845
   93   2HG1  VAL  14          2HG1      VAL  14   3.330   7.490  -8.074
   94   3HG1  VAL  14          3HG1      VAL  14   2.058   8.689  -8.371
   95   1HG2  VAL  14          1HG2      VAL  14   0.510   7.467  -6.671
   96   2HG2  VAL  14          2HG2      VAL  14   1.838   6.290  -6.685
   97   3HG2  VAL  14          3HG2      VAL  14   1.250   6.925  -5.140
   98    H    VAL  15           H        VAL  15   2.941   9.460  -3.442
   99    HA   VAL  15           HA       VAL  15   0.458   8.632  -2.064
  100    HB   VAL  15           HB       VAL  15   3.302   8.738  -0.975
  101   1HG1  VAL  15          1HG1      VAL  15   2.472   7.177   0.671
  102   2HG1  VAL  15          2HG1      VAL  15   0.846   7.226  -0.056
  103   3HG1  VAL  15          3HG1      VAL  15   1.530   8.666   0.728
  104   1HG2  VAL  15          1HG2      VAL  15   3.265   7.242  -2.943
  105   2HG2  VAL  15          2HG2      VAL  15   1.842   6.418  -2.297
  106   3HG2  VAL  15          3HG2      VAL  15   3.404   6.324  -1.445
  107    H    LEU  16           H        LEU  16   3.178  10.954  -1.446
  108    HA   LEU  16           HA       LEU  16   1.698  12.102   0.748
  109   1HB   LEU  16          1HB       LEU  16   4.119  13.293  -0.650
  110   2HB   LEU  16          2HB       LEU  16   3.458  13.744   0.910
  111    HG   LEU  16           HG       LEU  16   4.674  11.031   0.203
  112   1HD1  LEU  16          1HD1      LEU  16   6.483  11.719   1.697
  113   2HD1  LEU  16          2HD1      LEU  16   5.667  13.266   2.016
  114   3HD1  LEU  16          3HD1      LEU  16   6.293  12.907   0.394
  115   1HD2  LEU  16          1HD2      LEU  16   4.546  10.635   2.694
  116   2HD2  LEU  16          2HD2      LEU  16   2.968  10.651   1.906
  117   3HD2  LEU  16          3HD2      LEU  16   3.514  12.070   2.830
  118    H    GLU  17           HN       GLU  17   2.533  13.501  -2.478
  119    HA   GLU  17           HA       GLU  17   0.657  15.712  -2.038
  120   1HB   GLU  17          1HB       GLU  17   2.126  14.868  -4.558
  121   2HB   GLU  17          2HB       GLU  17   1.334  16.416  -4.269
  122   1HG   GLU  17          1HG       GLU  17   2.915  16.925  -2.441
  123   2HG   GLU  17          2HG       GLU  17   3.748  15.388  -2.696
  124    H    SER  18           H        SER  18  -0.802  13.388  -1.720
  125    HA   SER  18           HA       SER  18  -2.294  12.901  -4.258
  126   1HB   SER  18          2HB       SER  18  -1.637  10.952  -2.841
  127   2HB   SER  18          1HB       SER  18  -2.628  11.605  -1.521
  128    HG   SER  18           HG       SER  18  -4.140  10.437  -2.530
  129    H    SER  19           H        SER  19  -4.718  12.495  -3.414
  130    HA   SER  19           HA       SER  19  -5.790  14.986  -2.125
  131   1HB   SER  19          1HB       SER  19  -7.742  14.674  -3.738
  132   2HB   SER  19          2HB       SER  19  -6.241  15.272  -4.466
  133    HG   SER  19           HG       SER  19  -5.821  13.256  -5.282
  134    H    VAL  20           H        VAL  20  -7.106  12.008  -3.481
  135    HA   VAL  20           HA       VAL  20  -8.549  11.332  -1.029
  136    HB   VAL  20           HB       VAL  20  -9.345   9.399  -2.294
  137   1HG1  VAL  20          1HG2      VAL  20  -8.709   8.994  -4.621
  138   2HG1  VAL  20          2HG2      VAL  20  -7.319   8.775  -3.554
  139   3HG1  VAL  20          3HG2      VAL  20  -7.460  10.248  -4.537
  140   1HG2  VAL  20          1HG1      VAL  20 -10.408  11.617  -2.612
  141   2HG2  VAL  20          2HG1      VAL  20 -10.538  10.587  -4.046
  142   3HG2  VAL  20          3HG1      VAL  20  -9.364  11.911  -4.020
  143    HA   PRO  21           HA       PRO  21  -5.522   8.927   0.927
  144   1HB   PRO  21          1HB       PRO  21  -7.410   6.580   1.074
  145   2HB   PRO  21          2HB       PRO  21  -6.435   7.282   2.391
  146   1HG   PRO  21          2HG       PRO  21  -9.059   7.813   2.163
  147   2HG   PRO  21          1HG       PRO  21  -7.931   9.126   2.607
  148   1HD   PRO  21          1HD       PRO  21  -9.233   8.628  -0.075
  149   2HD   PRO  21          2HD       PRO  21  -8.859  10.156   0.763
  150    H    VAL  22           H        VAL  22  -4.175   7.050   0.832
  151    HA   VAL  22           HA       VAL  22  -4.130   5.605  -1.775
  152    HB   VAL  22           HB       VAL  22  -1.741   7.029  -0.548
  153   1HG1  VAL  22          1HG1      VAL  22  -1.188   5.004  -1.904
  154   2HG1  VAL  22          2HG1      VAL  22  -2.112   5.671  -3.256
  155   3HG1  VAL  22          3HG1      VAL  22  -0.654   6.497  -2.688
  156   1HG2  VAL  22          1HG2      VAL  22  -3.602   7.847  -2.816
  157   2HG2  VAL  22          2HG2      VAL  22  -1.975   8.512  -2.598
  158   3HG2  VAL  22          3HG2      VAL  22  -3.203   8.753  -1.348
  159    H    LEU  23           H        LEU  23  -4.093   3.504  -1.340
  160    HA   LEU  23           HA       LEU  23  -3.067   2.405   1.184
  161   1HB   LEU  23          2HB       LEU  23  -5.166   1.673   0.020
  162   2HB   LEU  23          1HB       LEU  23  -4.196   0.972  -1.258
  163    HG   LEU  23           HG       LEU  23  -4.078   0.174   1.685
  164   1HD1  LEU  23          1HD2      LEU  23  -2.691  -0.966  -0.788
  165   2HD1  LEU  23          2HD2      LEU  23  -2.903  -1.881   0.711
  166   3HD1  LEU  23          3HD2      LEU  23  -1.934  -0.408   0.726
  167   1HD2  LEU  23          1HD1      LEU  23  -5.285  -1.830   0.948
  168   2HD2  LEU  23          2HD1      LEU  23  -6.211  -0.375   0.531
  169   3HD2  LEU  23          3HD1      LEU  23  -5.299  -1.235  -0.728
  170    H    VAL  24           H        VAL  24  -0.815   2.370   1.217
  171    HA   VAL  24           HA       VAL  24   0.692   1.766  -1.305
  172    HB   VAL  24           HB       VAL  24   1.603   2.968   1.331
  173   1HG1  VAL  24          1HG1      VAL  24   3.714   3.412   0.099
  174   2HG1  VAL  24          2HG1      VAL  24   3.111   2.479  -1.282
  175   3HG1  VAL  24          3HG1      VAL  24   3.429   1.678   0.270
  176   1HG2  VAL  24          1HG2      VAL  24   1.314   4.247  -1.423
  177   2HG2  VAL  24          2HG2      VAL  24   1.900   5.020   0.044
  178   3HG2  VAL  24          3HG2      VAL  24   0.205   4.520  -0.071
  179    H    ASP  25           HN       ASP  25   1.204  -0.328  -1.549
  180    HA   ASP  25           HA       ASP  25   1.486  -2.065   0.877
  181   1HB   ASP  25          2HB       ASP  25   0.038  -2.965  -0.828
  182   2HB   ASP  25          1HB       ASP  25   1.287  -2.734  -2.059
  183    H    PHE  26           H        PHE  26   3.536  -2.046   1.766
  184    HA   PHE  26           HA       PHE  26   5.874  -1.553   0.025
  185   1HB   PHE  26          2HB       PHE  26   5.534  -2.164   2.966
  186   2HB   PHE  26          1HB       PHE  26   7.097  -2.119   2.167
  187    HD1  PHE  26           HD1      PHE  26   8.286  -0.123   2.063
  188    HD2  PHE  26           HD2      PHE  26   4.007   0.045   2.577
  189    HE1  PHE  26           HE1      PHE  26   8.432   2.304   2.483
  190    HE2  PHE  26           HE2      PHE  26   4.157   2.475   2.974
  191    HZ   PHE  26           HZ       PHE  26   6.379   3.583   3.116
  192    H    TRP  27           H        TRP  27   6.514  -3.150  -1.279
  193    HA   TRP  27           HA       TRP  27   6.235  -5.993  -0.398
  194   1HB   TRP  27          1HB       TRP  27   5.459  -6.589  -2.575
  195   2HB   TRP  27          2HB       TRP  27   4.481  -5.224  -2.094
  196    HD1  TRP  27           HD1      TRP  27   5.518  -2.814  -3.208
  197    HE1  TRP  27           HE1      TRP  27   6.665  -2.364  -5.484
  198    HE3  TRP  27           HE3      TRP  27   6.466  -7.648  -4.607
  199    HZ2  TRP  27           HZ2      TRP  27   8.058  -3.922  -7.475
  200    HZ3  TRP  27           HZ3      TRP  27   7.625  -8.113  -6.720
  201    HH2  TRP  27           HH2      TRP  27   8.397  -6.269  -8.181
  202    H    ALA  28           H        ALA  28   7.391  -7.309  -2.307
  203    HA   ALA  28           HA       ALA  28   9.617  -6.151  -3.589
  204   1HB   ALA  28          1HB       ALA  28  11.456  -7.355  -2.451
  205   2HB   ALA  28          2HB       ALA  28  10.694  -6.208  -1.339
  206   3HB   ALA  28          3HB       ALA  28  10.322  -7.954  -1.231
  207    HA   PRO  29           HA       PRO  29   8.752  -9.836  -5.913
  208   1HB   PRO  29          1HB       PRO  29  11.284 -10.551  -6.868
  209   2HB   PRO  29          2HB       PRO  29  10.172  -9.336  -7.579
  210   1HG   PRO  29          2HG       PRO  29  12.472  -8.856  -5.660
  211   2HG   PRO  29          1HG       PRO  29  12.089  -7.957  -7.161
  212   1HD   PRO  29          2HD       PRO  29  11.301  -6.896  -4.835
  213   2HD   PRO  29          1HD       PRO  29  10.137  -6.995  -6.145
  214    H    TRP  30           H        TRP  30  11.537 -10.150  -3.657
  215    HA   TRP  30           HA       TRP  30  11.286 -13.053  -3.549
  216   1HB   TRP  30          1HB       TRP  30  12.893 -12.815  -1.666
  217   2HB   TRP  30          2HB       TRP  30  13.421 -12.091  -3.178
  218    HD1  TRP  30           HD1      TRP  30  14.221  -9.693  -3.106
  219    HE1  TRP  30           HE1      TRP  30  14.298  -7.793  -1.396
  220    HE3  TRP  30           HE3      TRP  30  11.458 -11.854   0.642
  221    HZ2  TRP  30           HZ2      TRP  30  13.153  -7.209   1.187
  222    HZ3  TRP  30           HZ3      TRP  30  10.882 -10.557   2.661
  223    HH2  TRP  30           HH2      TRP  30  11.666  -8.218   2.921
  224    H    CYS  31           H        CYS  31   9.332 -10.563  -2.205
  225    HA   CYS  31           HA       CYS  31   8.964 -11.853   0.421
  226   1HB   CYS  31          2HB       CYS  31   8.853  -9.505   0.399
  227   2HB   CYS  31          1HB       CYS  31   7.687  -9.488  -0.922
  228    H    GLY  32           H        GLY  32   8.188 -13.862   0.130
  229   1HA   GLY  32          1HA       GLY  32   6.470 -15.039  -1.544
  230   2HA   GLY  32          2HA       GLY  32   6.483 -15.429   0.174
  231    HA   PRO  33           HA       PRO  33   2.367 -14.052   0.718
  232   1HB   PRO  33          2HB       PRO  33   3.011 -11.643   2.356
  233   2HB   PRO  33          1HB       PRO  33   1.908 -12.993   2.718
  234   1HG   PRO  33          1HG       PRO  33   4.329 -12.771   3.915
  235   2HG   PRO  33          2HG       PRO  33   3.690 -14.372   3.424
  236   1HD   PRO  33          1HD       PRO  33   5.774 -12.723   1.993
  237   2HD   PRO  33          2HD       PRO  33   5.691 -14.491   2.219
  238    H    CYS  34           H        CYS  34   4.521 -11.268   0.285
  239    HA   CYS  34           HA       CYS  34   2.725  -9.364  -0.729
  240   1HB   CYS  34          2HB       CYS  34   5.573  -9.620  -1.708
  241   2HB   CYS  34          1HB       CYS  34   4.480  -8.255  -1.732
  242    H    ARG  35           HN       ARG  35   4.764 -11.767  -2.475
  243    HA   ARG  35           HA       ARG  35   3.936 -11.162  -5.098
  244   1HB   ARG  35          1HB       ARG  35   4.930 -13.700  -3.742
  245   2HB   ARG  35          2HB       ARG  35   4.566 -13.663  -5.457
  246   1HG   ARG  35          1HG       ARG  35   6.450 -11.622  -4.218
  247   2HG   ARG  35          2HG       ARG  35   7.001 -13.234  -4.673
  248   1HD   ARG  35          1HD       ARG  35   5.620 -11.299  -6.599
  249   2HD   ARG  35          2HD       ARG  35   7.358 -11.492  -6.473
  250    HE   ARG  35           HE       ARG  35   5.488 -13.250  -7.795
  251   1HH1  ARG  35          1HH2      ARG  35   8.641 -13.167  -6.156
  252   2HH1  ARG  35          2HH2      ARG  35   9.278 -14.525  -7.041
  253   1HH2  ARG  35          2HH1      ARG  35   6.315 -15.037  -8.926
  254   2HH2  ARG  35          1HH1      ARG  35   7.930 -15.617  -8.626
  255    H    ILE  36           H        ILE  36   2.493 -13.569  -2.786
  256    HA   ILE  36           HA       ILE  36   0.526 -14.270  -4.838
  257    HB   ILE  36           HB       ILE  36  -0.499 -15.727  -3.191
  258   1HG1  ILE  36          2HG1      ILE  36   0.948 -16.184  -1.085
  259   2HG1  ILE  36          1HG1      ILE  36   1.488 -14.524  -1.252
  260   1HG2  ILE  36          1HG2      ILE  36   1.376 -17.272  -3.086
  261   2HG2  ILE  36          2HG2      ILE  36   1.445 -16.383  -4.611
  262   3HG2  ILE  36          3HG2      ILE  36   2.541 -15.950  -3.282
  263   1HD1  ILE  36          1HD1      ILE  36  -1.375 -15.549  -0.888
  264   2HD1  ILE  36          2HD1      ILE  36  -0.972 -13.837  -1.082
  265   3HD1  ILE  36          3HD1      ILE  36  -0.391 -14.722   0.336
  266    H    ILE  37           H        ILE  37   0.487 -11.849  -2.181
  267    HA   ILE  37           HA       ILE  37  -2.391 -11.415  -2.687
  268    HB   ILE  37           HB       ILE  37  -2.292  -9.547  -1.210
  269   1HG1  ILE  37          1HG1      ILE  37   0.696  -9.968  -1.093
  270   2HG1  ILE  37          2HG1      ILE  37  -0.115  -8.578  -1.800
  271   1HG2  ILE  37          1HG2      ILE  37  -2.400 -11.924  -0.346
  272   2HG2  ILE  37          2HG2      ILE  37  -0.670 -11.798   0.044
  273   3HG2  ILE  37          3HG2      ILE  37  -1.846 -10.727   0.823
  274   1HD1  ILE  37          1HD1      ILE  37  -0.002  -9.341   1.130
  275   2HD1  ILE  37          2HD1      ILE  37  -1.093  -8.087   0.485
  276   3HD1  ILE  37          3HD1      ILE  37   0.668  -7.907   0.342
  277    H    ALA  38           H        ALA  38   0.626 -10.127  -3.988
  278    HA   ALA  38           HA       ALA  38   0.145  -7.722  -4.915
  279   1HB   ALA  38          1HB       ALA  38   1.329  -9.980  -6.600
  280   2HB   ALA  38          2HB       ALA  38   1.473  -8.272  -6.976
  281   3HB   ALA  38          3HB       ALA  38   2.177  -8.903  -5.481
  282    HA   PRO  39           HA       PRO  39  -2.531  -8.822  -8.772
  283   1HB   PRO  39          2HB       PRO  39  -4.022 -11.269  -7.917
  284   2HB   PRO  39          1HB       PRO  39  -3.318 -10.891  -9.510
  285   1HG   PRO  39          2HG       PRO  39  -2.163 -12.745  -7.865
  286   2HG   PRO  39          1HG       PRO  39  -1.151 -11.602  -8.801
  287   1HD   PRO  39          1HD       PRO  39  -2.085 -11.318  -5.928
  288   2HD   PRO  39          2HD       PRO  39  -0.423 -11.233  -6.552
  289    H    VAL  40           H        VAL  40  -3.538  -9.866  -5.553
  290    HA   VAL  40           HA       VAL  40  -6.265  -8.971  -5.636
  291    HB   VAL  40           HB       VAL  40  -4.558  -9.421  -3.148
  292   1HG1  VAL  40          1HG1      VAL  40  -6.661 -10.031  -2.152
  293   2HG1  VAL  40          2HG1      VAL  40  -7.506  -9.765  -3.698
  294   3HG1  VAL  40          3HG1      VAL  40  -6.761  -8.400  -2.835
  295   1HG2  VAL  40          1HG2      VAL  40  -6.030 -11.484  -4.855
  296   2HG2  VAL  40          2HG2      VAL  40  -5.417 -11.772  -3.213
  297   3HG2  VAL  40          3HG2      VAL  40  -4.284 -11.461  -4.526
  298    H    VAL  41           H        VAL  41  -3.171  -7.675  -4.329
  299    HA   VAL  41           HA       VAL  41  -4.142  -5.192  -3.362
  300    HB   VAL  41           HB       VAL  41  -1.448  -5.707  -4.705
  301   1HG1  VAL  41          1HG1      VAL  41  -0.551  -6.112  -2.477
  302   2HG1  VAL  41          2HG1      VAL  41  -2.157  -5.890  -1.747
  303   3HG1  VAL  41          3HG1      VAL  41  -1.833  -7.271  -2.800
  304   1HG2  VAL  41          1HG2      VAL  41  -2.344  -3.515  -2.776
  305   2HG2  VAL  41          2HG2      VAL  41  -0.672  -3.802  -3.279
  306   3HG2  VAL  41          3HG2      VAL  41  -1.865  -3.295  -4.470
  307    H    ASP  42           HN       ASP  42  -3.061  -6.169  -6.653
  308    HA   ASP  42           HA       ASP  42  -3.400  -3.597  -7.794
  309   1HB   ASP  42          2HB       ASP  42  -2.185  -5.637  -8.771
  310   2HB   ASP  42          1HB       ASP  42  -3.753  -6.168  -9.374
  311    H    GLU  43           HN       GLU  43  -5.606  -6.423  -8.179
  312    HA   GLU  43           HA       GLU  43  -7.621  -4.973  -9.508
  313   1HB   GLU  43          1HB       GLU  43  -8.947  -6.879  -9.289
  314   2HB   GLU  43          2HB       GLU  43  -7.294  -7.486  -9.284
  315   1HG   GLU  43          2HG       GLU  43  -7.554  -7.350  -6.647
  316   2HG   GLU  43          1HG       GLU  43  -9.278  -7.254  -6.989
  317    H    ILE  44           H        ILE  44  -7.068  -5.325  -6.006
  318    HA   ILE  44           HA       ILE  44  -9.482  -4.292  -5.009
  319    HB   ILE  44           HB       ILE  44  -6.612  -4.377  -4.107
  320   1HG1  ILE  44          1HG1      ILE  44  -9.300  -5.247  -2.905
  321   2HG1  ILE  44          2HG1      ILE  44  -8.269  -6.283  -3.888
  322   1HG2  ILE  44          1HG2      ILE  44  -6.945  -3.236  -2.086
  323   2HG2  ILE  44          2HG2      ILE  44  -7.368  -2.110  -3.359
  324   3HG2  ILE  44          3HG2      ILE  44  -8.656  -2.943  -2.439
  325   1HD1  ILE  44          1HD1      ILE  44  -7.627  -5.128  -1.148
  326   2HD1  ILE  44          2HD1      ILE  44  -6.456  -6.023  -2.146
  327   3HD1  ILE  44          3HD1      ILE  44  -7.936  -6.814  -1.553
  328    H    ALA  45           H        ALA  45  -6.809  -2.573  -6.640
  329    HA   ALA  45           HA       ALA  45  -7.547   0.086  -5.986
  330   1HB   ALA  45          1HB       ALA  45  -6.510  -0.863  -8.680
  331   2HB   ALA  45          2HB       ALA  45  -5.466  -0.770  -7.265
  332   3HB   ALA  45          3HB       ALA  45  -6.238   0.703  -7.900
  333    H    GLY  46           H        GLY  46  -8.890  -2.255  -8.329
  334   1HA   GLY  46          2HA       GLY  46 -10.465  -0.298  -9.821
  335   2HA   GLY  46          1HA       GLY  46 -10.511  -2.069  -9.936
  336    H    GLU  47           HN       GLU  47 -10.886  -2.789  -7.273
  337    HA   GLU  47           HA       GLU  47 -13.687  -2.616  -7.013
  338   1HB   GLU  47          2HB       GLU  47 -11.686  -3.097  -4.766
  339   2HB   GLU  47          1HB       GLU  47 -13.420  -3.455  -4.769
  340   1HG   GLU  47          2HG       GLU  47 -12.921  -4.964  -6.811
  341   2HG   GLU  47          1HG       GLU  47 -11.227  -4.772  -6.423
  342    H    TYR  48           H        TYR  48 -11.211  -0.798  -5.194
  343    HA   TYR  48           HA       TYR  48 -13.388   1.020  -4.168
  344   1HB   TYR  48          1HB       TYR  48 -10.610   0.621  -3.042
  345   2HB   TYR  48          2HB       TYR  48 -11.951   1.499  -2.307
  346    HD1  TYR  48           HD1      TYR  48 -14.109   0.170  -1.703
  347    HD2  TYR  48           HD2      TYR  48 -10.377  -1.690  -2.719
  348    HE1  TYR  48           HE1      TYR  48 -15.081  -2.056  -1.190
  349    HE2  TYR  48           HE2      TYR  48 -11.334  -3.919  -2.207
  350    HH   TYR  48           HH       TYR  48 -13.437  -4.986  -2.263
  351    H    LYS  49           HN       LYS  49 -12.241   1.311  -6.836
  352    HA   LYS  49           HA       LYS  49 -10.436   3.474  -6.980
  353   1HB   LYS  49          1HB       LYS  49 -11.405   3.838  -9.232
  354   2HB   LYS  49          2HB       LYS  49 -11.118   2.127  -8.907
  355   1HG   LYS  49          2HG       LYS  49 -13.577   1.939  -8.248
  356   2HG   LYS  49          1HG       LYS  49 -13.808   3.579  -8.861
  357   1HD   LYS  49          1HD       LYS  49 -13.093   2.909 -11.097
  358   2HD   LYS  49          2HD       LYS  49 -12.603   1.310 -10.514
  359   1HE   LYS  49          1HE       LYS  49 -15.471   2.353 -10.550
  360   2HE   LYS  49          2HE       LYS  49 -14.753   1.195 -11.684
  361   1HZ   LYS  49          1HZ       LYS  49 -15.213   0.799  -8.819
  362   2HZ   LYS  49          2HZ       LYS  49 -15.897  -0.020 -10.072
  363   3HZ   LYS  49          3HZ       LYS  49 -14.290  -0.209  -9.721
  364    H    ASP  50           HN       ASP  50 -10.915   5.712  -7.524
  365    HA   ASP  50           HA       ASP  50 -11.888   7.746  -7.400
  366   1HB   ASP  50          2HB       ASP  50 -14.030   6.609  -8.146
  367   2HB   ASP  50          1HB       ASP  50 -14.503   6.471  -6.456
  368    H    LYS  51           HN       LYS  51 -13.153   5.727  -4.779
  369    HA   LYS  51           HA       LYS  51 -12.900   7.860  -2.822
  370   1HB   LYS  51          1HB       LYS  51 -13.423   6.084  -1.199
  371   2HB   LYS  51          2HB       LYS  51 -14.645   6.289  -2.443
  372   1HG   LYS  51          1HG       LYS  51 -13.868   4.252  -3.586
  373   2HG   LYS  51          2HG       LYS  51 -12.558   4.053  -2.414
  374   1HD   LYS  51          2HD       LYS  51 -15.518   4.062  -1.683
  375   2HD   LYS  51          1HD       LYS  51 -14.596   2.604  -2.075
  376   1HE   LYS  51          2HE       LYS  51 -13.019   3.088  -0.201
  377   2HE   LYS  51          1HE       LYS  51 -14.002   4.495   0.250
  378   1HZ   LYS  51          1HZ       LYS  51 -14.910   1.708   0.228
  379   2HZ   LYS  51          2HZ       LYS  51 -14.547   2.605   1.552
  380   3HZ   LYS  51          3HZ       LYS  51 -15.838   3.015   0.615
  381    H    LEU  52           H        LEU  52 -10.873   5.127  -3.816
  382    HA   LEU  52           HA       LEU  52  -8.735   6.099  -1.988
  383   1HB   LEU  52          1HB       LEU  52 -10.255   3.682  -1.642
  384   2HB   LEU  52          2HB       LEU  52  -8.756   3.186  -2.414
  385    HG   LEU  52           HG       LEU  52  -7.555   4.554  -0.561
  386   1HD1  LEU  52          1HD1      LEU  52  -8.999   4.778   1.511
  387   2HD1  LEU  52          2HD1      LEU  52 -10.417   4.381   0.517
  388   3HD1  LEU  52          3HD1      LEU  52  -9.512   5.864   0.206
  389   1HD2  LEU  52          1HD2      LEU  52  -7.637   2.090  -0.609
  390   2HD2  LEU  52          2HD2      LEU  52  -9.241   2.117   0.155
  391   3HD2  LEU  52          3HD2      LEU  52  -7.813   2.686   1.051
  392    H    LYS  53           HN       LYS  53  -6.623   5.738  -2.760
  393    HA   LYS  53           HA       LYS  53  -6.357   4.729  -5.556
  394   1HB   LYS  53          1HB       LYS  53  -5.497   7.117  -4.503
  395   2HB   LYS  53          2HB       LYS  53  -4.121   6.096  -4.123
  396   1HG   LYS  53          1HG       LYS  53  -5.336   6.701  -6.858
  397   2HG   LYS  53          2HG       LYS  53  -3.800   7.278  -6.203
  398   1HD   LYS  53          2HD       LYS  53  -3.068   4.792  -6.124
  399   2HD   LYS  53          1HD       LYS  53  -4.529   4.458  -7.089
  400   1HE   LYS  53          2HE       LYS  53  -2.690   4.614  -8.594
  401   2HE   LYS  53          1HE       LYS  53  -3.726   6.028  -8.840
  402   1HZ   LYS  53          1HZ       LYS  53  -2.177   7.299  -7.528
  403   2HZ   LYS  53          2HZ       LYS  53  -1.239   5.969  -7.267
  404   3HZ   LYS  53          3HZ       LYS  53  -1.400   6.581  -8.789
  405    H    CYS  54           H        CYS  54  -4.608   3.027  -5.756
  406    HA   CYS  54           HA       CYS  54  -3.651   1.866  -3.201
  407   1HB   CYS  54          1HB       CYS  54  -5.638   0.522  -3.951
  408   2HB   CYS  54          2HB       CYS  54  -4.826   0.316  -5.530
  409    HG   CYS  54           HG       CYS  54  -4.432  -1.874  -4.401
  410    H    VAL  55           H        VAL  55  -1.506   1.044  -3.403
  411    HA   VAL  55           HA       VAL  55  -0.274   0.871  -5.990
  412    HB   VAL  55           HB       VAL  55   1.366   2.582  -5.787
  413   1HG1  VAL  55          1HG2      VAL  55   0.366   3.169  -3.062
  414   2HG1  VAL  55          2HG2      VAL  55   1.605   4.116  -3.943
  415   3HG1  VAL  55          3HG2      VAL  55   1.955   2.449  -3.490
  416   1HG2  VAL  55          1HG1      VAL  55  -1.118   4.029  -4.717
  417   2HG2  VAL  55          2HG1      VAL  55   0.225   4.762  -5.587
  418   3HG2  VAL  55          3HG1      VAL  55  -0.871   3.687  -6.441
  419    H    LYS  56           HN       LYS  56   2.207   0.416  -5.640
  420    HA   LYS  56           HA       LYS  56   2.697  -0.668  -2.945
  421   1HB   LYS  56          2HB       LYS  56   3.321  -2.852  -3.809
  422   2HB   LYS  56          1HB       LYS  56   1.681  -2.418  -4.258
  423   1HG   LYS  56          1HG       LYS  56   2.393  -1.849  -6.549
  424   2HG   LYS  56          2HG       LYS  56   4.068  -2.238  -6.135
  425   1HD   LYS  56          2HD       LYS  56   3.050  -4.108  -7.300
  426   2HD   LYS  56          1HD       LYS  56   3.406  -4.584  -5.631
  427   1HE   LYS  56          2HE       LYS  56   1.060  -4.382  -4.997
  428   2HE   LYS  56          1HE       LYS  56   0.652  -3.607  -6.545
  429   1HZ   LYS  56          1HZ       LYS  56   0.040  -5.904  -6.490
  430   2HZ   LYS  56          2HZ       LYS  56   1.594  -6.353  -6.168
  431   3HZ   LYS  56          3HZ       LYS  56   1.216  -5.664  -7.618
  432    H    LEU  57           H        LEU  57   4.684  -0.580  -2.199
  433    HA   LEU  57           HA       LEU  57   6.690   0.989  -3.751
  434   1HB   LEU  57          1HB       LEU  57   5.823   1.984  -1.686
  435   2HB   LEU  57          2HB       LEU  57   6.329   0.559  -0.763
  436    HG   LEU  57           HG       LEU  57   7.656   2.553  -0.417
  437   1HD1  LEU  57          1HD1      LEU  57   7.664   3.346  -2.811
  438   2HD1  LEU  57          2HD1      LEU  57   8.802   2.027  -3.165
  439   3HD1  LEU  57          3HD1      LEU  57   9.257   3.326  -2.034
  440   1HD2  LEU  57          1HD2      LEU  57   8.486   0.096  -0.155
  441   2HD2  LEU  57          2HD2      LEU  57   9.664   1.422  -0.124
  442   3HD2  LEU  57          3HD2      LEU  57   9.451   0.440  -1.577
  443    H    ASN  58           H        ASN  58   8.416  -0.080  -4.551
  444    HA   ASN  58           HA       ASN  58   8.938  -2.851  -3.709
  445   1HB   ASN  58          1HB       ASN  58   9.262  -2.187  -6.049
  446   2HB   ASN  58          2HB       ASN  58  10.552  -1.084  -5.561
  447   1HD2  ASN  58          2HD2      ASN  58   9.997  -4.218  -6.689
  448   2HD2  ASN  58          1HD2      ASN  58  11.510  -4.924  -6.152
  449    H    THR  59           H        THR  59   9.707  -3.118  -1.782
  450    HA   THR  59           HA       THR  59  11.063  -1.146  -0.211
  451    HB   THR  59           HB       THR  59  10.768  -4.152   0.279
  452    HG1  THR  59           HG1      THR  59   8.771  -3.316  -0.155
  453   1HG2  THR  59          1HG2      THR  59  12.258  -3.065   1.900
  454   2HG2  THR  59          2HG2      THR  59  11.059  -1.780   2.165
  455   3HG2  THR  59          3HG2      THR  59  10.704  -3.450   2.657
  456    H    ASP  60           HN       ASP  60  12.184  -3.706  -2.329
  457    HA   ASP  60           HA       ASP  60  14.807  -4.048  -1.165
  458   1HB   ASP  60          1HB       ASP  60  13.373  -5.565  -2.704
  459   2HB   ASP  60          2HB       ASP  60  13.975  -4.592  -4.044
  460    H    GLU  61           HN       GLU  61  13.388  -2.204  -3.780
  461    HA   GLU  61           HA       GLU  61  15.814  -0.789  -4.560
  462   1HB   GLU  61          2HB       GLU  61  14.036  -1.537  -6.138
  463   2HB   GLU  61          1HB       GLU  61  12.884  -0.480  -5.317
  464   1HG   GLU  61          1HG       GLU  61  13.662   0.534  -7.404
  465   2HG   GLU  61          2HG       GLU  61  14.170   1.514  -6.030
  466    H    SER  62           H        SER  62  12.999  -0.133  -2.488
  467    HA   SER  62           HA       SER  62  14.045   2.583  -1.822
  468   1HB   SER  62          1HB       SER  62  11.142   1.713  -2.213
  469   2HB   SER  62          2HB       SER  62  11.735   3.228  -1.538
  470    HG   SER  62           HG       SER  62  13.020   3.478  -3.478
  471    HA   PRO  63           HA       PRO  63  13.656  -0.220   1.971
  472   1HB   PRO  63          2HB       PRO  63  16.276  -0.095   2.761
  473   2HB   PRO  63          1HB       PRO  63  15.666  -1.204   1.507
  474   1HG   PRO  63          1HG       PRO  63  17.078   1.392   0.979
  475   2HG   PRO  63          2HG       PRO  63  17.425  -0.223   0.306
  476   1HD   PRO  63          1HD       PRO  63  15.839   1.513  -1.052
  477   2HD   PRO  63          2HD       PRO  63  15.465  -0.220  -1.020
  478    H    ASN  64           H        ASN  64  15.421   2.545   1.140
  479    HA   ASN  64           HA       ASN  64  15.879   4.133   3.337
  480   1HB   ASN  64          2HB       ASN  64  14.674   4.932   0.659
  481   2HB   ASN  64          1HB       ASN  64  15.110   6.118   1.890
  482   1HD2  ASN  64          2HD2      ASN  64  16.254   5.978  -0.770
  483   2HD2  ASN  64          1HD2      ASN  64  17.964   5.608  -0.558
  484    H    VAL  65           H        VAL  65  12.821   4.689   1.622
  485    HA   VAL  65           HA       VAL  65  11.563   6.116   3.695
  486    HB   VAL  65           HB       VAL  65  10.566   4.531   1.286
  487   1HG1  VAL  65          1HG2      VAL  65   8.428   5.776   1.557
  488   2HG1  VAL  65          2HG2      VAL  65   8.987   6.298   3.169
  489   3HG1  VAL  65          3HG2      VAL  65   8.693   4.575   2.825
  490   1HG2  VAL  65          1HG1      VAL  65  10.288   6.794   0.355
  491   2HG2  VAL  65          2HG1      VAL  65  10.791   7.517   1.898
  492   3HG2  VAL  65          3HG1      VAL  65  11.958   6.600   0.934
  493    H    ALA  66           H        ALA  66  11.469   2.699   2.887
  494    HA   ALA  66           HA       ALA  66   9.555   1.832   4.817
  495   1HB   ALA  66          1HB       ALA  66  10.525  -0.398   4.518
  496   2HB   ALA  66          2HB       ALA  66  11.975   0.273   3.790
  497   3HB   ALA  66          3HB       ALA  66  10.425   0.429   2.950
  498    H    SER  67           H        SER  67  13.063   2.426   5.113
  499    HA   SER  67           HA       SER  67  13.268   1.465   7.832
  500   1HB   SER  67          1HB       SER  67  15.128   3.359   6.325
  501   2HB   SER  67          2HB       SER  67  15.492   2.422   7.779
  502    HG   SER  67           HG       SER  67  14.777   1.345   5.239
  503    H    GLU  68           HN       GLU  68  12.895   4.656   6.294
  504    HA   GLU  68           HA       GLU  68  12.968   6.246   8.654
  505   1HB   GLU  68          1HB       GLU  68  11.378   6.645   6.072
  506   2HB   GLU  68          2HB       GLU  68  11.533   7.847   7.343
  507   1HG   GLU  68          2HG       GLU  68  13.882   6.680   5.774
  508   2HG   GLU  68          1HG       GLU  68  13.120   8.243   5.475
  509    H    TYR  69           H        TYR  69  10.214   4.569   7.104
  510    HA   TYR  69           HA       TYR  69   8.363   5.401   9.207
  511   1HB   TYR  69          2HB       TYR  69   8.250   3.433   6.897
  512   2HB   TYR  69          1HB       TYR  69   6.992   3.464   8.117
  513    HD1  TYR  69           HD1      TYR  69   5.993   5.855   8.723
  514    HD2  TYR  69           HD2      TYR  69   7.869   4.817   4.991
  515    HE1  TYR  69           HE1      TYR  69   5.095   7.927   7.696
  516    HE2  TYR  69           HE2      TYR  69   6.937   6.882   3.957
  517    HH   TYR  69           HH       TYR  69   5.920   8.903   4.360
  518    H    GLY  70           H        GLY  70  10.376   2.521   8.637
  519   1HA   GLY  70          1HA       GLY  70  11.357   1.343  10.443
  520   2HA   GLY  70          2HA       GLY  70  10.038   1.812  11.517
  521    H    ILE  71           H        ILE  71  10.109   0.312   8.255
  522    HA   ILE  71           HA       ILE  71   8.098  -1.669   9.035
  523    HB   ILE  71           HB       ILE  71   9.721  -1.274   6.493
  524   1HG1  ILE  71          2HG1      ILE  71   6.906  -0.436   7.353
  525   2HG1  ILE  71          1HG1      ILE  71   8.266   0.631   6.988
  526   1HG2  ILE  71          1HG2      ILE  71   7.269  -3.012   7.001
  527   2HG2  ILE  71          2HG2      ILE  71   8.912  -3.621   6.725
  528   3HG2  ILE  71          3HG2      ILE  71   8.069  -2.773   5.438
  529   1HD1  ILE  71          1HD1      ILE  71   6.982   0.731   5.061
  530   2HD1  ILE  71          2HD1      ILE  71   8.255  -0.425   4.641
  531   3HD1  ILE  71          3HD1      ILE  71   6.629  -1.007   5.060
  532    H    ARG  72           HN       ARG  72   8.735  -3.335  10.329
  533    HA   ARG  72           HA       ARG  72  11.496  -4.182  10.419
  534   1HB   ARG  72          1HB       ARG  72  10.876  -5.603  12.137
  535   2HB   ARG  72          2HB       ARG  72   9.984  -4.115  12.410
  536   1HG   ARG  72          2HG       ARG  72   8.609  -6.475  11.047
  537   2HG   ARG  72          1HG       ARG  72   8.978  -6.537  12.744
  538   1HD   ARG  72          2HD       ARG  72   6.712  -5.820  12.542
  539   2HD   ARG  72          1HD       ARG  72   7.699  -4.549  13.252
  540    HE   ARG  72           HE       ARG  72   6.994  -3.170  11.612
  541   1HH1  ARG  72          1HH2      ARG  72   6.696  -6.470  10.344
  542   2HH1  ARG  72          2HH2      ARG  72   6.224  -5.925   8.745
  543   1HH2  ARG  72          1HH1      ARG  72   6.013  -2.531   9.644
  544   2HH2  ARG  72          2HH1      ARG  72   5.640  -3.724   8.421
  545    H    SER  73           H        SER  73   8.603  -5.333   8.719
  546    HA   SER  73           HA       SER  73  10.207  -7.049   7.044
  547   1HB   SER  73          1HB       SER  73   7.955  -8.394   8.592
  548   2HB   SER  73          2HB       SER  73   9.135  -9.145   7.517
  549    HG   SER  73           HG       SER  73  10.666  -8.129   9.252
  550    H    ILE  74           H        ILE  74   8.848  -7.813   5.220
  551    HA   ILE  74           HA       ILE  74   6.413  -6.155   4.866
  552    HB   ILE  74           HB       ILE  74   6.958  -6.448   2.366
  553   1HG1  ILE  74          2HG1      ILE  74   9.817  -6.686   3.298
  554   2HG1  ILE  74          1HG1      ILE  74   8.871  -8.105   2.810
  555   1HG2  ILE  74          1HG2      ILE  74   7.031  -4.337   3.716
  556   2HG2  ILE  74          2HG2      ILE  74   8.721  -4.694   4.134
  557   3HG2  ILE  74          3HG2      ILE  74   8.255  -4.361   2.457
  558   1HD1  ILE  74          1HD1      ILE  74  10.152  -7.206   0.922
  559   2HD1  ILE  74          2HD1      ILE  74   8.406  -7.148   0.628
  560   3HD1  ILE  74          3HD1      ILE  74   9.292  -5.673   1.046
  561    HA   PRO  75           HA       PRO  75   4.780  -6.504   2.630
  562   1HB   PRO  75          2HB       PRO  75   2.133  -6.924   2.962
  563   2HB   PRO  75          1HB       PRO  75   3.091  -7.880   1.816
  564   1HG   PRO  75          2HG       PRO  75   2.450  -8.595   4.706
  565   2HG   PRO  75          1HG       PRO  75   2.112  -9.585   3.260
  566   1HD   PRO  75          1HD       PRO  75   4.355  -9.976   4.741
  567   2HD   PRO  75          2HD       PRO  75   4.477 -10.003   2.962
  568    H    THR  76           H        THR  76   3.581  -4.671   3.235
  569    HA   THR  76           HA       THR  76   2.514  -4.313   5.902
  570    HB   THR  76           HB       THR  76   5.104  -2.916   5.151
  571    HG1  THR  76           HG1      THR  76   4.941  -5.020   6.426
  572   1HG2  THR  76          1HG2      THR  76   3.491  -1.241   6.063
  573   2HG2  THR  76          2HG2      THR  76   4.771  -1.599   7.232
  574   3HG2  THR  76          3HG2      THR  76   3.169  -2.328   7.434
  575    H    ILE  77           H        ILE  77   0.643  -3.583   5.104
  576    HA   ILE  77           HA       ILE  77   0.626  -1.730   2.791
  577    HB   ILE  77           HB       ILE  77  -1.762  -1.948   2.774
  578   1HG1  ILE  77          1HG1      ILE  77  -1.526  -3.898   5.084
  579   2HG1  ILE  77          2HG1      ILE  77  -2.221  -2.272   5.184
  580   1HG2  ILE  77          1HG2      ILE  77  -0.471  -4.715   2.944
  581   2HG2  ILE  77          2HG2      ILE  77  -1.870  -4.249   1.952
  582   3HG2  ILE  77          3HG2      ILE  77  -0.279  -3.595   1.583
  583   1HD1  ILE  77          1HD1      ILE  77  -4.026  -3.808   5.034
  584   2HD1  ILE  77          2HD1      ILE  77  -3.335  -4.610   3.619
  585   3HD1  ILE  77          3HD1      ILE  77  -3.935  -2.938   3.489
  586    H    MET  78           H        MET  78   0.275   0.389   3.116
  587    HA   MET  78           HA       MET  78  -0.372   1.357   5.871
  588   1HB   MET  78          2HB       MET  78   1.321   2.803   3.843
  589   2HB   MET  78          1HB       MET  78   0.964   3.300   5.496
  590   1HG   MET  78          2HG       MET  78   2.146   1.141   6.226
  591   2HG   MET  78          1HG       MET  78   2.750   1.039   4.581
  592   1HE   MET  78          1HE       MET  78   5.791   2.005   6.819
  593   2HE   MET  78          2HE       MET  78   4.887   0.717   5.992
  594   3HE   MET  78          3HE       MET  78   4.359   1.283   7.594
  595    H    VAL  79           H        VAL  79  -1.613   3.221   5.863
  596    HA   VAL  79           HA       VAL  79  -3.074   3.835   3.298
  597    HB   VAL  79           HB       VAL  79  -4.101   3.809   6.142
  598   1HG1  VAL  79          1HG1      VAL  79  -4.812   2.111   3.701
  599   2HG1  VAL  79          2HG1      VAL  79  -5.675   2.074   5.251
  600   3HG1  VAL  79          3HG1      VAL  79  -3.989   1.545   5.170
  601   1HG2  VAL  79          1HG2      VAL  79  -6.294   4.423   5.061
  602   2HG2  VAL  79          2HG2      VAL  79  -5.450   4.611   3.510
  603   3HG2  VAL  79          3HG2      VAL  79  -5.086   5.698   4.865
  604    H    PHE  80           H        PHE  80  -2.446   5.778   2.615
  605    HA   PHE  80           HA       PHE  80  -1.616   7.862   4.599
  606   1HB   PHE  80          1HB       PHE  80  -0.819   7.326   1.727
  607   2HB   PHE  80          2HB       PHE  80  -0.453   8.836   2.556
  608    HD1  PHE  80           HD1      PHE  80   0.467   5.279   2.266
  609    HD2  PHE  80           HD2      PHE  80   1.146   8.949   4.416
  610    HE1  PHE  80           HE1      PHE  80   2.665   4.427   3.066
  611    HE2  PHE  80           HE2      PHE  80   3.178   7.988   5.427
  612    HZ   PHE  80           HZ       PHE  80   3.957   5.714   4.749
  613    H    LYS  81           HN       LYS  81  -2.293  10.037   4.143
  614    HA   LYS  81           HA       LYS  81  -4.047  10.694   1.986
  615   1HB   LYS  81          1HB       LYS  81  -6.095  11.016   3.089
  616   2HB   LYS  81          2HB       LYS  81  -5.618   9.394   3.567
  617   1HG   LYS  81          2HG       LYS  81  -5.543  11.935   5.251
  618   2HG   LYS  81          1HG       LYS  81  -6.587  10.524   5.426
  619   1HD   LYS  81          2HD       LYS  81  -4.410   9.177   5.809
  620   2HD   LYS  81          1HD       LYS  81  -3.620  10.732   6.069
  621   1HE   LYS  81          2HE       LYS  81  -5.987   9.679   7.667
  622   2HE   LYS  81          1HE       LYS  81  -4.300   9.782   8.200
  623   1HZ   LYS  81          1HZ       LYS  81  -5.558  11.609   9.006
  624   2HZ   LYS  81          2HZ       LYS  81  -4.410  12.145   7.952
  625   3HZ   LYS  81          3HZ       LYS  81  -5.988  12.067   7.482
  626    H    GLY  82           H        GLY  82  -4.448  13.078   2.059
  627   1HA   GLY  82          2HA       GLY  82  -3.669  15.225   2.479
  628   2HA   GLY  82          1HA       GLY  82  -3.975  14.720   4.160
  629    H    GLY  83           H        GLY  83  -1.366  13.438   2.063
  630   1HA   GLY  83          2HA       GLY  83   0.903  13.468   2.297
  631   2HA   GLY  83          1HA       GLY  83   0.735  15.062   3.030
  632    H    LYS  84           HN       LYS  84  -0.857  12.365   4.641
  633    HA   LYS  84           HA       LYS  84   1.396  11.890   6.498
  634   1HB   LYS  84          2HB       LYS  84  -1.431  12.692   7.327
  635   2HB   LYS  84          1HB       LYS  84  -0.142  12.218   8.436
  636   1HG   LYS  84          2HG       LYS  84  -0.106  14.686   6.655
  637   2HG   LYS  84          1HG       LYS  84  -0.550  14.670   8.355
  638   1HD   LYS  84          2HD       LYS  84   1.651  13.986   9.067
  639   2HD   LYS  84          1HD       LYS  84   2.197  13.723   7.408
  640   1HE   LYS  84          1HE       LYS  84   1.392  16.433   8.538
  641   2HE   LYS  84          2HE       LYS  84   3.048  15.837   8.317
  642   1HZ   LYS  84          1HZ       LYS  84   2.491  17.149   6.475
  643   2HZ   LYS  84          2HZ       LYS  84   1.081  16.342   6.206
  644   3HZ   LYS  84          3HZ       LYS  84   2.512  15.578   5.955
  645    H    LYS  85           HN       LYS  85   0.784  10.065   8.023
  646    HA   LYS  85           HA       LYS  85  -0.471   7.914   6.423
  647   1HB   LYS  85          1HB       LYS  85   1.860   7.762   7.516
  648   2HB   LYS  85          2HB       LYS  85   0.986   7.585   9.046
  649   1HG   LYS  85          2HG       LYS  85  -0.165   5.556   8.127
  650   2HG   LYS  85          1HG       LYS  85   0.570   5.861   6.545
  651   1HD   LYS  85          2HD       LYS  85   1.777   4.094   7.583
  652   2HD   LYS  85          1HD       LYS  85   2.830   5.515   7.546
  653   1HE   LYS  85          1HE       LYS  85   2.247   5.945   9.954
  654   2HE   LYS  85          2HE       LYS  85   1.215   4.505   9.945
  655   1HZ   LYS  85          1HZ       LYS  85   3.158   3.203   9.437
  656   2HZ   LYS  85          2HZ       LYS  85   4.111   4.546   9.457
  657   3HZ   LYS  85          3HZ       LYS  85   3.369   4.044  10.839
  658    H    CYS  86           H        CYS  86  -2.032   6.541   7.382
  659    HA   CYS  86           HA       CYS  86  -3.748   7.769   9.508
  660   1HB   CYS  86          2HB       CYS  86  -4.745   7.422   7.211
  661   2HB   CYS  86          1HB       CYS  86  -4.479   5.694   7.390
  662    HG   CYS  86           HG       CYS  86  -6.774   5.631   8.074
  663    H    GLU  87           HN       GLU  87  -2.895   4.542   8.177
  664    HA   GLU  87           HA       GLU  87  -1.915   3.529  10.670
  665   1HB   GLU  87          2HB       GLU  87  -3.753   1.573  10.550
  666   2HB   GLU  87          1HB       GLU  87  -3.919   3.010  11.545
  667   1HG   GLU  87          2HG       GLU  87  -5.981   2.362  10.362
  668   2HG   GLU  87          1HG       GLU  87  -5.485   4.016  10.073
  669    H    THR  88           H        THR  88  -1.718   0.915  10.306
  670    HA   THR  88           HA       THR  88  -1.152   0.218   7.586
  671    HB   THR  88           HB       THR  88   0.865   1.521   8.069
  672    HG1  THR  88           HG1      THR  88   1.073  -0.646   7.117
  673   1HG2  THR  88          1HG2      THR  88   1.203  -0.180  10.582
  674   2HG2  THR  88          2HG2      THR  88   2.384   0.973   9.940
  675   3HG2  THR  88          3HG2      THR  88   0.823   1.557  10.535
  676    H    ILE  89           H        ILE  89  -0.634  -2.071   7.386
  677    HA   ILE  89           HA       ILE  89  -0.864  -3.791   9.756
  678    HB   ILE  89           HB       ILE  89  -2.942  -3.639   7.511
  679   1HG1  ILE  89          1HG1      ILE  89  -3.472  -2.193   9.428
  680   2HG1  ILE  89          2HG1      ILE  89  -4.606  -3.510   9.258
  681   1HG2  ILE  89          1HG2      ILE  89  -4.005  -5.667   8.579
  682   2HG2  ILE  89          2HG2      ILE  89  -2.528  -5.982   7.685
  683   3HG2  ILE  89          3HG2      ILE  89  -2.491  -5.932   9.463
  684   1HD1  ILE  89          1HD1      ILE  89  -3.587  -4.746  11.115
  685   2HD1  ILE  89          2HD1      ILE  89  -4.084  -3.124  11.604
  686   3HD1  ILE  89          3HD1      ILE  89  -2.376  -3.464  11.331
  687    H    ILE  90           H        ILE  90  -0.316  -6.039   9.180
  688    HA   ILE  90           HA       ILE  90   1.692  -6.208   7.019
  689    HB   ILE  90           HB       ILE  90   0.732  -8.161   9.148
  690   1HG1  ILE  90          1HG1      ILE  90   3.268  -6.465   8.853
  691   2HG1  ILE  90          2HG1      ILE  90   1.958  -6.178  10.005
  692   1HG2  ILE  90          1HG2      ILE  90   2.638  -9.564   8.485
  693   2HG2  ILE  90          2HG2      ILE  90   3.080  -8.414   7.209
  694   3HG2  ILE  90          3HG2      ILE  90   1.571  -9.347   7.114
  695   1HD1  ILE  90          1HD1      ILE  90   3.728  -7.214  11.200
  696   2HD1  ILE  90          2HD1      ILE  90   2.433  -8.419  11.043
  697   3HD1  ILE  90          3HD1      ILE  90   3.890  -8.519  10.020
  698    H    GLY  91           H        GLY  91   0.989  -6.506   5.029
  699   1HA   GLY  91          1HA       GLY  91  -1.606  -7.077   4.244
  700   2HA   GLY  91          2HA       GLY  91  -0.189  -7.192   3.206
  701    H    ALA  92           H        ALA  92   0.629  -9.554   5.304
  702    HA   ALA  92           HA       ALA  92  -0.246 -11.663   3.570
  703   1HB   ALA  92          1HB       ALA  92   1.033 -11.748   6.340
  704   2HB   ALA  92          2HB       ALA  92   0.963 -13.081   5.169
  705   3HB   ALA  92          3HB       ALA  92   1.915 -11.628   4.806
  706    H    VAL  93           H        VAL  93  -2.664 -10.861   3.930
  707    HA   VAL  93           HA       VAL  93  -3.912 -12.829   5.707
  708    HB   VAL  93           HB       VAL  93  -5.549 -11.198   6.541
  709   1HG1  VAL  93          1HG2      VAL  93  -3.809  -9.052   5.256
  710   2HG1  VAL  93          2HG2      VAL  93  -5.183  -8.768   6.341
  711   3HG1  VAL  93          3HG2      VAL  93  -5.455  -9.501   4.762
  712   1HG2  VAL  93          1HG1      VAL  93  -4.208 -10.094   8.210
  713   2HG2  VAL  93          2HG1      VAL  93  -3.536 -11.706   7.906
  714   3HG2  VAL  93          3HG1      VAL  93  -2.741 -10.263   7.234
  715    HA   PRO  94           HA       PRO  94  -6.361 -13.441   2.109
  716   1HB   PRO  94          1HB       PRO  94  -8.836 -13.295   3.835
  717   2HB   PRO  94          2HB       PRO  94  -8.408 -14.533   2.620
  718   1HG   PRO  94          1HG       PRO  94  -8.068 -15.059   5.259
  719   2HG   PRO  94          2HG       PRO  94  -6.784 -15.505   4.094
  720   1HD   PRO  94          1HD       PRO  94  -6.892 -13.092   5.915
  721   2HD   PRO  94          2HD       PRO  94  -5.542 -14.205   5.563
  722    H    LYS  95           HN       LYS  95  -7.740 -12.476   0.588
  723    HA   LYS  95           HA       LYS  95  -7.820  -9.772   0.246
  724   1HB   LYS  95          1HB       LYS  95  -8.348 -11.542  -1.452
  725   2HB   LYS  95          2HB       LYS  95  -9.893 -11.849  -0.677
  726   1HG   LYS  95          1HG       LYS  95 -10.660  -9.552  -1.177
  727   2HG   LYS  95          2HG       LYS  95  -9.094  -9.176  -1.904
  728   1HD   LYS  95          2HD       LYS  95  -9.499 -10.999  -3.603
  729   2HD   LYS  95          1HD       LYS  95 -11.079 -11.303  -2.854
  730   1HE   LYS  95          2HE       LYS  95 -11.762  -8.962  -3.324
  731   2HE   LYS  95          1HE       LYS  95 -10.180  -8.640  -4.059
  732   1HZ   LYS  95          1HZ       LYS  95 -12.109 -10.626  -5.039
  733   2HZ   LYS  95          2HZ       LYS  95 -10.668 -10.210  -5.745
  734   3HZ   LYS  95          3HZ       LYS  95 -11.880  -9.105  -5.643
  735    H    ALA  96           H        ALA  96 -10.450 -11.789   1.438
  736    HA   ALA  96           HA       ALA  96 -12.415  -9.876   2.005
  737   1HB   ALA  96          1HB       ALA  96 -11.707 -12.351   3.657
  738   2HB   ALA  96          2HB       ALA  96 -12.786 -12.301   2.245
  739   3HB   ALA  96          3HB       ALA  96 -13.238 -11.452   3.736
  740    H    THR  97           H        THR  97  -9.748 -10.977   4.192
  741    HA   THR  97           HA       THR  97 -10.361  -9.224   6.321
  742    HB   THR  97           HB       THR  97  -7.602 -10.274   5.587
  743    HG1  THR  97           HG1      THR  97  -9.788 -11.646   6.769
  744   1HG2  THR  97          1HG2      THR  97  -9.035  -9.843   8.252
  745   2HG2  THR  97          2HG2      THR  97  -7.735  -8.828   7.591
  746   3HG2  THR  97          3HG2      THR  97  -7.404 -10.509   8.047
  747    H    ILE  98           H        ILE  98  -8.132  -8.879   3.485
  748    HA   ILE  98           HA       ILE  98  -7.075  -6.336   4.172
  749    HB   ILE  98           HB       ILE  98  -7.704  -7.481   1.398
  750   1HG1  ILE  98          1HG1      ILE  98  -6.081  -8.831   2.710
  751   2HG1  ILE  98          2HG1      ILE  98  -5.462  -8.151   1.219
  752   1HG2  ILE  98          1HG2      ILE  98  -7.479  -5.073   1.184
  753   2HG2  ILE  98          2HG2      ILE  98  -6.064  -5.050   2.243
  754   3HG2  ILE  98          3HG2      ILE  98  -5.967  -5.809   0.639
  755   1HD1  ILE  98          1HD1      ILE  98  -4.216  -6.438   2.416
  756   2HD1  ILE  98          2HD1      ILE  98  -3.833  -8.036   3.052
  757   3HD1  ILE  98          3HD1      ILE  98  -4.904  -6.967   3.974
  758    H    VAL  99           H        VAL  99 -10.008  -7.118   2.231
  759    HA   VAL  99           HA       VAL  99 -10.831  -4.453   1.753
  760    HB   VAL  99           HB       VAL  99 -12.442  -7.036   2.007
  761   1HG1  VAL  99          1HG2      VAL  99 -13.310  -4.285   1.019
  762   2HG1  VAL  99          2HG2      VAL  99 -14.002  -5.184   2.382
  763   3HG1  VAL  99          3HG2      VAL  99 -14.212  -5.790   0.739
  764   1HG2  VAL  99          1HG1      VAL  99 -10.778  -6.932   0.129
  765   2HG2  VAL  99          2HG1      VAL  99 -11.525  -5.426  -0.409
  766   3HG2  VAL  99          3HG1      VAL  99 -12.451  -6.941  -0.447
  767    H    GLN 100           H        GLN 100 -11.939  -6.695   4.380
  768    HA   GLN 100           HA       GLN 100 -13.571  -4.768   5.700
  769   1HB   GLN 100          2HB       GLN 100 -11.966  -7.095   6.863
  770   2HB   GLN 100          1HB       GLN 100 -13.219  -6.198   7.726
  771   1HG   GLN 100          2HG       GLN 100 -13.662  -7.889   5.221
  772   2HG   GLN 100          1HG       GLN 100 -14.081  -8.324   6.877
  773   1HE2  GLN 100          1HE2      GLN 100 -14.765  -6.042   4.229
  774   2HE2  GLN 100          2HE2      GLN 100 -16.417  -5.696   4.738
  775    H    THR 101           H        THR 101 -10.142  -5.512   6.171
  776    HA   THR 101           HA       THR 101  -9.585  -3.730   8.291
  777    HB   THR 101           HB       THR 101  -7.811  -4.657   5.986
  778    HG1  THR 101           HG1      THR 101  -8.568  -6.324   7.254
  779   1HG2  THR 101          1HG2      THR 101  -7.058  -3.402   8.651
  780   2HG2  THR 101          2HG2      THR 101  -5.940  -4.190   7.509
  781   3HG2  THR 101          3HG2      THR 101  -6.774  -2.706   7.031
  782    H    VAL 102           H        VAL 102  -9.436  -3.101   4.698
  783    HA   VAL 102           HA       VAL 102  -8.704  -0.340   5.036
  784    HB   VAL 102           HB       VAL 102 -10.061  -1.907   2.839
  785   1HG1  VAL 102          1HG1      VAL 102  -7.608  -2.286   3.275
  786   2HG1  VAL 102          2HG1      VAL 102  -7.939  -1.605   1.672
  787   3HG1  VAL 102          3HG1      VAL 102  -7.329  -0.558   2.971
  788   1HG2  VAL 102          1HG2      VAL 102  -9.660   0.047   1.336
  789   2HG2  VAL 102          2HG2      VAL 102 -10.915   0.355   2.533
  790   3HG2  VAL 102          3HG2      VAL 102  -9.286   1.036   2.765
  791    H    GLU 103           HN       GLU 103 -11.891  -1.868   4.474
  792    HA   GLU 103           HA       GLU 103 -13.412   0.467   4.463
  793   1HB   GLU 103          2HB       GLU 103 -14.131  -2.351   5.372
  794   2HB   GLU 103          1HB       GLU 103 -15.302  -1.051   5.145
  795   1HG   GLU 103          2HG       GLU 103 -13.496  -2.123   2.927
  796   2HG   GLU 103          1HG       GLU 103 -15.189  -2.553   3.176
  797    H    LYS 104           HN       LYS 104 -12.642  -1.511   7.355
  798    HA   LYS 104           HA       LYS 104 -14.173   0.071   9.145
  799   1HB   LYS 104          2HB       LYS 104 -12.747  -0.793  10.939
  800   2HB   LYS 104          1HB       LYS 104 -13.247  -2.075   9.832
  801   1HG   LYS 104          2HG       LYS 104 -11.103  -2.283   8.942
  802   2HG   LYS 104          1HG       LYS 104 -10.570  -0.689   9.466
  803   1HD   LYS 104          2HD       LYS 104  -9.462  -2.354  10.767
  804   2HD   LYS 104          1HD       LYS 104 -10.547  -1.410  11.799
  805   1HE   LYS 104          1HE       LYS 104 -12.229  -3.244  11.725
  806   2HE   LYS 104          2HE       LYS 104 -11.196  -4.161  10.611
  807   1HZ   LYS 104          1HZ       LYS 104 -10.508  -3.415  13.366
  808   2HZ   LYS 104          2HZ       LYS 104  -9.549  -4.270  12.334
  809   3HZ   LYS 104          3HZ       LYS 104 -10.975  -4.910  12.855
  810    H    TYR 105           H        TYR 105 -11.180   0.985   7.536
  811    HA   TYR 105           HA       TYR 105 -10.671   3.166   9.506
  812   1HB   TYR 105          2HB       TYR 105  -9.123   2.333   7.038
  813   2HB   TYR 105          1HB       TYR 105  -8.606   3.461   8.287
  814    HD1  TYR 105           HD1      TYR 105  -7.360   0.752   7.093
  815    HD2  TYR 105           HD2      TYR 105  -9.370   1.836  10.756
  816    HE1  TYR 105           HE1      TYR 105  -6.001  -0.886   8.336
  817    HE2  TYR 105           HE2      TYR 105  -8.105   0.089  11.962
  818    HH   TYR 105           HH       TYR 105  -5.599  -1.889  10.374
  819    H    LEU 106           H        LEU 106 -12.880   2.803   7.178
  820    HA   LEU 106           HA       LEU 106 -12.681   5.627   6.233
  821   1HB   LEU 106          2HB       LEU 106 -13.579   3.188   4.645
  822   2HB   LEU 106          1HB       LEU 106 -13.628   4.862   4.079
  823    HG   LEU 106           HG       LEU 106 -11.081   3.329   4.790
  824   1HD1  LEU 106          1HD2      LEU 106 -10.814   5.802   4.995
  825   2HD1  LEU 106          2HD2      LEU 106 -11.471   6.001   3.359
  826   3HD1  LEU 106          3HD2      LEU 106  -9.925   5.164   3.616
  827   1HD2  LEU 106          1HD1      LEU 106 -10.725   3.110   2.405
  828   2HD2  LEU 106          2HD1      LEU 106 -12.291   2.398   2.809
  829   3HD2  LEU 106          3HD1      LEU 106 -12.222   4.002   2.052
  830    H    ASN 107           H        ASN 107 -14.810   2.790   6.495
  831    HA   ASN 107           HA       ASN 107 -16.844   4.115   8.017
  832   1HB   ASN 107          2HB       ASN 107 -17.411   5.069   5.817
  833   2HB   ASN 107          1HB       ASN 107 -17.386   3.465   5.078
  834   1HD2  ASN 107          1HD2      ASN 107 -18.891   1.848   6.279
  835   2HD2  ASN 107          2HD2      ASN 107 -20.542   2.447   6.585
  Start of MODEL   27
    1   1H    MET   1          1H        MET   1  -7.208   5.567  -7.216
    2   2H    MET   1          2H        MET   1  -7.278   3.941  -7.041
    3   3H    MET   1          3H        MET   1  -7.757   4.611  -8.471
    4    HA   MET   1           HA       MET   1  -5.598   5.058  -9.096
    5   1HB   MET   1          1HB       MET   1  -4.948   6.023  -6.897
    6   2HB   MET   1          2HB       MET   1  -4.885   4.406  -6.190
    7   1HG   MET   1          2HG       MET   1  -2.647   5.327  -6.746
    8   2HG   MET   1          1HG       MET   1  -2.987   3.800  -7.539
    9   1HE   MET   1          1HE       MET   1  -2.858   7.867  -9.706
   10   2HE   MET   1          2HE       MET   1  -4.274   7.413  -8.736
   11   3HE   MET   1          3HE       MET   1  -2.691   7.648  -7.950
   12    H    GLU   2           HN       GLU   2  -4.184   3.407  -9.945
   13    HA   GLU   2           HA       GLU   2  -5.139   0.622  -9.546
   14   1HB   GLU   2          2HB       GLU   2  -3.968   0.181 -11.666
   15   2HB   GLU   2          1HB       GLU   2  -5.252   1.382 -11.828
   16   1HG   GLU   2          1HG       GLU   2  -3.589   3.214 -11.857
   17   2HG   GLU   2          2HG       GLU   2  -2.278   2.062 -11.563
   18    H    ALA   3           H        ALA   3  -3.365  -1.076  -9.477
   19    HA   ALA   3           HA       ALA   3  -1.456  -0.549  -7.482
   20   1HB   ALA   3          1HB       ALA   3  -1.663  -2.834  -9.494
   21   2HB   ALA   3          2HB       ALA   3  -0.713  -2.853  -7.995
   22   3HB   ALA   3          3HB       ALA   3  -2.474  -2.746  -7.919
   23    H    GLY   4           H        GLY   4  -0.490   1.430  -8.609
   24   1HA   GLY   4          2HA       GLY   4   1.463   0.979 -10.697
   25   2HA   GLY   4          1HA       GLY   4   1.315   2.420  -9.678
   26    H    ALA   5           H        ALA   5   3.746   1.007 -10.481
   27    HA   ALA   5           HA       ALA   5   4.787  -0.161  -7.966
   28   1HB   ALA   5          1HB       ALA   5   6.849  -0.449  -9.213
   29   2HB   ALA   5          2HB       ALA   5   5.468  -1.225 -10.023
   30   3HB   ALA   5          3HB       ALA   5   6.117   0.321 -10.643
   31    H    VAL   6           H        VAL   6   5.194   1.353  -6.497
   32    HA   VAL   6           HA       VAL   6   6.138   4.080  -7.316
   33    HB   VAL   6           HB       VAL   6   5.761   4.548  -4.776
   34   1HG1  VAL   6          1HG1      VAL   6   3.837   3.425  -3.785
   35   2HG1  VAL   6          2HG1      VAL   6   5.138   2.279  -4.075
   36   3HG1  VAL   6          3HG1      VAL   6   3.732   2.306  -5.158
   37   1HG2  VAL   6          1HG2      VAL   6   3.450   4.322  -6.719
   38   2HG2  VAL   6          2HG2      VAL   6   4.568   5.698  -6.539
   39   3HG2  VAL   6          3HG2      VAL   6   3.472   5.275  -5.216
   40    H    ASN   7           H        ASN   7   7.876   5.006  -6.100
   41    HA   ASN   7           HA       ASN   7   9.696   3.179  -4.724
   42   1HB   ASN   7          2HB       ASN   7  10.362   3.034  -7.055
   43   2HB   ASN   7          1HB       ASN   7  10.439   4.798  -7.225
   44   1HD2  ASN   7          2HD2      ASN   7  11.654   2.682  -4.516
   45   2HD2  ASN   7          1HD2      ASN   7  13.334   2.838  -4.943
   46    H    ASP   8           HN       ASP   8  11.564   4.695  -3.992
   47    HA   ASP   8           HA       ASP   8  10.753   6.397  -2.065
   48   1HB   ASP   8          1HB       ASP   8  13.119   5.633  -2.586
   49   2HB   ASP   8          2HB       ASP   8  13.241   6.918  -3.774
   50    H    ASP   9           HN       ASP   9  11.635   7.479  -5.288
   51    HA   ASP   9           HA       ASP   9  10.946  10.240  -4.973
   52   1HB   ASP   9          2HB       ASP   9  12.360   9.522  -6.797
   53   2HB   ASP   9          1HB       ASP   9  11.113   8.473  -7.462
   54    H    THR  10           H        THR  10   9.143   8.045  -7.143
   55    HA   THR  10           HA       THR  10   6.872   9.569  -7.453
   56    HB   THR  10           HB       THR  10   5.784   7.294  -7.988
   57    HG1  THR  10           HG1      THR  10   7.470   5.639  -8.153
   58   1HG2  THR  10          1HG2      THR  10   6.925   8.701  -9.680
   59   2HG2  THR  10          2HG2      THR  10   8.482   7.960  -9.266
   60   3HG2  THR  10          3HG2      THR  10   7.191   6.978  -9.989
   61    H    PHE  11           H        PHE  11   7.444   7.231  -4.863
   62    HA   PHE  11           HA       PHE  11   5.077   6.936  -3.526
   63   1HB   PHE  11          1HB       PHE  11   7.234   6.066  -2.807
   64   2HB   PHE  11          2HB       PHE  11   7.834   7.660  -2.461
   65    HD1  PHE  11           HD1      PHE  11   5.126   5.267  -1.431
   66    HD2  PHE  11           HD2      PHE  11   7.737   8.497  -0.266
   67    HE1  PHE  11           HE1      PHE  11   4.379   5.026   0.922
   68    HE2  PHE  11           HE2      PHE  11   7.003   8.240   2.080
   69    HZ   PHE  11           HZ       PHE  11   5.321   6.516   2.680
   70    H    LYS  12           HN       LYS  12   7.222   9.691  -3.395
   71    HA   LYS  12           HA       LYS  12   5.967  11.325  -1.458
   72   1HB   LYS  12          1HB       LYS  12   7.370  12.124  -4.046
   73   2HB   LYS  12          2HB       LYS  12   6.845  13.247  -2.810
   74   1HG   LYS  12          1HG       LYS  12   8.392  12.302  -1.177
   75   2HG   LYS  12          2HG       LYS  12   8.669  10.872  -2.179
   76   1HD   LYS  12          1HD       LYS  12  10.599  12.297  -2.318
   77   2HD   LYS  12          2HD       LYS  12   9.799  12.199  -3.892
   78   1HE   LYS  12          2HE       LYS  12   8.766  14.419  -3.537
   79   2HE   LYS  12          1HE       LYS  12   9.490  14.512  -1.917
   80   1HZ   LYS  12          1HZ       LYS  12  11.640  14.446  -2.959
   81   2HZ   LYS  12          2HZ       LYS  12  10.753  15.706  -3.544
   82   3HZ   LYS  12          3HZ       LYS  12  10.958  14.350  -4.457
   83    H    ASN  13           H        ASN  13   5.522  11.630  -5.010
   84    HA   ASN  13           HA       ASN  13   3.323  13.449  -4.797
   85   1HB   ASN  13          1HB       ASN  13   4.347  11.669  -7.049
   86   2HB   ASN  13          2HB       ASN  13   3.090  12.883  -7.258
   87   1HD2  ASN  13          1HD2      ASN  13   3.679  15.161  -6.187
   88   2HD2  ASN  13          2HD2      ASN  13   5.286  15.719  -6.587
   89    H    VAL  14           H        VAL  14   3.616   9.992  -5.107
   90    HA   VAL  14           HA       VAL  14   0.755   9.648  -5.791
   91    HB   VAL  14           HB       VAL  14   3.129   7.737  -5.552
   92   1HG1  VAL  14          1HG1      VAL  14   1.687   8.880  -7.994
   93   2HG1  VAL  14          2HG1      VAL  14   3.299   9.375  -7.450
   94   3HG1  VAL  14          3HG1      VAL  14   3.037   7.729  -8.028
   95   1HG2  VAL  14          1HG2      VAL  14   1.187   6.404  -5.214
   96   2HG2  VAL  14          2HG2      VAL  14   1.679   6.193  -6.902
   97   3HG2  VAL  14          3HG2      VAL  14   0.299   7.248  -6.514
   98    H    VAL  15           H        VAL  15   2.575   9.609  -2.840
   99    HA   VAL  15           HA       VAL  15   0.200   8.374  -1.493
  100    HB   VAL  15           HB       VAL  15   3.096   7.952  -0.662
  101   1HG1  VAL  15          1HG1      VAL  15   0.519   6.520   0.077
  102   2HG1  VAL  15          2HG1      VAL  15   2.136   6.211   0.742
  103   3HG1  VAL  15          3HG1      VAL  15   1.330   7.749   1.080
  104   1HG2  VAL  15          1HG2      VAL  15   2.811   5.634  -1.535
  105   2HG2  VAL  15          2HG2      VAL  15   2.903   6.854  -2.806
  106   3HG2  VAL  15          3HG2      VAL  15   1.331   6.163  -2.359
  107    H    LEU  16           H        LEU  16   3.229  10.149  -0.653
  108    HA   LEU  16           HA       LEU  16   2.163  11.324   1.694
  109   1HB   LEU  16          1HB       LEU  16   4.388  12.347  -0.109
  110   2HB   LEU  16          2HB       LEU  16   4.026  12.894   1.503
  111    HG   LEU  16           HG       LEU  16   5.007  10.118   0.675
  112   1HD1  LEU  16          1HD1      LEU  16   6.995  10.723   1.989
  113   2HD1  LEU  16          2HD1      LEU  16   6.261  12.278   2.426
  114   3HD1  LEU  16          3HD1      LEU  16   6.701  11.944   0.740
  115   1HD2  LEU  16          1HD2      LEU  16   5.140   9.653   3.154
  116   2HD2  LEU  16          2HD2      LEU  16   4.163  11.108   3.435
  117   3HD2  LEU  16          3HD2      LEU  16   3.492   9.729   2.531
  118    H    GLU  17           HN       GLU  17   2.205  12.523  -1.605
  119    HA   GLU  17           HA       GLU  17   0.760  14.991  -0.844
  120   1HB   GLU  17          2HB       GLU  17   2.669  14.818  -2.509
  121   2HB   GLU  17          1HB       GLU  17   1.539  14.029  -3.618
  122   1HG   GLU  17          2HG       GLU  17   0.133  16.049  -3.655
  123   2HG   GLU  17          1HG       GLU  17   1.172  16.811  -2.437
  124    H    SER  18           H        SER  18  -0.344  11.786  -1.409
  125    HA   SER  18           HA       SER  18  -2.546  12.458  -3.172
  126   1HB   SER  18          2HB       SER  18  -1.835   9.993  -1.560
  127   2HB   SER  18          1HB       SER  18  -3.294  10.142  -2.538
  128    HG   SER  18           HG       SER  18  -1.369   9.296  -3.668
  129    H    SER  19           H        SER  19  -4.576  13.106  -2.629
  130    HA   SER  19           HA       SER  19  -5.279  13.779   0.100
  131   1HB   SER  19          2HB       SER  19  -7.420  14.430  -1.221
  132   2HB   SER  19          1HB       SER  19  -5.913  15.281  -1.630
  133    HG   SER  19           HG       SER  19  -6.957  14.504  -3.523
  134    H    VAL  20           H        VAL  20  -6.583  11.661  -2.461
  135    HA   VAL  20           HA       VAL  20  -8.457  10.351  -0.699
  136    HB   VAL  20           HB       VAL  20  -8.858   8.814  -2.604
  137   1HG1  VAL  20          1HG2      VAL  20  -6.610   8.618  -3.563
  138   2HG1  VAL  20          2HG2      VAL  20  -7.779   9.163  -4.768
  139   3HG1  VAL  20          3HG2      VAL  20  -6.646  10.325  -4.058
  140   1HG2  VAL  20          1HG1      VAL  20  -9.758  10.496  -4.139
  141   2HG2  VAL  20          2HG1      VAL  20  -8.721  11.750  -3.434
  142   3HG2  VAL  20          3HG1      VAL  20 -10.011  11.009  -2.462
  143    HA   PRO  21           HA       PRO  21  -5.827   7.475   1.063
  144   1HB   PRO  21          1HB       PRO  21  -7.760   5.201   0.755
  145   2HB   PRO  21          2HB       PRO  21  -7.072   5.834   2.256
  146   1HG   PRO  21          1HG       PRO  21  -9.601   6.285   1.450
  147   2HG   PRO  21          2HG       PRO  21  -8.709   7.534   2.354
  148   1HD   PRO  21          1HD       PRO  21  -9.325   7.519  -0.634
  149   2HD   PRO  21          2HD       PRO  21  -9.190   8.842   0.555
  150    H    VAL  22           H        VAL  22  -4.504   5.673   0.840
  151    HA   VAL  22           HA       VAL  22  -4.652   4.092  -1.492
  152    HB   VAL  22           HB       VAL  22  -1.992   4.903  -1.820
  153   1HG1  VAL  22          1HG2      VAL  22  -3.682   4.260  -3.573
  154   2HG1  VAL  22          2HG2      VAL  22  -4.577   5.752  -3.284
  155   3HG1  VAL  22          3HG2      VAL  22  -2.960   5.826  -3.985
  156   1HG2  VAL  22          1HG1      VAL  22  -2.398   6.890  -0.431
  157   2HG2  VAL  22          2HG1      VAL  22  -3.636   7.425  -1.596
  158   3HG2  VAL  22          3HG1      VAL  22  -1.957   7.246  -2.110
  159    H    LEU  23           H        LEU  23  -4.000   2.037  -1.371
  160    HA   LEU  23           HA       LEU  23  -2.788   1.278   1.191
  161   1HB   LEU  23          2HB       LEU  23  -4.888   0.285   0.205
  162   2HB   LEU  23          1HB       LEU  23  -3.907  -0.415  -1.070
  163    HG   LEU  23           HG       LEU  23  -2.554  -1.540   0.791
  164   1HD1  LEU  23          1HD2      LEU  23  -5.479  -2.281   0.372
  165   2HD1  LEU  23          2HD2      LEU  23  -4.126  -2.712  -0.697
  166   3HD1  LEU  23          3HD2      LEU  23  -4.200  -3.377   0.939
  167   1HD2  LEU  23          1HD1      LEU  23  -5.044  -0.686   2.368
  168   2HD2  LEU  23          2HD1      LEU  23  -3.359  -0.266   2.751
  169   3HD2  LEU  23          3HD1      LEU  23  -3.918  -1.935   2.908
  170    H    VAL  24           H        VAL  24  -0.578   1.600   1.007
  171    HA   VAL  24           HA       VAL  24   0.759   0.851  -1.568
  172    HB   VAL  24           HB       VAL  24   1.454   2.948  -1.104
  173   1HG1  VAL  24          1HG2      VAL  24   0.520   3.380   1.035
  174   2HG1  VAL  24          2HG2      VAL  24   1.636   2.228   1.817
  175   3HG1  VAL  24          3HG2      VAL  24   2.251   3.739   1.099
  176   1HG2  VAL  24          1HG1      VAL  24   3.320   1.347  -1.481
  177   2HG2  VAL  24          2HG1      VAL  24   3.568   1.248   0.275
  178   3HG2  VAL  24          3HG1      VAL  24   3.798   2.790  -0.562
  179    H    ASP  25           HN       ASP  25   1.286  -1.203  -1.674
  180    HA   ASP  25           HA       ASP  25   1.872  -2.770   0.774
  181   1HB   ASP  25          1HB       ASP  25   0.490  -3.852  -0.894
  182   2HB   ASP  25          2HB       ASP  25   1.693  -3.527  -2.150
  183    H    PHE  26           H        PHE  26   3.916  -2.618   1.568
  184    HA   PHE  26           HA       PHE  26   6.184  -1.788  -0.124
  185   1HB   PHE  26          2HB       PHE  26   5.955  -2.649   2.772
  186   2HB   PHE  26          1HB       PHE  26   7.473  -2.359   1.959
  187    HD1  PHE  26           HD1      PHE  26   4.172  -0.465   2.260
  188    HD2  PHE  26           HD2      PHE  26   8.484  -0.351   2.507
  189    HE1  PHE  26           HE1      PHE  26   4.086   1.915   2.879
  190    HE2  PHE  26           HE2      PHE  26   8.362   1.942   3.387
  191    HZ   PHE  26           HZ       PHE  26   6.165   3.126   3.500
  192    H    TRP  27           H        TRP  27   6.733  -3.357  -1.562
  193    HA   TRP  27           HA       TRP  27   6.635  -6.231  -0.733
  194   1HB   TRP  27          2HB       TRP  27   5.813  -6.829  -2.877
  195   2HB   TRP  27          1HB       TRP  27   4.813  -5.502  -2.343
  196    HD1  TRP  27           HD1      TRP  27   5.631  -3.032  -3.412
  197    HE1  TRP  27           HE1      TRP  27   6.763  -2.413  -5.655
  198    HE3  TRP  27           HE3      TRP  27   6.831  -7.738  -5.034
  199    HZ2  TRP  27           HZ2      TRP  27   8.294  -3.794  -7.679
  200    HZ3  TRP  27           HZ3      TRP  27   7.977  -8.040  -7.185
  201    HH2  TRP  27           HH2      TRP  27   8.734  -6.086  -8.509
  202    H    ALA  28           H        ALA  28   7.815  -7.401  -2.808
  203    HA   ALA  28           HA       ALA  28   9.968  -6.045  -4.030
  204   1HB   ALA  28          1HB       ALA  28  10.795  -7.968  -1.806
  205   2HB   ALA  28          2HB       ALA  28  11.880  -7.217  -2.984
  206   3HB   ALA  28          3HB       ALA  28  11.067  -6.207  -1.780
  207    HA   PRO  29           HA       PRO  29   9.270  -9.732  -6.493
  208   1HB   PRO  29          1HB       PRO  29  11.781 -10.281  -7.541
  209   2HB   PRO  29          2HB       PRO  29  10.631  -9.033  -8.129
  210   1HG   PRO  29          1HG       PRO  29  12.957  -8.628  -6.214
  211   2HG   PRO  29          2HG       PRO  29  12.565  -7.675  -7.679
  212   1HD   PRO  29          2HD       PRO  29  11.736  -6.727  -5.304
  213   2HD   PRO  29          1HD       PRO  29  10.596  -6.776  -6.644
  214    H    TRP  30           H        TRP  30  12.037  -9.836  -4.208
  215    HA   TRP  30           HA       TRP  30  11.955 -12.751  -4.016
  216   1HB   TRP  30          2HB       TRP  30  13.521 -12.338  -2.116
  217   2HB   TRP  30          1HB       TRP  30  14.030 -11.714  -3.674
  218    HD1  TRP  30           HD1      TRP  30  14.826  -9.318  -3.763
  219    HE1  TRP  30           HE1      TRP  30  14.971  -7.332  -2.128
  220    HE3  TRP  30           HE3      TRP  30  12.041 -11.229   0.099
  221    HZ2  TRP  30           HZ2      TRP  30  13.878  -6.615   0.428
  222    HZ3  TRP  30           HZ3      TRP  30  11.604  -9.865   2.105
  223    HH2  TRP  30           HH2      TRP  30  12.393  -7.521   2.231
  224    H    CYS  31           H        CYS  31   9.707 -10.470  -2.955
  225    HA   CYS  31           HA       CYS  31   9.375 -11.526  -0.231
  226   1HB   CYS  31          2HB       CYS  31   9.012  -9.165  -0.694
  227   2HB   CYS  31          1HB       CYS  31   7.734  -9.585  -1.843
  228    H    GLY  32           H        GLY  32   9.039 -13.747  -0.815
  229   1HA   GLY  32          1HA       GLY  32   7.147 -15.023  -2.275
  230   2HA   GLY  32          2HA       GLY  32   7.519 -15.518  -0.620
  231    HA   PRO  33           HA       PRO  33   3.469 -14.516   0.577
  232   1HB   PRO  33          2HB       PRO  33   3.943 -12.293   2.444
  233   2HB   PRO  33          1HB       PRO  33   3.274 -13.898   2.769
  234   1HG   PRO  33          1HG       PRO  33   5.812 -13.226   3.573
  235   2HG   PRO  33          2HG       PRO  33   5.394 -14.871   3.011
  236   1HD   PRO  33          2HD       PRO  33   6.730 -12.668   1.435
  237   2HD   PRO  33          1HD       PRO  33   7.146 -14.397   1.528
  238    H    CYS  34           H        CYS  34   5.264 -11.678  -0.589
  239    HA   CYS  34           HA       CYS  34   3.035  -9.867  -0.826
  240   1HB   CYS  34          1HB       CYS  34   5.471  -9.891  -2.510
  241   2HB   CYS  34          2HB       CYS  34   4.264  -8.672  -2.318
  242    H    ARG  35           HN       ARG  35   4.817 -12.158  -2.965
  243    HA   ARG  35           HA       ARG  35   3.574 -11.764  -5.403
  244   1HB   ARG  35          1HB       ARG  35   4.435 -14.409  -4.151
  245   2HB   ARG  35          2HB       ARG  35   4.115 -14.131  -5.855
  246   1HG   ARG  35          2HG       ARG  35   5.992 -12.541  -6.006
  247   2HG   ARG  35          1HG       ARG  35   6.322 -12.745  -4.276
  248   1HD   ARG  35          2HD       ARG  35   6.626 -15.201  -4.654
  249   2HD   ARG  35          1HD       ARG  35   6.459 -14.917  -6.403
  250    HE   ARG  35           HE       ARG  35   8.471 -13.168  -5.476
  251   1HH1  ARG  35          2HH2      ARG  35   7.956 -16.659  -5.709
  252   2HH1  ARG  35          1HH2      ARG  35   9.654 -17.033  -5.844
  253   1HH2  ARG  35          1HH1      ARG  35  10.599 -13.608  -5.678
  254   2HH2  ARG  35          2HH1      ARG  35  11.230 -15.242  -5.826
  255    H    ILE  36           H        ILE  36   2.475 -13.892  -2.749
  256    HA   ILE  36           HA       ILE  36   0.139 -14.732  -4.294
  257    HB   ILE  36           HB       ILE  36  -0.466 -16.020  -2.246
  258   1HG1  ILE  36          2HG1      ILE  36   1.483 -16.456  -0.667
  259   2HG1  ILE  36          1HG1      ILE  36   2.182 -14.926  -1.176
  260   1HG2  ILE  36          1HG2      ILE  36   0.847 -16.900  -4.160
  261   2HG2  ILE  36          2HG2      ILE  36   1.311 -17.654  -2.634
  262   3HG2  ILE  36          3HG2      ILE  36   2.350 -16.408  -3.351
  263   1HD1  ILE  36          1HD1      ILE  36  -0.565 -15.403   0.120
  264   2HD1  ILE  36          2HD1      ILE  36   0.872 -14.749   0.928
  265   3HD1  ILE  36          3HD1      ILE  36   0.060 -13.808  -0.333
  266    H    ILE  37           H        ILE  37   0.647 -11.933  -2.208
  267    HA   ILE  37           HA       ILE  37  -2.335 -11.617  -2.072
  268    HB   ILE  37           HB       ILE  37  -1.940  -9.530  -0.909
  269   1HG1  ILE  37          1HG1      ILE  37   0.962 -10.345  -0.755
  270   2HG1  ILE  37          2HG1      ILE  37   0.363  -9.059  -1.826
  271   1HG2  ILE  37          1HG2      ILE  37  -0.469 -11.775   0.516
  272   2HG2  ILE  37          2HG2      ILE  37  -2.225 -11.795   0.239
  273   3HG2  ILE  37          3HG2      ILE  37  -1.504 -10.503   1.199
  274   1HD1  ILE  37          1HD1      ILE  37  -0.507  -7.859   0.181
  275   2HD1  ILE  37          2HD1      ILE  37   1.259  -8.033   0.133
  276   3HD1  ILE  37          3HD1      ILE  37   0.307  -9.076   1.205
  277    H    ALA  38           H        ALA  38   0.493 -10.549  -3.932
  278    HA   ALA  38           HA       ALA  38  -0.227  -8.344  -5.194
  279   1HB   ALA  38          1HB       ALA  38   0.589 -10.815  -6.771
  280   2HB   ALA  38          2HB       ALA  38   0.846  -9.121  -7.209
  281   3HB   ALA  38          3HB       ALA  38   1.697  -9.805  -5.810
  282    HA   PRO  39           HA       PRO  39  -3.506 -10.289  -8.174
  283   1HB   PRO  39          1HB       PRO  39  -4.810 -12.376  -6.471
  284   2HB   PRO  39          2HB       PRO  39  -4.418 -12.437  -8.210
  285   1HG   PRO  39          1HG       PRO  39  -2.956 -13.871  -6.406
  286   2HG   PRO  39          2HG       PRO  39  -2.131 -13.001  -7.741
  287   1HD   PRO  39          2HD       PRO  39  -2.625 -12.012  -4.922
  288   2HD   PRO  39          1HD       PRO  39  -1.081 -12.129  -5.725
  289    H    VAL  40           H        VAL  40  -3.976 -10.388  -4.639
  290    HA   VAL  40           HA       VAL  40  -6.660  -9.258  -4.614
  291    HB   VAL  40           HB       VAL  40  -4.474  -9.539  -2.471
  292   1HG1  VAL  40          1HG2      VAL  40  -6.237  -8.807  -0.867
  293   2HG1  VAL  40          2HG2      VAL  40  -5.527  -7.520  -1.832
  294   3HG1  VAL  40          3HG2      VAL  40  -7.132  -8.134  -2.258
  295   1HG2  VAL  40          1HG1      VAL  40  -5.590 -11.547  -3.195
  296   2HG2  VAL  40          2HG1      VAL  40  -6.092 -11.080  -1.545
  297   3HG2  VAL  40          3HG1      VAL  40  -7.178 -10.771  -2.940
  298    H    VAL  41           H        VAL  41  -3.302  -8.082  -4.211
  299    HA   VAL  41           HA       VAL  41  -4.049  -5.478  -3.589
  300    HB   VAL  41           HB       VAL  41  -1.540  -6.416  -5.088
  301   1HG1  VAL  41          1HG1      VAL  41  -1.910  -5.881  -2.106
  302   2HG1  VAL  41          2HG1      VAL  41  -0.428  -6.434  -2.916
  303   3HG1  VAL  41          3HG1      VAL  41  -1.829  -7.491  -2.823
  304   1HG2  VAL  41          1HG2      VAL  41  -1.709  -4.025  -5.345
  305   2HG2  VAL  41          2HG2      VAL  41  -0.486  -4.364  -4.114
  306   3HG2  VAL  41          3HG2      VAL  41  -2.096  -3.812  -3.617
  307    H    ASP  42           HN       ASP  42  -3.154  -6.862  -6.782
  308    HA   ASP  42           HA       ASP  42  -3.720  -4.573  -8.370
  309   1HB   ASP  42          1HB       ASP  42  -3.950  -7.496  -9.137
  310   2HB   ASP  42          2HB       ASP  42  -3.833  -6.088 -10.231
  311    H    GLU  43           HN       GLU  43  -5.796  -7.435  -7.623
  312    HA   GLU  43           HA       GLU  43  -8.051  -6.635  -9.074
  313   1HB   GLU  43          2HB       GLU  43  -7.997  -8.832  -7.907
  314   2HB   GLU  43          1HB       GLU  43  -7.885  -7.910  -6.374
  315   1HG   GLU  43          1HG       GLU  43 -10.121  -8.890  -6.700
  316   2HG   GLU  43          2HG       GLU  43 -10.057  -7.151  -6.396
  317    H    ILE  44           H        ILE  44  -7.256  -5.917  -5.635
  318    HA   ILE  44           HA       ILE  44  -9.508  -4.279  -5.089
  319    HB   ILE  44           HB       ILE  44  -6.681  -4.383  -3.981
  320   1HG1  ILE  44          2HG1      ILE  44  -8.612  -6.144  -3.683
  321   2HG1  ILE  44          1HG1      ILE  44  -7.606  -5.692  -2.292
  322   1HG2  ILE  44          1HG2      ILE  44  -8.940  -2.581  -3.115
  323   2HG2  ILE  44          2HG2      ILE  44  -7.307  -2.100  -3.623
  324   3HG2  ILE  44          3HG2      ILE  44  -7.527  -2.979  -2.098
  325   1HD1  ILE  44          1HD1      ILE  44 -10.029  -5.908  -1.805
  326   2HD1  ILE  44          2HD1      ILE  44 -10.371  -4.583  -2.923
  327   3HD1  ILE  44          3HD1      ILE  44  -9.423  -4.284  -1.444
  328    H    ALA  45           H        ALA  45  -6.324  -3.447  -6.471
  329    HA   ALA  45           HA       ALA  45  -6.742  -0.678  -6.865
  330   1HB   ALA  45          1HB       ALA  45  -4.837  -2.612  -7.695
  331   2HB   ALA  45          2HB       ALA  45  -4.816  -0.871  -7.944
  332   3HB   ALA  45          3HB       ALA  45  -5.479  -1.936  -9.197
  333    H    GLY  46           H        GLY  46  -7.736  -3.485  -8.859
  334   1HA   GLY  46          2HA       GLY  46  -9.066  -2.069 -10.941
  335   2HA   GLY  46          1HA       GLY  46  -9.391  -3.730 -10.422
  336    H    GLU  47           HN       GLU  47 -10.514  -3.731  -8.045
  337    HA   GLU  47           HA       GLU  47 -13.129  -3.143  -8.269
  338   1HB   GLU  47          1HB       GLU  47 -11.414  -2.976  -5.750
  339   2HB   GLU  47          2HB       GLU  47 -13.171  -2.985  -5.773
  340   1HG   GLU  47          1HG       GLU  47 -13.207  -5.224  -6.779
  341   2HG   GLU  47          2HG       GLU  47 -11.439  -5.239  -6.819
  342    H    TYR  48           H        TYR  48 -10.748  -0.910  -6.832
  343    HA   TYR  48           HA       TYR  48 -12.854   1.254  -6.938
  344   1HB   TYR  48          1HB       TYR  48 -10.543   1.257  -5.021
  345   2HB   TYR  48          2HB       TYR  48 -12.126   2.067  -4.972
  346    HD1  TYR  48           HD1      TYR  48 -14.156   0.900  -4.282
  347    HD2  TYR  48           HD2      TYR  48 -10.276  -0.937  -4.028
  348    HE1  TYR  48           HE1      TYR  48 -14.973  -0.582  -2.464
  349    HE2  TYR  48           HE2      TYR  48 -11.151  -2.515  -2.304
  350    HH   TYR  48           HH       TYR  48 -14.500  -2.387  -1.111
  351    H    LYS  49           HN       LYS  49 -10.744   0.482  -8.986
  352    HA   LYS  49           HA       LYS  49  -8.594   2.056  -9.271
  353   1HB   LYS  49          1HB       LYS  49  -8.994   1.983 -11.714
  354   2HB   LYS  49          2HB       LYS  49  -9.333   0.433 -10.943
  355   1HG   LYS  49          1HG       LYS  49 -11.806   1.147 -10.917
  356   2HG   LYS  49          2HG       LYS  49 -11.323   2.457 -12.026
  357   1HD   LYS  49          1HD       LYS  49 -10.353   0.671 -13.542
  358   2HD   LYS  49          2HD       LYS  49 -11.100  -0.535 -12.475
  359   1HE   LYS  49          2HE       LYS  49 -12.515   1.649 -14.082
  360   2HE   LYS  49          1HE       LYS  49 -12.604  -0.100 -14.347
  361   1HZ   LYS  49          1HZ       LYS  49 -13.634   1.379 -12.019
  362   2HZ   LYS  49          2HZ       LYS  49 -13.650  -0.265 -12.167
  363   3HZ   LYS  49          3HZ       LYS  49 -14.522   0.670 -13.209
  364    H    ASP  50           HN       ASP  50 -11.853   3.128 -10.002
  365    HA   ASP  50           HA       ASP  50 -11.703   5.545 -11.101
  366   1HB   ASP  50          1HB       ASP  50 -13.468   4.611  -8.797
  367   2HB   ASP  50          2HB       ASP  50 -13.782   6.059  -9.772
  368    H    LYS  51           HN       LYS  51 -11.132   5.023  -7.634
  369    HA   LYS  51           HA       LYS  51  -9.812   7.716  -7.529
  370   1HB   LYS  51          1HB       LYS  51 -11.630   6.943  -5.190
  371   2HB   LYS  51          2HB       LYS  51 -10.813   8.422  -5.553
  372   1HG   LYS  51          1HG       LYS  51 -12.937   9.039  -6.063
  373   2HG   LYS  51          2HG       LYS  51 -12.329   8.604  -7.658
  374   1HD   LYS  51          1HD       LYS  51 -14.587   7.765  -7.332
  375   2HD   LYS  51          2HD       LYS  51 -13.486   6.393  -7.450
  376   1HE   LYS  51          2HE       LYS  51 -13.598   5.959  -5.077
  377   2HE   LYS  51          1HE       LYS  51 -14.443   7.493  -4.783
  378   1HZ   LYS  51          1HZ       LYS  51 -15.480   5.219  -6.322
  379   2HZ   LYS  51          2HZ       LYS  51 -15.914   5.630  -4.787
  380   3HZ   LYS  51          3HZ       LYS  51 -16.278   6.634  -6.041
  381    H    LEU  52           H        LEU  52 -10.681   4.859  -5.673
  382    HA   LEU  52           HA       LEU  52  -8.971   5.666  -3.521
  383   1HB   LEU  52          1HB       LEU  52 -11.286   4.968  -3.322
  384   2HB   LEU  52          2HB       LEU  52 -10.887   3.405  -4.040
  385    HG   LEU  52           HG       LEU  52  -9.861   2.725  -1.998
  386   1HD1  LEU  52          1HD1      LEU  52  -8.974   5.008  -1.214
  387   2HD1  LEU  52          2HD1      LEU  52  -9.962   4.222   0.028
  388   3HD1  LEU  52          3HD1      LEU  52 -10.643   5.509  -0.995
  389   1HD2  LEU  52          1HD2      LEU  52 -12.559   3.991  -1.521
  390   2HD2  LEU  52          2HD2      LEU  52 -11.824   2.671  -0.585
  391   3HD2  LEU  52          3HD2      LEU  52 -12.247   2.419  -2.284
  392    H    LYS  53           HN       LYS  53  -8.101   3.829  -2.338
  393    HA   LYS  53           HA       LYS  53  -5.819   3.721  -2.933
  394   1HB   LYS  53          2HB       LYS  53  -5.845   2.310  -0.554
  395   2HB   LYS  53          1HB       LYS  53  -6.970   3.626  -0.662
  396   1HG   LYS  53          1HG       LYS  53  -8.644   2.232  -0.293
  397   2HG   LYS  53          2HG       LYS  53  -8.261   1.316  -1.783
  398   1HD   LYS  53          1HD       LYS  53  -6.880  -0.215  -0.555
  399   2HD   LYS  53          2HD       LYS  53  -7.033   0.777   0.904
  400   1HE   LYS  53          2HE       LYS  53  -8.522  -1.239   0.912
  401   2HE   LYS  53          1HE       LYS  53  -9.499   0.242   0.925
  402   1HZ   LYS  53          1HZ       LYS  53  -8.883  -1.351  -1.440
  403   2HZ   LYS  53          2HZ       LYS  53  -9.851  -0.017  -1.389
  404   3HZ   LYS  53          3HZ       LYS  53 -10.297  -1.387  -0.594
  405    H    CYS  54           H        CYS  54  -4.544   2.661  -4.478
  406    HA   CYS  54           HA       CYS  54  -3.472   0.191  -3.301
  407   1HB   CYS  54          2HB       CYS  54  -5.296  -0.695  -4.791
  408   2HB   CYS  54          1HB       CYS  54  -4.574   0.257  -6.101
  409    HG   CYS  54           HG       CYS  54  -4.075  -2.489  -5.864
  410    H    VAL  55           H        VAL  55  -1.297   0.319  -3.361
  411    HA   VAL  55           HA       VAL  55  -0.026   0.819  -5.919
  412    HB   VAL  55           HB       VAL  55   1.564   2.354  -4.120
  413   1HG1  VAL  55          1HG1      VAL  55  -0.450   2.788  -2.696
  414   2HG1  VAL  55          2HG1      VAL  55   0.270   4.226  -3.435
  415   3HG1  VAL  55          3HG1      VAL  55  -1.219   3.558  -4.109
  416   1HG2  VAL  55          1HG2      VAL  55   1.129   4.138  -5.742
  417   2HG2  VAL  55          2HG2      VAL  55   1.459   2.594  -6.526
  418   3HG2  VAL  55          3HG2      VAL  55  -0.210   3.190  -6.436
  419    H    LYS  56           HN       LYS  56   2.367   0.373  -5.755
  420    HA   LYS  56           HA       LYS  56   2.957  -1.568  -3.565
  421   1HB   LYS  56          2HB       LYS  56   2.449  -2.000  -6.399
  422   2HB   LYS  56          1HB       LYS  56   4.083  -2.523  -5.982
  423   1HG   LYS  56          2HG       LYS  56   3.186  -3.858  -4.082
  424   2HG   LYS  56          1HG       LYS  56   1.547  -3.344  -4.508
  425   1HD   LYS  56          2HD       LYS  56   3.410  -4.942  -6.336
  426   2HD   LYS  56          1HD       LYS  56   2.165  -5.642  -5.286
  427   1HE   LYS  56          2HE       LYS  56   0.438  -4.233  -6.468
  428   2HE   LYS  56          1HE       LYS  56   1.679  -3.730  -7.625
  429   1HZ   LYS  56          1HZ       LYS  56   1.962  -6.008  -8.237
  430   2HZ   LYS  56          2HZ       LYS  56   0.371  -5.584  -8.381
  431   3HZ   LYS  56          3HZ       LYS  56   0.861  -6.504  -7.111
  432    H    LEU  57           H        LEU  57   4.679  -0.812  -2.497
  433    HA   LEU  57           HA       LEU  57   6.703   0.843  -3.941
  434   1HB   LEU  57          1HB       LEU  57   5.726   1.791  -1.895
  435   2HB   LEU  57          2HB       LEU  57   6.277   0.377  -0.988
  436    HG   LEU  57           HG       LEU  57   8.638   1.233  -2.203
  437   1HD1  LEU  57          1HD2      LEU  57   9.096   2.275   0.035
  438   2HD1  LEU  57          2HD2      LEU  57   7.383   2.043   0.426
  439   3HD1  LEU  57          3HD2      LEU  57   8.428   0.632   0.099
  440   1HD2  LEU  57          1HD1      LEU  57   8.754   3.659  -2.009
  441   2HD2  LEU  57          2HD1      LEU  57   7.060   3.733  -1.497
  442   3HD2  LEU  57          3HD1      LEU  57   7.467   3.230  -3.152
  443    H    ASN  58           H        ASN  58   8.437  -0.145  -4.714
  444    HA   ASN  58           HA       ASN  58   9.135  -2.841  -3.797
  445   1HB   ASN  58          2HB       ASN  58   9.520  -2.151  -6.139
  446   2HB   ASN  58          1HB       ASN  58  10.701  -0.954  -5.592
  447   1HD2  ASN  58          2HD2      ASN  58  10.509  -4.011  -6.883
  448   2HD2  ASN  58          1HD2      ASN  58  12.007  -4.657  -6.236
  449    H    THR  59           H        THR  59  10.039  -3.185  -1.944
  450    HA   THR  59           HA       THR  59  10.970  -1.070  -0.235
  451    HB   THR  59           HB       THR  59  11.241  -4.085   0.115
  452    HG1  THR  59           HG1      THR  59   9.109  -3.620  -0.362
  453   1HG2  THR  59          1HG2      THR  59  10.988  -3.556   2.510
  454   2HG2  THR  59          2HG2      THR  59  10.883  -1.826   2.131
  455   3HG2  THR  59          3HG2      THR  59  12.401  -2.713   1.849
  456    H    ASP  60           HN       ASP  60  12.572  -3.344  -2.378
  457    HA   ASP  60           HA       ASP  60  15.223  -3.197  -1.215
  458   1HB   ASP  60          1HB       ASP  60  14.033  -4.985  -2.748
  459   2HB   ASP  60          2HB       ASP  60  14.552  -3.958  -4.079
  460    H    GLU  61           HN       GLU  61  13.380  -1.672  -3.767
  461    HA   GLU  61           HA       GLU  61  15.447   0.131  -4.716
  462   1HB   GLU  61          1HB       GLU  61  13.163  -0.802  -5.772
  463   2HB   GLU  61          2HB       GLU  61  12.479   0.610  -5.077
  464   1HG   GLU  61          1HG       GLU  61  13.037   1.136  -7.314
  465   2HG   GLU  61          2HG       GLU  61  14.314   1.925  -6.387
  466    H    SER  62           H        SER  62  12.900   0.219  -2.337
  467    HA   SER  62           HA       SER  62  13.391   3.098  -1.686
  468   1HB   SER  62          1HB       SER  62  10.939   1.484  -1.002
  469   2HB   SER  62          2HB       SER  62  11.189   3.245  -1.058
  470    HG   SER  62           HG       SER  62  10.963   1.337  -3.126
  471    HA   PRO  63           HA       PRO  63  14.585   0.419   2.121
  472   1HB   PRO  63          2HB       PRO  63  17.207   1.239   2.291
  473   2HB   PRO  63          1HB       PRO  63  16.629  -0.123   1.297
  474   1HG   PRO  63          1HG       PRO  63  17.252   2.624   0.286
  475   2HG   PRO  63          2HG       PRO  63  17.772   1.048  -0.370
  476   1HD   PRO  63          1HD       PRO  63  15.593   2.338  -1.347
  477   2HD   PRO  63          2HD       PRO  63  15.570   0.560  -1.195
  478    H    ASN  64           H        ASN  64  15.430   3.419   0.807
  479    HA   ASN  64           HA       ASN  64  15.730   5.284   2.868
  480   1HB   ASN  64          2HB       ASN  64  14.276   5.499   0.197
  481   2HB   ASN  64          1HB       ASN  64  14.388   6.859   1.311
  482   1HD2  ASN  64          1HD2      ASN  64  15.537   7.682  -0.857
  483   2HD2  ASN  64          2HD2      ASN  64  17.271   7.411  -0.865
  484    H    VAL  65           H        VAL  65  12.569   4.928   1.301
  485    HA   VAL  65           HA       VAL  65  10.980   6.116   3.255
  486    HB   VAL  65           HB       VAL  65  10.300   3.809   1.368
  487   1HG1  VAL  65          1HG2      VAL  65   7.998   4.612   1.521
  488   2HG1  VAL  65          2HG2      VAL  65   8.499   5.858   2.700
  489   3HG1  VAL  65          3HG2      VAL  65   8.583   4.140   3.119
  490   1HG2  VAL  65          1HG1      VAL  65  10.242   6.828   0.982
  491   2HG2  VAL  65          2HG1      VAL  65   9.438   5.666  -0.099
  492   3HG2  VAL  65          3HG1      VAL  65  11.194   5.628   0.080
  493    H    ALA  66           H        ALA  66  11.747   2.728   2.745
  494    HA   ALA  66           HA       ALA  66  10.273   1.565   4.835
  495   1HB   ALA  66          1HB       ALA  66  11.466   0.304   3.044
  496   2HB   ALA  66          2HB       ALA  66  11.772  -0.353   4.664
  497   3HB   ALA  66          3HB       ALA  66  13.007   0.623   3.865
  498    H    SER  67           H        SER  67  13.534   3.024   4.996
  499    HA   SER  67           HA       SER  67  13.942   2.382   7.798
  500   1HB   SER  67          2HB       SER  67  15.379   4.384   5.997
  501   2HB   SER  67          1HB       SER  67  15.929   3.783   7.573
  502    HG   SER  67           HG       SER  67  15.504   2.258   5.211
  503    H    GLU  68           HN       GLU  68  12.882   5.230   5.949
  504    HA   GLU  68           HA       GLU  68  12.786   7.122   8.069
  505   1HB   GLU  68          1HB       GLU  68  11.064   6.814   5.577
  506   2HB   GLU  68          2HB       GLU  68  10.983   8.210   6.649
  507   1HG   GLU  68          2HG       GLU  68  13.165   8.936   6.130
  508   2HG   GLU  68          1HG       GLU  68  13.659   7.373   5.485
  509    H    TYR  69           H        TYR  69  10.301   4.785   6.928
  510    HA   TYR  69           HA       TYR  69   8.520   5.453   9.182
  511   1HB   TYR  69          2HB       TYR  69   8.455   3.447   6.909
  512   2HB   TYR  69          1HB       TYR  69   7.370   3.304   8.286
  513    HD1  TYR  69           HD1      TYR  69   8.178   5.342   5.307
  514    HD2  TYR  69           HD2      TYR  69   5.739   5.089   8.848
  515    HE1  TYR  69           HE1      TYR  69   6.994   7.426   4.650
  516    HE2  TYR  69           HE2      TYR  69   4.572   7.176   8.194
  517    HH   TYR  69           HH       TYR  69   4.627   9.001   6.787
  518    H    GLY  70           H        GLY  70  10.889   2.912   8.390
  519   1HA   GLY  70          2HA       GLY  70  12.313   1.936   9.942
  520   2HA   GLY  70          1HA       GLY  70  11.260   2.421  11.273
  521    H    ILE  71           H        ILE  71  10.756   0.484   8.246
  522    HA   ILE  71           HA       ILE  71   9.478  -1.654   9.881
  523    HB   ILE  71           HB       ILE  71   8.487  -2.336   7.826
  524   1HG1  ILE  71          1HG1      ILE  71   9.798  -0.052   6.340
  525   2HG1  ILE  71          2HG1      ILE  71  10.486  -1.680   6.330
  526   1HG2  ILE  71          1HG2      ILE  71   8.247   0.700   8.044
  527   2HG2  ILE  71          2HG2      ILE  71   7.049  -0.434   7.412
  528   3HG2  ILE  71          3HG2      ILE  71   7.459  -0.466   9.129
  529   1HD1  ILE  71          1HD1      ILE  71   7.750  -0.905   5.286
  530   2HD1  ILE  71          2HD1      ILE  71   9.171  -1.463   4.378
  531   3HD1  ILE  71          3HD1      ILE  71   8.329  -2.579   5.461
  532    H    ARG  72           HN       ARG  72   9.824  -3.804   8.243
  533    HA   ARG  72           HA       ARG  72  12.574  -4.184   7.446
  534   1HB   ARG  72          2HB       ARG  72  12.774  -6.173   9.133
  535   2HB   ARG  72          1HB       ARG  72  13.253  -4.553   9.605
  536   1HG   ARG  72          1HG       ARG  72  11.485  -4.200  11.039
  537   2HG   ARG  72          2HG       ARG  72  10.423  -5.390  10.285
  538   1HD   ARG  72          1HD       ARG  72  12.961  -6.058  11.807
  539   2HD   ARG  72          2HD       ARG  72  11.323  -6.143  12.488
  540    HE   ARG  72           HE       ARG  72  10.929  -7.711  10.386
  541   1HH1  ARG  72          2HH1      ARG  72  13.623  -7.825  12.684
  542   2HH1  ARG  72          1HH1      ARG  72  14.057  -9.458  12.260
  543   1HH2  ARG  72          2HH2      ARG  72  11.479  -9.707   9.815
  544   2HH2  ARG  72          1HH2      ARG  72  12.775 -10.598  10.599
  545    H    SER  73           H        SER  73  10.421  -6.705   8.826
  546    HA   SER  73           HA       SER  73  10.462  -8.288   6.556
  547   1HB   SER  73          1HB       SER  73   8.098  -8.115   8.442
  548   2HB   SER  73          2HB       SER  73   8.748  -9.553   7.643
  549    HG   SER  73           HG       SER  73   9.323  -9.296   9.921
  550    H    ILE  74           H        ILE  74   8.744  -8.802   5.016
  551    HA   ILE  74           HA       ILE  74   6.715  -6.791   4.553
  552    HB   ILE  74           HB       ILE  74   7.362  -6.743   2.079
  553   1HG1  ILE  74          1HG1      ILE  74  10.117  -7.549   3.021
  554   2HG1  ILE  74          2HG1      ILE  74   8.991  -8.628   2.179
  555   1HG2  ILE  74          1HG2      ILE  74   7.665  -4.860   3.747
  556   2HG2  ILE  74          2HG2      ILE  74   9.344  -5.400   3.960
  557   3HG2  ILE  74          3HG2      ILE  74   8.776  -4.820   2.386
  558   1HD1  ILE  74          1HD1      ILE  74  10.335  -7.681   0.454
  559   2HD1  ILE  74          2HD1      ILE  74   8.792  -6.850   0.356
  560   3HD1  ILE  74          3HD1      ILE  74  10.188  -6.047   1.108
  561    HA   PRO  75           HA       PRO  75   5.180  -6.879   2.240
  562   1HB   PRO  75          1HB       PRO  75   2.484  -7.352   2.545
  563   2HB   PRO  75          2HB       PRO  75   3.481  -7.892   1.191
  564   1HG   PRO  75          1HG       PRO  75   2.665  -9.395   3.684
  565   2HG   PRO  75          2HG       PRO  75   2.641 -10.018   2.008
  566   1HD   PRO  75          2HD       PRO  75   4.675 -10.607   3.771
  567   2HD   PRO  75          1HD       PRO  75   4.991 -10.348   2.046
  568    H    THR  76           H        THR  76   4.606  -5.066   3.092
  569    HA   THR  76           HA       THR  76   3.403  -4.852   5.796
  570    HB   THR  76           HB       THR  76   5.920  -3.394   4.909
  571    HG1  THR  76           HG1      THR  76   6.569  -5.047   6.170
  572   1HG2  THR  76          1HG2      THR  76   3.928  -2.751   7.132
  573   2HG2  THR  76          2HG2      THR  76   5.579  -2.117   7.054
  574   3HG2  THR  76          3HG2      THR  76   4.413  -1.694   5.787
  575    H    ILE  77           H        ILE  77   1.495  -4.149   5.234
  576    HA   ILE  77           HA       ILE  77   1.090  -2.596   2.731
  577    HB   ILE  77           HB       ILE  77  -0.941  -4.189   4.339
  578   1HG1  ILE  77          1HG1      ILE  77   0.619  -5.215   1.934
  579   2HG1  ILE  77          2HG1      ILE  77   0.855  -5.753   3.606
  580   1HG2  ILE  77          1HG2      ILE  77  -1.669  -2.401   2.726
  581   2HG2  ILE  77          2HG2      ILE  77  -0.890  -3.310   1.416
  582   3HG2  ILE  77          3HG2      ILE  77  -2.265  -4.010   2.303
  583   1HD1  ILE  77          1HD1      ILE  77  -1.636  -6.166   1.943
  584   2HD1  ILE  77          2HD1      ILE  77  -1.560  -6.409   3.707
  585   3HD1  ILE  77          3HD1      ILE  77  -0.534  -7.370   2.637
  586    H    MET  78           H        MET  78   1.125  -0.447   3.255
  587    HA   MET  78           HA       MET  78  -0.206   0.350   5.824
  588   1HB   MET  78          2HB       MET  78   1.558   2.000   4.059
  589   2HB   MET  78          1HB       MET  78   0.992   2.423   5.673
  590   1HG   MET  78          2HG       MET  78   2.381   0.541   6.593
  591   2HG   MET  78          1HG       MET  78   3.012   0.272   4.958
  592   1HE   MET  78          1HE       MET  78   6.109   1.857   6.639
  593   2HE   MET  78          2HE       MET  78   4.957   0.685   7.330
  594   3HE   MET  78          3HE       MET  78   5.485   0.534   5.630
  595    H    VAL  79           H        VAL  79  -1.567   2.138   5.787
  596    HA   VAL  79           HA       VAL  79  -2.715   2.858   3.119
  597    HB   VAL  79           HB       VAL  79  -4.272   1.567   5.062
  598   1HG1  VAL  79          1HG2      VAL  79  -6.143   2.336   3.538
  599   2HG1  VAL  79          2HG2      VAL  79  -4.740   1.824   2.577
  600   3HG1  VAL  79          3HG2      VAL  79  -5.059   3.549   2.839
  601   1HG2  VAL  79          1HG1      VAL  79  -5.049   4.506   5.056
  602   2HG2  VAL  79          2HG1      VAL  79  -5.933   3.149   5.773
  603   3HG2  VAL  79          3HG1      VAL  79  -4.372   3.623   6.433
  604    H    PHE  80           H        PHE  80  -2.602   4.835   2.640
  605    HA   PHE  80           HA       PHE  80  -2.033   6.858   4.747
  606   1HB   PHE  80          1HB       PHE  80  -0.955   6.576   1.916
  607   2HB   PHE  80          2HB       PHE  80  -0.870   8.075   2.828
  608    HD1  PHE  80           HD1      PHE  80   0.158   4.445   3.180
  609    HD2  PHE  80           HD2      PHE  80   1.079   8.569   3.972
  610    HE1  PHE  80           HE1      PHE  80   2.540   3.850   3.677
  611    HE2  PHE  80           HE2      PHE  80   3.412   7.967   4.481
  612    HZ   PHE  80           HZ       PHE  80   4.112   5.568   4.467
  613    H    LYS  81           HN       LYS  81  -3.154   8.848   4.368
  614    HA   LYS  81           HA       LYS  81  -4.663   9.360   2.008
  615   1HB   LYS  81          1HB       LYS  81  -6.893   9.221   2.740
  616   2HB   LYS  81          2HB       LYS  81  -6.202   7.655   3.179
  617   1HG   LYS  81          1HG       LYS  81  -6.787   9.930   5.101
  618   2HG   LYS  81          2HG       LYS  81  -7.685   8.424   4.870
  619   1HD   LYS  81          2HD       LYS  81  -5.385   7.248   5.337
  620   2HD   LYS  81          1HD       LYS  81  -4.920   8.799   6.057
  621   1HE   LYS  81          2HE       LYS  81  -7.296   7.036   6.813
  622   2HE   LYS  81          1HE       LYS  81  -5.820   7.269   7.742
  623   1HZ   LYS  81          1HZ       LYS  81  -7.778   9.368   7.157
  624   2HZ   LYS  81          2HZ       LYS  81  -7.569   8.613   8.606
  625   3HZ   LYS  81          3HZ       LYS  81  -6.376   9.575   7.999
  626    H    GLY  82           H        GLY  82  -5.562  11.627   2.199
  627   1HA   GLY  82          2HA       GLY  82  -5.160  13.808   2.993
  628   2HA   GLY  82          1HA       GLY  82  -5.134  13.047   4.622
  629    H    GLY  83           H        GLY  83  -3.031  12.207   1.882
  630   1HA   GLY  83          1HA       GLY  83  -0.850  12.161   1.569
  631   2HA   GLY  83          2HA       GLY  83  -0.626  13.494   2.698
  632    H    LYS  84           HN       LYS  84  -1.401  12.379   5.092
  633    HA   LYS  84           HA       LYS  84   1.004  10.820   5.640
  634   1HB   LYS  84          1HB       LYS  84  -1.220  11.787   7.480
  635   2HB   LYS  84          2HB       LYS  84   0.314  11.070   8.004
  636   1HG   LYS  84          1HG       LYS  84   1.472  12.906   6.587
  637   2HG   LYS  84          2HG       LYS  84  -0.096  13.725   6.581
  638   1HD   LYS  84          2HD       LYS  84   1.487  12.858   9.057
  639   2HD   LYS  84          1HD       LYS  84   1.436  14.497   8.392
  640   1HE   LYS  84          1HE       LYS  84  -1.047  14.555   8.767
  641   2HE   LYS  84          2HE       LYS  84  -0.954  12.950   9.516
  642   1HZ   LYS  84          1HZ       LYS  84   0.498  13.864  11.166
  643   2HZ   LYS  84          2HZ       LYS  84  -0.936  14.673  11.136
  644   3HZ   LYS  84          3HZ       LYS  84   0.409  15.360  10.479
  645    H    LYS  85           HN       LYS  85   1.009   9.097   7.206
  646    HA   LYS  85           HA       LYS  85  -0.353   6.747   6.175
  647   1HB   LYS  85          2HB       LYS  85   2.139   7.028   6.856
  648   2HB   LYS  85          1HB       LYS  85   1.563   6.997   8.511
  649   1HG   LYS  85          2HG       LYS  85   0.394   4.666   7.505
  650   2HG   LYS  85          1HG       LYS  85   1.783   4.843   6.460
  651   1HD   LYS  85          2HD       LYS  85   2.705   3.580   8.133
  652   2HD   LYS  85          1HD       LYS  85   3.115   5.178   8.750
  653   1HE   LYS  85          1HE       LYS  85   0.724   3.437   9.543
  654   2HE   LYS  85          2HE       LYS  85   2.200   3.654  10.496
  655   1HZ   LYS  85          1HZ       LYS  85   0.290   5.775   9.827
  656   2HZ   LYS  85          2HZ       LYS  85   1.641   5.950  10.755
  657   3HZ   LYS  85          3HZ       LYS  85   0.392   4.996  11.267
  658    H    CYS  86           H        CYS  86  -1.655   5.327   7.431
  659    HA   CYS  86           HA       CYS  86  -2.298   6.098  10.252
  660   1HB   CYS  86          1HB       CYS  86  -4.093   7.011   9.026
  661   2HB   CYS  86          2HB       CYS  86  -4.282   5.568   8.007
  662    HG   CYS  86           HG       CYS  86  -4.647   5.907  11.285
  663    H    GLU  87           HN       GLU  87  -3.675   3.591   8.143
  664    HA   GLU  87           HA       GLU  87  -3.003   1.520   9.992
  665   1HB   GLU  87          1HB       GLU  87  -3.927   1.390   7.120
  666   2HB   GLU  87          2HB       GLU  87  -3.861   0.009   8.208
  667   1HG   GLU  87          2HG       GLU  87  -5.567   2.512   8.735
  668   2HG   GLU  87          1HG       GLU  87  -6.136   1.012   8.045
  669    H    THR  88           H        THR  88  -1.589  -0.170   9.799
  670    HA   THR  88           HA       THR  88   0.510  -0.296   7.745
  671    HB   THR  88           HB       THR  88   1.641   1.217   9.112
  672    HG1  THR  88           HG1      THR  88   2.258  -1.374  10.075
  673   1HG2  THR  88          1HG2      THR  88   1.836   1.014  11.587
  674   2HG2  THR  88          2HG2      THR  88   0.182   1.366  11.078
  675   3HG2  THR  88          3HG2      THR  88   0.626  -0.280  11.580
  676    H    ILE  89           H        ILE  89  -0.816  -2.134   7.282
  677    HA   ILE  89           HA       ILE  89  -1.066  -4.265   9.312
  678    HB   ILE  89           HB       ILE  89  -1.904  -4.252   6.381
  679   1HG1  ILE  89          1HG1      ILE  89  -3.043  -2.362   7.281
  680   2HG1  ILE  89          2HG1      ILE  89  -4.170  -3.710   7.220
  681   1HG2  ILE  89          1HG2      ILE  89  -1.953  -6.487   7.370
  682   2HG2  ILE  89          2HG2      ILE  89  -3.599  -5.901   7.143
  683   3HG2  ILE  89          3HG2      ILE  89  -2.883  -5.889   8.763
  684   1HD1  ILE  89          1HD1      ILE  89  -4.443  -2.408   9.275
  685   2HD1  ILE  89          2HD1      ILE  89  -3.947  -4.059   9.661
  686   3HD1  ILE  89          3HD1      ILE  89  -2.781  -2.719   9.755
  687    H    ILE  90           H        ILE  90  -0.144  -6.420   8.774
  688    HA   ILE  90           HA       ILE  90   2.274  -6.328   7.048
  689    HB   ILE  90           HB       ILE  90   2.338  -7.082  10.007
  690   1HG1  ILE  90          2HG1      ILE  90   3.478  -4.660   8.537
  691   2HG1  ILE  90          1HG1      ILE  90   2.204  -4.650   9.768
  692   1HG2  ILE  90          1HG2      ILE  90   4.776  -7.342   9.652
  693   2HG2  ILE  90          2HG2      ILE  90   4.581  -6.939   7.934
  694   3HG2  ILE  90          3HG2      ILE  90   3.902  -8.436   8.612
  695   1HD1  ILE  90          1HD1      ILE  90   3.866  -5.555  11.424
  696   2HD1  ILE  90          2HD1      ILE  90   5.138  -5.228  10.215
  697   3HD1  ILE  90          3HD1      ILE  90   4.153  -3.903  10.841
  698    H    GLY  91           H        GLY  91   2.908  -8.319   6.285
  699   1HA   GLY  91          2HA       GLY  91   2.865 -10.604   5.948
  700   2HA   GLY  91          1HA       GLY  91   1.690 -10.802   7.258
  701    H    ALA  92           H        ALA  92   1.147 -12.340   5.214
  702    HA   ALA  92           HA       ALA  92  -0.386 -11.126   3.089
  703   1HB   ALA  92          1HB       ALA  92   0.665 -13.354   2.874
  704   2HB   ALA  92          2HB       ALA  92  -0.385 -13.985   4.165
  705   3HB   ALA  92          3HB       ALA  92  -1.091 -13.453   2.623
  706    H    VAL  93           H        VAL  93  -2.770 -11.246   2.859
  707    HA   VAL  93           HA       VAL  93  -4.291 -11.645   5.335
  708    HB   VAL  93           HB       VAL  93  -5.292  -9.313   4.025
  709   1HG1  VAL  93          1HG1      VAL  93  -3.547  -7.641   4.493
  710   2HG1  VAL  93          2HG1      VAL  93  -2.972  -8.783   3.274
  711   3HG1  VAL  93          3HG1      VAL  93  -2.414  -8.905   4.965
  712   1HG2  VAL  93          1HG2      VAL  93  -4.178  -9.453   6.779
  713   2HG2  VAL  93          2HG2      VAL  93  -5.260  -8.218   6.071
  714   3HG2  VAL  93          3HG2      VAL  93  -5.833  -9.872   6.268
  715    HA   PRO  94           HA       PRO  94  -7.303 -12.638   2.053
  716   1HB   PRO  94          2HB       PRO  94  -9.444 -11.876   3.966
  717   2HB   PRO  94          1HB       PRO  94  -9.244 -13.413   3.119
  718   1HG   PRO  94          1HG       PRO  94  -8.713 -13.190   5.823
  719   2HG   PRO  94          2HG       PRO  94  -7.597 -14.139   4.788
  720   1HD   PRO  94          2HD       PRO  94  -7.374 -11.212   5.540
  721   2HD   PRO  94          1HD       PRO  94  -6.133 -12.442   5.805
  722    H    LYS  95           HN       LYS  95  -8.376 -11.237   0.622
  723    HA   LYS  95           HA       LYS  95  -7.940  -8.493   0.885
  724   1HB   LYS  95          1HB       LYS  95  -9.560  -8.305  -1.031
  725   2HB   LYS  95          2HB       LYS  95  -8.406  -9.641  -1.305
  726   1HG   LYS  95          2HG       LYS  95 -10.232 -11.217  -0.481
  727   2HG   LYS  95          1HG       LYS  95 -11.342  -9.840  -0.570
  728   1HD   LYS  95          2HD       LYS  95  -9.767 -11.051  -2.890
  729   2HD   LYS  95          1HD       LYS  95 -11.480 -11.254  -2.530
  730   1HE   LYS  95          2HE       LYS  95 -11.568  -9.626  -4.170
  731   2HE   LYS  95          1HE       LYS  95 -11.633  -8.640  -2.705
  732   1HZ   LYS  95          1HZ       LYS  95  -9.247  -8.292  -2.987
  733   2HZ   LYS  95          2HZ       LYS  95 -10.129  -7.767  -4.274
  734   3HZ   LYS  95          3HZ       LYS  95  -9.272  -9.175  -4.379
  735    H    ALA  96           H        ALA  96 -10.663 -10.442   1.665
  736    HA   ALA  96           HA       ALA  96 -12.705  -8.579   2.210
  737   1HB   ALA  96          1HB       ALA  96 -13.573 -10.224   3.848
  738   2HB   ALA  96          2HB       ALA  96 -12.024 -11.094   3.812
  739   3HB   ALA  96          3HB       ALA  96 -13.038 -11.017   2.354
  740    H    THR  97           H        THR  97 -10.165  -9.729   4.510
  741    HA   THR  97           HA       THR  97 -10.878  -8.067   6.664
  742    HB   THR  97           HB       THR  97  -8.103  -9.061   5.909
  743    HG1  THR  97           HG1      THR  97 -10.262 -10.423   7.165
  744   1HG2  THR  97          1HG2      THR  97  -7.836  -9.317   8.357
  745   2HG2  THR  97          2HG2      THR  97  -9.456  -8.636   8.617
  746   3HG2  THR  97          3HG2      THR  97  -8.165  -7.630   7.926
  747    H    ILE  98           H        ILE  98  -8.491  -7.570   3.994
  748    HA   ILE  98           HA       ILE  98  -7.544  -5.043   4.881
  749    HB   ILE  98           HB       ILE  98  -7.667  -6.507   2.233
  750   1HG1  ILE  98          2HG1      ILE  98  -5.943  -6.945   4.011
  751   2HG1  ILE  98          1HG1      ILE  98  -5.318  -6.554   2.409
  752   1HG2  ILE  98          1HG2      ILE  98  -8.082  -4.286   1.411
  753   2HG2  ILE  98          2HG2      ILE  98  -6.878  -3.575   2.505
  754   3HG2  ILE  98          3HG2      ILE  98  -6.374  -4.636   1.168
  755   1HD1  ILE  98          1HD1      ILE  98  -3.999  -5.446   4.165
  756   2HD1  ILE  98          2HD1      ILE  98  -5.422  -4.588   4.752
  757   3HD1  ILE  98          3HD1      ILE  98  -4.777  -4.257   3.132
  758    H    VAL  99           H        VAL  99 -10.217  -5.780   2.608
  759    HA   VAL  99           HA       VAL  99 -11.062  -3.142   2.123
  760    HB   VAL  99           HB       VAL  99 -12.533  -5.810   2.201
  761   1HG1  VAL  99          1HG2      VAL  99 -13.617  -3.085   1.397
  762   2HG1  VAL  99          2HG2      VAL  99 -14.320  -4.627   0.859
  763   3HG1  VAL  99          3HG2      VAL  99 -14.284  -4.243   2.579
  764   1HG2  VAL  99          1HG1      VAL  99 -11.659  -3.996  -0.086
  765   2HG2  VAL  99          2HG1      VAL  99 -12.415  -5.596  -0.235
  766   3HG2  VAL  99          3HG1      VAL  99 -10.787  -5.444   0.445
  767    H    GLN 100           H        GLN 100 -12.306  -5.403   4.663
  768    HA   GLN 100           HA       GLN 100 -13.990  -3.539   5.973
  769   1HB   GLN 100          1HB       GLN 100 -12.323  -5.834   7.085
  770   2HB   GLN 100          2HB       GLN 100 -13.595  -5.026   7.993
  771   1HG   GLN 100          2HG       GLN 100 -14.177  -6.368   5.311
  772   2HG   GLN 100          1HG       GLN 100 -14.114  -7.274   6.826
  773   1HE2  GLN 100          1HE2      GLN 100 -15.628  -4.292   5.426
  774   2HE2  GLN 100          2HE2      GLN 100 -17.131  -4.517   6.307
  775    H    THR 101           H        THR 101 -10.585  -4.133   6.413
  776    HA   THR 101           HA       THR 101 -10.223  -2.485   8.734
  777    HB   THR 101           HB       THR 101  -8.113  -3.292   6.649
  778    HG1  THR 101           HG1      THR 101  -9.187  -5.021   7.675
  779   1HG2  THR 101          1HG2      THR 101  -7.874  -2.272   9.509
  780   2HG2  THR 101          2HG2      THR 101  -7.310  -1.436   8.044
  781   3HG2  THR 101          3HG2      THR 101  -6.565  -2.966   8.534
  782    H    VAL 102           H        VAL 102 -10.095  -1.696   5.215
  783    HA   VAL 102           HA       VAL 102  -9.382   1.090   5.855
  784    HB   VAL 102           HB       VAL 102 -10.311  -0.154   3.282
  785   1HG1  VAL 102          1HG1      VAL 102  -7.537   0.424   4.387
  786   2HG1  VAL 102          2HG1      VAL 102  -8.214  -1.169   3.953
  787   3HG1  VAL 102          3HG1      VAL 102  -7.855   0.006   2.704
  788   1HG2  VAL 102          1HG2      VAL 102 -10.628   2.271   3.154
  789   2HG2  VAL 102          2HG2      VAL 102  -9.113   1.947   2.313
  790   3HG2  VAL 102          3HG2      VAL 102  -9.075   2.565   3.965
  791    H    GLU 103           HN       GLU 103 -12.354  -0.708   5.055
  792    HA   GLU 103           HA       GLU 103 -14.061   1.501   4.598
  793   1HB   GLU 103          1HB       GLU 103 -14.507  -1.281   5.729
  794   2HB   GLU 103          2HB       GLU 103 -15.828  -0.135   5.492
  795   1HG   GLU 103          1HG       GLU 103 -15.326   0.119   3.141
  796   2HG   GLU 103          2HG       GLU 103 -13.881  -0.887   3.253
  797    H    LYS 104           HN       LYS 104 -12.998   0.021   7.610
  798    HA   LYS 104           HA       LYS 104 -14.398   1.426   9.556
  799   1HB   LYS 104          1HB       LYS 104 -12.525  -0.213   9.915
  800   2HB   LYS 104          2HB       LYS 104 -11.389   1.044   9.398
  801   1HG   LYS 104          1HG       LYS 104 -12.173   2.466  11.351
  802   2HG   LYS 104          2HG       LYS 104 -13.126   1.065  11.891
  803   1HD   LYS 104          1HD       LYS 104 -11.016  -0.288  11.946
  804   2HD   LYS 104          2HD       LYS 104 -10.125   1.093  11.319
  805   1HE   LYS 104          2HE       LYS 104  -9.755   0.926  13.722
  806   2HE   LYS 104          1HE       LYS 104 -10.625   2.418  13.340
  807   1HZ   LYS 104          1HZ       LYS 104 -11.847  -0.068  14.329
  808   2HZ   LYS 104          2HZ       LYS 104 -12.649   1.335  14.003
  809   3HZ   LYS 104          3HZ       LYS 104 -11.548   1.282  15.226
  810    H    TYR 105           H        TYR 105 -11.874   2.669   7.392
  811    HA   TYR 105           HA       TYR 105 -11.992   5.420   8.500
  812   1HB   TYR 105          2HB       TYR 105  -9.973   3.974   6.724
  813   2HB   TYR 105          1HB       TYR 105  -9.842   5.655   7.253
  814    HD1  TYR 105           HD1      TYR 105  -9.066   2.231   7.964
  815    HD2  TYR 105           HD2      TYR 105  -9.779   6.054   9.799
  816    HE1  TYR 105           HE1      TYR 105  -8.078   1.407  10.060
  817    HE2  TYR 105           HE2      TYR 105  -8.626   5.272  11.875
  818    HH   TYR 105           HH       TYR 105  -6.867   2.263  12.004
  819    H    LEU 106           H        LEU 106 -13.893   3.937   6.390
  820    HA   LEU 106           HA       LEU 106 -14.326   6.276   4.787
  821   1HB   LEU 106          2HB       LEU 106 -13.169   3.778   3.492
  822   2HB   LEU 106          1HB       LEU 106 -14.410   4.720   2.675
  823    HG   LEU 106           HG       LEU 106 -11.585   5.564   3.260
  824   1HD1  LEU 106          1HD2      LEU 106 -13.922   7.400   2.562
  825   2HD1  LEU 106          2HD2      LEU 106 -12.807   7.572   3.938
  826   3HD1  LEU 106          3HD2      LEU 106 -12.212   7.812   2.306
  827   1HD2  LEU 106          1HD1      LEU 106 -13.441   5.551   0.816
  828   2HD2  LEU 106          2HD1      LEU 106 -11.767   6.089   0.815
  829   3HD2  LEU 106          3HD1      LEU 106 -12.149   4.383   1.156
  830    H    ASN 107           H        ASN 107 -16.302   6.398   5.556
  831    HA   ASN 107           HA       ASN 107 -18.376   4.730   4.608
  832   1HB   ASN 107          2HB       ASN 107 -17.441   3.486   6.723
  833   2HB   ASN 107          1HB       ASN 107 -18.096   4.842   7.644
  834   1HD2  ASN 107          2HD2      ASN 107 -20.549   5.263   6.216
  835   2HD2  ASN 107          1HD2      ASN 107 -21.553   3.822   6.455
  Start of MODEL   28
    1   1H    MET   1          1H        MET   1  -1.796  -1.545 -11.473
    2   2H    MET   1          2H        MET   1  -1.388  -2.864 -12.401
    3   3H    MET   1          3H        MET   1  -2.556  -2.978 -11.255
    4    HA   MET   1           HA       MET   1  -2.662  -1.581 -13.813
    5   1HB   MET   1          2HB       MET   1  -3.313  -3.967 -13.748
    6   2HB   MET   1          1HB       MET   1  -4.533  -3.630 -12.519
    7   1HG   MET   1          1HG       MET   1  -5.717  -2.141 -14.121
    8   2HG   MET   1          2HG       MET   1  -4.454  -2.437 -15.325
    9   1HE   MET   1          1HE       MET   1  -6.404  -2.975 -17.034
   10   2HE   MET   1          2HE       MET   1  -7.631  -2.769 -15.757
   11   3HE   MET   1          3HE       MET   1  -7.627  -4.239 -16.758
   12    H    GLU   2           HN       GLU   2  -5.114  -2.115 -11.167
   13    HA   GLU   2           HA       GLU   2  -6.024   0.659 -11.440
   14   1HB   GLU   2          1HB       GLU   2  -6.674  -1.559  -9.427
   15   2HB   GLU   2          2HB       GLU   2  -7.380   0.056  -9.430
   16   1HG   GLU   2          1HG       GLU   2  -8.926  -1.405 -10.552
   17   2HG   GLU   2          2HG       GLU   2  -8.227  -0.330 -11.761
   18    H    ALA   3           H        ALA   3  -4.426  -1.346  -8.970
   19    HA   ALA   3           HA       ALA   3  -3.202   0.847  -7.615
   20   1HB   ALA   3          1HB       ALA   3  -1.856  -0.931  -6.525
   21   2HB   ALA   3          2HB       ALA   3  -3.552  -1.465  -6.647
   22   3HB   ALA   3          3HB       ALA   3  -2.343  -2.089  -7.780
   23    H    GLY   4           H        GLY   4  -1.153   1.741  -7.848
   24   1HA   GLY   4          2HA       GLY   4   0.311   1.168 -10.395
   25   2HA   GLY   4          1HA       GLY   4   0.452   2.596  -9.363
   26    H    ALA   5           H        ALA   5   2.819   2.092  -9.652
   27    HA   ALA   5           HA       ALA   5   3.800   0.383  -7.443
   28   1HB   ALA   5          1HB       ALA   5   4.978   0.513 -10.252
   29   2HB   ALA   5          2HB       ALA   5   4.182  -0.899  -9.518
   30   3HB   ALA   5          3HB       ALA   5   5.710  -0.293  -8.847
   31    H    VAL   6           H        VAL   6   5.530   1.443  -6.341
   32    HA   VAL   6           HA       VAL   6   6.431   4.052  -7.425
   33    HB   VAL   6           HB       VAL   6   6.122   4.950  -4.982
   34   1HG1  VAL   6          1HG1      VAL   6   3.958   2.815  -4.941
   35   2HG1  VAL   6          2HG1      VAL   6   5.397   2.902  -3.916
   36   3HG1  VAL   6          3HG1      VAL   6   4.156   4.148  -3.790
   37   1HG2  VAL   6          1HG2      VAL   6   5.055   6.027  -6.767
   38   2HG2  VAL   6          2HG2      VAL   6   3.862   4.734  -6.957
   39   3HG2  VAL   6          3HG2      VAL   6   3.849   5.764  -5.500
   40    H    ASN   7           H        ASN   7   8.079   5.020  -6.123
   41    HA   ASN   7           HA       ASN   7   9.701   3.260  -4.494
   42   1HB   ASN   7          2HB       ASN   7  10.806   2.881  -6.618
   43   2HB   ASN   7          1HB       ASN   7  10.594   4.586  -7.088
   44   1HD2  ASN   7          2HD2      ASN   7  12.154   2.795  -4.359
   45   2HD2  ASN   7          1HD2      ASN   7  13.696   3.585  -4.520
   46    H    ASP   8           HN       ASP   8  11.463   4.727  -3.595
   47    HA   ASP   8           HA       ASP   8  10.523   6.732  -1.995
   48   1HB   ASP   8          1HB       ASP   8  12.852   5.683  -2.048
   49   2HB   ASP   8          2HB       ASP   8  13.281   6.808  -3.324
   50    H    ASP   9           HN       ASP   9  11.932   7.209  -5.180
   51    HA   ASP   9           HA       ASP   9  11.716  10.024  -5.408
   52   1HB   ASP   9          1HB       ASP   9  12.959   8.656  -7.000
   53   2HB   ASP   9          2HB       ASP   9  11.503   7.844  -7.548
   54    H    THR  10           H        THR  10   9.499   7.723  -7.034
   55    HA   THR  10           HA       THR  10   7.572   9.682  -7.730
   56    HB   THR  10           HB       THR  10   6.183   7.567  -8.187
   57    HG1  THR  10           HG1      THR  10   7.586   5.670  -8.144
   58   1HG2  THR  10          1HG2      THR  10   7.612   6.900 -10.074
   59   2HG2  THR  10          2HG2      THR  10   7.636   8.661  -9.883
   60   3HG2  THR  10          3HG2      THR  10   9.014   7.692  -9.329
   61    H    PHE  11           H        PHE  11   7.776   7.516  -5.001
   62    HA   PHE  11           HA       PHE  11   5.404   7.463  -3.714
   63   1HB   PHE  11          2HB       PHE  11   7.504   6.495  -2.922
   64   2HB   PHE  11          1HB       PHE  11   8.151   8.073  -2.559
   65    HD1  PHE  11           HD1      PHE  11   8.037   8.870  -0.372
   66    HD2  PHE  11           HD2      PHE  11   5.430   5.683  -1.621
   67    HE1  PHE  11           HE1      PHE  11   7.223   8.648   1.934
   68    HE2  PHE  11           HE2      PHE  11   4.547   5.501   0.686
   69    HZ   PHE  11           HZ       PHE  11   5.437   6.977   2.483
   70    H    LYS  12           HN       LYS  12   7.693  10.066  -3.600
   71    HA   LYS  12           HA       LYS  12   6.609  11.983  -1.903
   72   1HB   LYS  12          1HB       LYS  12   7.795  12.353  -4.692
   73   2HB   LYS  12          2HB       LYS  12   7.474  13.676  -3.607
   74   1HG   LYS  12          1HG       LYS  12   9.360  11.294  -3.140
   75   2HG   LYS  12          2HG       LYS  12   9.852  12.887  -3.695
   76   1HD   LYS  12          1HD       LYS  12  10.302  13.345  -1.539
   77   2HD   LYS  12          2HD       LYS  12   8.561  13.556  -1.353
   78   1HE   LYS  12          1HE       LYS  12   9.416  12.081   0.397
   79   2HE   LYS  12          2HE       LYS  12   8.401  11.123  -0.695
   80   1HZ   LYS  12          1HZ       LYS  12  10.386  10.290  -1.726
   81   2HZ   LYS  12          2HZ       LYS  12  10.468  10.032  -0.110
   82   3HZ   LYS  12          3HZ       LYS  12  11.337  11.251  -0.786
   83    H    ASN  13           H        ASN  13   5.920  11.874  -5.391
   84    HA   ASN  13           HA       ASN  13   3.815  13.879  -5.181
   85   1HB   ASN  13          2HB       ASN  13   5.485  12.709  -7.258
   86   2HB   ASN  13          1HB       ASN  13   3.802  12.483  -7.713
   87   1HD2  ASN  13          2HD2      ASN  13   5.433  15.194  -5.876
   88   2HD2  ASN  13          1HD2      ASN  13   5.019  16.404  -7.065
   89    H    VAL  14           H        VAL  14   4.082  10.449  -5.741
   90    HA   VAL  14           HA       VAL  14   1.292  10.108  -6.475
   91    HB   VAL  14           HB       VAL  14   3.461   8.111  -5.715
   92   1HG1  VAL  14          1HG1      VAL  14   3.626   7.780  -8.166
   93   2HG1  VAL  14          2HG1      VAL  14   2.379   9.013  -8.430
   94   3HG1  VAL  14          3HG1      VAL  14   3.959   9.469  -7.774
   95   1HG2  VAL  14          1HG2      VAL  14   1.315   6.990  -5.469
   96   2HG2  VAL  14          2HG2      VAL  14   0.720   7.707  -6.989
   97   3HG2  VAL  14          3HG2      VAL  14   2.014   6.499  -7.022
   98    H    VAL  15           H        VAL  15   3.063   9.720  -3.409
   99    HA   VAL  15           HA       VAL  15   0.558   8.830  -2.060
  100    HB   VAL  15           HB       VAL  15   3.423   8.554  -1.061
  101   1HG1  VAL  15          1HG1      VAL  15   0.852   7.176  -0.249
  102   2HG1  VAL  15          2HG1      VAL  15   1.615   8.516   0.636
  103   3HG1  VAL  15          3HG1      VAL  15   2.467   6.985   0.480
  104   1HG2  VAL  15          1HG2      VAL  15   3.299   7.278  -3.118
  105   2HG2  VAL  15          2HG2      VAL  15   3.182   6.167  -1.751
  106   3HG2  VAL  15          3HG2      VAL  15   1.730   6.605  -2.664
  107    H    LEU  16           H        LEU  16   3.525  10.681  -1.112
  108    HA   LEU  16           HA       LEU  16   2.283  11.788   1.174
  109   1HB   LEU  16          1HB       LEU  16   4.518  13.095  -0.426
  110   2HB   LEU  16          2HB       LEU  16   4.082  13.395   1.242
  111    HG   LEU  16           HG       LEU  16   5.260  10.814   0.105
  112   1HD1  LEU  16          1HD1      LEU  16   6.336  12.878   2.078
  113   2HD1  LEU  16          2HD1      LEU  16   7.186  11.432   1.495
  114   3HD1  LEU  16          3HD1      LEU  16   6.802  12.759   0.372
  115   1HD2  LEU  16          1HD2      LEU  16   5.404  10.075   2.483
  116   2HD2  LEU  16          2HD2      LEU  16   4.478  11.498   2.969
  117   3HD2  LEU  16          3HD2      LEU  16   3.726  10.228   1.963
  118    H    GLU  17           HN       GLU  17   2.747  13.302  -2.027
  119    HA   GLU  17           HA       GLU  17   1.026  15.581  -1.296
  120   1HB   GLU  17          1HB       GLU  17   2.319  14.831  -3.926
  121   2HB   GLU  17          2HB       GLU  17   1.653  16.407  -3.515
  122   1HG   GLU  17          2HG       GLU  17   3.372  16.827  -1.873
  123   2HG   GLU  17          1HG       GLU  17   4.009  15.185  -1.990
  124    H    SER  18           H        SER  18  -0.160  12.616  -1.736
  125    HA   SER  18           HA       SER  18  -1.745  13.019  -4.151
  126   1HB   SER  18          2HB       SER  18  -1.065  10.796  -2.640
  127   2HB   SER  18          1HB       SER  18  -2.770  11.020  -2.233
  128    HG   SER  18           HG       SER  18  -1.545  10.177  -4.512
  129    H    SER  19           H        SER  19  -4.056  13.213  -4.248
  130    HA   SER  19           HA       SER  19  -5.213  15.071  -2.293
  131   1HB   SER  19          1HB       SER  19  -7.038  14.985  -4.122
  132   2HB   SER  19          2HB       SER  19  -5.454  15.635  -4.598
  133    HG   SER  19           HG       SER  19  -6.181  14.065  -6.108
  134    H    VAL  20           H        VAL  20  -6.163  12.113  -3.967
  135    HA   VAL  20           HA       VAL  20  -8.241  11.345  -2.031
  136    HB   VAL  20           HB       VAL  20  -8.396   9.317  -3.473
  137   1HG1  VAL  20          1HG1      VAL  20  -6.232  10.549  -5.218
  138   2HG1  VAL  20          2HG1      VAL  20  -5.989   9.156  -4.144
  139   3HG1  VAL  20          3HG1      VAL  20  -7.138   9.052  -5.483
  140   1HG2  VAL  20          1HG2      VAL  20  -9.179  10.449  -5.502
  141   2HG2  VAL  20          2HG2      VAL  20  -8.393  11.949  -4.986
  142   3HG2  VAL  20          3HG2      VAL  20  -9.727  11.263  -4.027
  143    HA   PRO  21           HA       PRO  21  -5.758   8.875   0.691
  144   1HB   PRO  21          2HB       PRO  21  -7.593   6.569   0.175
  145   2HB   PRO  21          1HB       PRO  21  -7.111   7.251   1.742
  146   1HG   PRO  21          1HG       PRO  21  -9.547   7.617   0.644
  147   2HG   PRO  21          2HG       PRO  21  -8.756   9.006   1.463
  148   1HD   PRO  21          2HD       PRO  21  -8.819   8.417  -1.532
  149   2HD   PRO  21          1HD       PRO  21  -9.226   9.900  -0.703
  150    H    VAL  22           H        VAL  22  -4.483   6.808   0.660
  151    HA   VAL  22           HA       VAL  22  -4.066   5.587  -2.029
  152    HB   VAL  22           HB       VAL  22  -1.854   6.981  -0.466
  153   1HG1  VAL  22          1HG1      VAL  22  -0.548   6.579  -2.523
  154   2HG1  VAL  22          2HG1      VAL  22  -1.109   5.063  -1.803
  155   3HG1  VAL  22          3HG1      VAL  22  -1.928   5.723  -3.235
  156   1HG2  VAL  22          1HG2      VAL  22  -3.195   8.750  -1.371
  157   2HG2  VAL  22          2HG2      VAL  22  -1.771   8.557  -2.389
  158   3HG2  VAL  22          3HG2      VAL  22  -3.325   7.931  -2.947
  159    H    LEU  23           H        LEU  23  -4.098   3.411  -1.640
  160    HA   LEU  23           HA       LEU  23  -3.173   2.339   0.948
  161   1HB   LEU  23          2HB       LEU  23  -5.275   1.702  -0.709
  162   2HB   LEU  23          1HB       LEU  23  -4.087   0.565  -1.285
  163    HG   LEU  23           HG       LEU  23  -3.742  -0.055   1.208
  164   1HD1  LEU  23          1HD2      LEU  23  -4.922  -1.473  -0.515
  165   2HD1  LEU  23          2HD2      LEU  23  -5.613  -1.643   1.107
  166   3HD1  LEU  23          3HD2      LEU  23  -6.436  -0.645  -0.114
  167   1HD2  LEU  23          1HD1      LEU  23  -4.995   1.906   2.142
  168   2HD2  LEU  23          2HD1      LEU  23  -5.632   0.339   2.680
  169   3HD2  LEU  23          3HD1      LEU  23  -6.481   1.263   1.432
  170    H    VAL  24           H        VAL  24  -0.927   2.352   1.055
  171    HA   VAL  24           HA       VAL  24   0.648   1.644  -1.387
  172    HB   VAL  24           HB       VAL  24   1.556   2.823   1.262
  173   1HG1  VAL  24          1HG1      VAL  24   3.636   3.322   0.002
  174   2HG1  VAL  24          2HG1      VAL  24   2.992   2.463  -1.411
  175   3HG1  VAL  24          3HG1      VAL  24   3.363   1.583   0.086
  176   1HG2  VAL  24          1HG2      VAL  24   1.062   4.143  -1.437
  177   2HG2  VAL  24          2HG2      VAL  24   1.841   4.894  -0.033
  178   3HG2  VAL  24          3HG2      VAL  24   0.140   4.428   0.064
  179    H    ASP  25           HN       ASP  25   1.083  -0.574  -1.555
  180    HA   ASP  25           HA       ASP  25   1.417  -2.170   0.932
  181   1HB   ASP  25          2HB       ASP  25   0.040  -3.174  -0.759
  182   2HB   ASP  25          1HB       ASP  25   1.311  -2.958  -1.963
  183    H    PHE  26           H        PHE  26   3.453  -2.199   1.843
  184    HA   PHE  26           HA       PHE  26   5.795  -1.489   0.185
  185   1HB   PHE  26          2HB       PHE  26   5.514  -2.283   3.101
  186   2HB   PHE  26          1HB       PHE  26   7.031  -1.956   2.283
  187    HD1  PHE  26           HD1      PHE  26   7.948   0.167   2.659
  188    HD2  PHE  26           HD2      PHE  26   3.638  -0.209   2.578
  189    HE1  PHE  26           HE1      PHE  26   7.699   2.529   3.301
  190    HE2  PHE  26           HE2      PHE  26   3.419   2.136   3.129
  191    HZ   PHE  26           HZ       PHE  26   5.411   3.459   3.778
  192    H    TRP  27           H        TRP  27   6.583  -3.050  -1.125
  193    HA   TRP  27           HA       TRP  27   6.341  -5.903  -0.287
  194   1HB   TRP  27          2HB       TRP  27   5.496  -6.531  -2.422
  195   2HB   TRP  27          1HB       TRP  27   4.505  -5.181  -1.910
  196    HD1  TRP  27           HD1      TRP  27   5.455  -2.744  -2.982
  197    HE1  TRP  27           HE1      TRP  27   6.602  -2.194  -5.245
  198    HE3  TRP  27           HE3      TRP  27   6.406  -7.507  -4.567
  199    HZ2  TRP  27           HZ2      TRP  27   8.033  -3.668  -7.275
  200    HZ3  TRP  27           HZ3      TRP  27   7.553  -7.889  -6.708
  201    HH2  TRP  27           HH2      TRP  27   8.365  -5.989  -8.076
  202    H    ALA  28           H        ALA  28   7.452  -7.155  -2.306
  203    HA   ALA  28           HA       ALA  28   9.634  -5.915  -3.590
  204   1HB   ALA  28          1HB       ALA  28  10.361  -7.755  -1.265
  205   2HB   ALA  28          2HB       ALA  28  11.486  -7.176  -2.510
  206   3HB   ALA  28          3HB       ALA  28  10.761  -6.021  -1.381
  207    HA   PRO  29           HA       PRO  29   8.705  -9.614  -5.958
  208   1HB   PRO  29          1HB       PRO  29  11.197 -10.325  -6.977
  209   2HB   PRO  29          2HB       PRO  29  10.103  -9.063  -7.634
  210   1HG   PRO  29          1HG       PRO  29  12.454  -8.678  -5.751
  211   2HG   PRO  29          2HG       PRO  29  12.069  -7.750  -7.231
  212   1HD   PRO  29          2HD       PRO  29  11.341  -6.719  -4.861
  213   2HD   PRO  29          1HD       PRO  29  10.174  -6.730  -6.178
  214    H    TRP  30           H        TRP  30  11.623  -9.882  -3.860
  215    HA   TRP  30           HA       TRP  30  11.439 -12.733  -3.605
  216   1HB   TRP  30          2HB       TRP  30  12.944 -12.419  -1.692
  217   2HB   TRP  30          1HB       TRP  30  13.489 -11.590  -3.141
  218    HD1  TRP  30           HD1      TRP  30  14.102  -9.128  -2.908
  219    HE1  TRP  30           HE1      TRP  30  14.008  -7.353  -1.032
  220    HE3  TRP  30           HE3      TRP  30  11.391 -11.723   0.592
  221    HZ2  TRP  30           HZ2      TRP  30  12.817  -7.053   1.542
  222    HZ3  TRP  30           HZ3      TRP  30  10.706 -10.623   2.693
  223    HH2  TRP  30           HH2      TRP  30  11.344  -8.269   3.149
  224    H    CYS  31           H        CYS  31   9.448 -10.207  -2.245
  225    HA   CYS  31           HA       CYS  31   8.896 -11.626   0.267
  226   1HB   CYS  31          2HB       CYS  31   8.862  -9.218   0.269
  227   2HB   CYS  31          1HB       CYS  31   7.611  -9.190  -0.981
  228    H    GLY  32           H        GLY  32   8.311 -13.651  -0.744
  229   1HA   GLY  32          1HA       GLY  32   6.216 -14.394  -2.292
  230   2HA   GLY  32          2HA       GLY  32   6.564 -15.208  -0.761
  231    HA   PRO  33           HA       PRO  33   2.762 -13.853   0.997
  232   1HB   PRO  33          1HB       PRO  33   3.177 -12.152   3.151
  233   2HB   PRO  33          2HB       PRO  33   3.441 -13.915   3.176
  234   1HG   PRO  33          2HG       PRO  33   5.508 -11.751   2.728
  235   2HG   PRO  33          1HG       PRO  33   5.595 -13.150   3.827
  236   1HD   PRO  33          2HD       PRO  33   6.775 -13.256   1.438
  237   2HD   PRO  33          1HD       PRO  33   5.835 -14.642   2.047
  238    H    CYS  34           H        CYS  34   4.842 -11.257  -0.146
  239    HA   CYS  34           HA       CYS  34   2.634  -9.280  -0.196
  240   1HB   CYS  34          2HB       CYS  34   5.323  -9.075  -1.588
  241   2HB   CYS  34          1HB       CYS  34   4.111  -7.843  -1.265
  242    H    ARG  35           HN       ARG  35   4.772 -10.990  -2.433
  243    HA   ARG  35           HA       ARG  35   3.839 -10.449  -4.913
  244   1HB   ARG  35          2HB       ARG  35   5.757 -11.951  -4.085
  245   2HB   ARG  35          1HB       ARG  35   4.587 -13.257  -3.987
  246   1HG   ARG  35          1HG       ARG  35   4.078 -12.790  -6.482
  247   2HG   ARG  35          2HG       ARG  35   5.523 -11.760  -6.460
  248   1HD   ARG  35          1HD       ARG  35   5.321 -14.719  -5.803
  249   2HD   ARG  35          2HD       ARG  35   6.122 -14.016  -7.218
  250    HE   ARG  35           HE       ARG  35   7.614 -12.830  -5.423
  251   1HH1  ARG  35          2HH1      ARG  35   6.523 -16.213  -5.237
  252   2HH1  ARG  35          1HH1      ARG  35   7.787 -16.664  -4.128
  253   1HH2  ARG  35          2HH2      ARG  35   9.193 -13.412  -4.081
  254   2HH2  ARG  35          1HH2      ARG  35   9.350 -15.021  -3.406
  255    H    ILE  36           H        ILE  36   2.630 -13.149  -2.881
  256    HA   ILE  36           HA       ILE  36   0.616 -13.872  -4.845
  257    HB   ILE  36           HB       ILE  36  -0.129 -15.509  -3.208
  258   1HG1  ILE  36          2HG1      ILE  36   1.649 -15.504  -1.100
  259   2HG1  ILE  36          1HG1      ILE  36   1.330 -13.778  -1.252
  260   1HG2  ILE  36          1HG2      ILE  36   1.868 -15.910  -4.625
  261   2HG2  ILE  36          2HG2      ILE  36   1.923 -16.788  -3.090
  262   3HG2  ILE  36          3HG2      ILE  36   2.914 -15.336  -3.311
  263   1HD1  ILE  36          1HD1      ILE  36  -1.156 -14.340  -1.179
  264   2HD1  ILE  36          2HD1      ILE  36  -0.268 -14.809   0.289
  265   3HD1  ILE  36          3HD1      ILE  36  -0.706 -16.034  -0.914
  266    H    ILE  37           H        ILE  37   0.553 -11.463  -2.311
  267    HA   ILE  37           HA       ILE  37  -2.417 -11.395  -2.240
  268    HB   ILE  37           HB       ILE  37  -0.239  -9.904  -0.714
  269   1HG1  ILE  37          2HG1      ILE  37  -0.445 -12.322  -0.136
  270   2HG1  ILE  37          1HG1      ILE  37  -0.844 -11.231   1.175
  271   1HG2  ILE  37          1HG2      ILE  37  -2.160  -8.456  -0.753
  272   2HG2  ILE  37          2HG2      ILE  37  -3.266  -9.794  -0.404
  273   3HG2  ILE  37          3HG2      ILE  37  -2.103  -9.232   0.819
  274   1HD1  ILE  37          1HD1      ILE  37  -2.363 -13.165   1.084
  275   2HD1  ILE  37          2HD1      ILE  37  -3.248 -11.655   0.873
  276   3HD1  ILE  37          3HD1      ILE  37  -2.908 -12.697  -0.528
  277    H    ALA  38           H        ALA  38   0.350  -9.639  -3.481
  278    HA   ALA  38           HA       ALA  38  -0.457  -7.170  -4.166
  279   1HB   ALA  38          1HB       ALA  38   1.065  -9.083  -5.982
  280   2HB   ALA  38          2HB       ALA  38   1.090  -7.316  -6.062
  281   3HB   ALA  38          3HB       ALA  38   1.752  -8.142  -4.640
  282    HA   PRO  39           HA       PRO  39  -2.687  -8.416  -8.234
  283   1HB   PRO  39          1HB       PRO  39  -3.891 -11.082  -7.719
  284   2HB   PRO  39          2HB       PRO  39  -2.980 -10.535  -9.150
  285   1HG   PRO  39          2HG       PRO  39  -1.898 -12.335  -7.384
  286   2HG   PRO  39          1HG       PRO  39  -0.888 -11.046  -8.113
  287   1HD   PRO  39          2HD       PRO  39  -2.323 -10.986  -5.453
  288   2HD   PRO  39          1HD       PRO  39  -0.642 -10.702  -5.679
  289    H    VAL  40           H        VAL  40  -3.684  -9.701  -5.146
  290    HA   VAL  40           HA       VAL  40  -6.495  -9.162  -5.336
  291    HB   VAL  40           HB       VAL  40  -4.641 -10.771  -3.800
  292   1HG1  VAL  40          1HG1      VAL  40  -4.709  -9.052  -2.050
  293   2HG1  VAL  40          2HG1      VAL  40  -6.476  -9.229  -1.988
  294   3HG1  VAL  40          3HG1      VAL  40  -5.407 -10.607  -1.591
  295   1HG2  VAL  40          1HG2      VAL  40  -6.603 -12.020  -3.253
  296   2HG2  VAL  40          2HG2      VAL  40  -6.586 -11.569  -4.962
  297   3HG2  VAL  40          3HG2      VAL  40  -7.640 -10.689  -3.834
  298    H    VAL  41           H        VAL  41  -3.568  -7.647  -3.903
  299    HA   VAL  41           HA       VAL  41  -4.836  -5.401  -2.698
  300    HB   VAL  41           HB       VAL  41  -2.171  -5.520  -4.194
  301   1HG1  VAL  41          1HG1      VAL  41  -1.173  -5.660  -1.935
  302   2HG1  VAL  41          2HG1      VAL  41  -2.194  -7.036  -2.335
  303   3HG1  VAL  41          3HG1      VAL  41  -2.806  -5.783  -1.234
  304   1HG2  VAL  41          1HG2      VAL  41  -2.742  -3.252  -4.122
  305   2HG2  VAL  41          2HG2      VAL  41  -3.262  -3.327  -2.417
  306   3HG2  VAL  41          3HG2      VAL  41  -1.550  -3.506  -2.857
  307    H    ASP  42           HN       ASP  42  -3.739  -5.955  -6.059
  308    HA   ASP  42           HA       ASP  42  -4.566  -3.472  -7.091
  309   1HB   ASP  42          2HB       ASP  42  -3.157  -5.520  -8.100
  310   2HB   ASP  42          1HB       ASP  42  -4.703  -5.943  -8.834
  311    H    GLU  43           HN       GLU  43  -6.393  -6.627  -7.232
  312    HA   GLU  43           HA       GLU  43  -8.650  -5.422  -8.461
  313   1HB   GLU  43          1HB       GLU  43  -9.735  -7.383  -8.198
  314   2HB   GLU  43          2HB       GLU  43  -8.063  -7.933  -8.123
  315   1HG   GLU  43          1HG       GLU  43  -8.307  -7.911  -5.581
  316   2HG   GLU  43          2HG       GLU  43 -10.025  -7.565  -5.794
  317    H    ILE  44           H        ILE  44  -7.875  -5.802  -4.956
  318    HA   ILE  44           HA       ILE  44 -10.317  -4.710  -3.988
  319    HB   ILE  44           HB       ILE  44  -7.492  -4.764  -2.850
  320   1HG1  ILE  44          2HG1      ILE  44 -10.039  -6.313  -2.187
  321   2HG1  ILE  44          1HG1      ILE  44  -8.794  -6.954  -3.220
  322   1HG2  ILE  44          1HG2      ILE  44 -10.087  -3.921  -1.480
  323   2HG2  ILE  44          2HG2      ILE  44  -8.523  -4.148  -0.670
  324   3HG2  ILE  44          3HG2      ILE  44  -8.712  -2.856  -1.838
  325   1HD1  ILE  44          1HD1      ILE  44  -8.425  -7.878  -1.056
  326   2HD1  ILE  44          2HD1      ILE  44  -8.504  -6.304  -0.269
  327   3HD1  ILE  44          3HD1      ILE  44  -7.130  -6.700  -1.332
  328    H    ALA  45           H        ALA  45  -7.244  -3.115  -5.044
  329    HA   ALA  45           HA       ALA  45  -8.036  -0.466  -4.498
  330   1HB   ALA  45          1HB       ALA  45  -5.815  -1.269  -5.432
  331   2HB   ALA  45          2HB       ALA  45  -6.568  -1.312  -7.034
  332   3HB   ALA  45          3HB       ALA  45  -6.502   0.216  -6.176
  333    H    GLY  46           H        GLY  46  -8.705  -2.533  -7.360
  334   1HA   GLY  46          1HA       GLY  46 -10.239  -0.748  -8.891
  335   2HA   GLY  46          2HA       GLY  46 -10.456  -2.510  -8.856
  336    H    GLU  47           HN       GLU  47 -11.430  -3.051  -6.367
  337    HA   GLU  47           HA       GLU  47 -14.147  -2.522  -6.484
  338   1HB   GLU  47          1HB       GLU  47 -12.394  -3.005  -4.034
  339   2HB   GLU  47          2HB       GLU  47 -14.140  -3.015  -4.030
  340   1HG   GLU  47          1HG       GLU  47 -14.234  -4.933  -5.511
  341   2HG   GLU  47          2HG       GLU  47 -12.485  -4.884  -5.771
  342    H    TYR  48           H        TYR  48 -11.674  -0.611  -4.819
  343    HA   TYR  48           HA       TYR  48 -13.719   1.503  -4.173
  344   1HB   TYR  48          1HB       TYR  48 -11.053   0.928  -2.865
  345   2HB   TYR  48          2HB       TYR  48 -12.239   2.127  -2.337
  346    HD1  TYR  48           HD1      TYR  48 -14.571   1.307  -1.602
  347    HD2  TYR  48           HD2      TYR  48 -11.187  -1.318  -2.071
  348    HE1  TYR  48           HE1      TYR  48 -15.846  -0.531  -0.533
  349    HE2  TYR  48           HE2      TYR  48 -12.508  -3.186  -1.106
  350    HH   TYR  48           HH       TYR  48 -15.796  -2.765   0.177
  351    H    LYS  49           HN       LYS  49 -12.269   1.189  -6.802
  352    HA   LYS  49           HA       LYS  49 -10.151   2.960  -6.987
  353   1HB   LYS  49          2HB       LYS  49 -11.034   1.455  -8.811
  354   2HB   LYS  49          1HB       LYS  49 -12.374   2.600  -9.011
  355   1HG   LYS  49          1HG       LYS  49 -10.755   2.860 -10.766
  356   2HG   LYS  49          2HG       LYS  49 -10.871   4.323  -9.813
  357   1HD   LYS  49          1HD       LYS  49  -8.714   3.577  -8.595
  358   2HD   LYS  49          2HD       LYS  49  -8.698   2.172  -9.663
  359   1HE   LYS  49          1HE       LYS  49  -7.193   3.854 -10.550
  360   2HE   LYS  49          2HE       LYS  49  -8.579   3.708 -11.642
  361   1HZ   LYS  49          1HZ       LYS  49  -8.017   5.978 -11.238
  362   2HZ   LYS  49          2HZ       LYS  49  -9.503   5.688 -10.598
  363   3HZ   LYS  49          3HZ       LYS  49  -8.192   5.802  -9.611
  364    H    ASP  50           HN       ASP  50 -10.024   5.057  -7.807
  365    HA   ASP  50           HA       ASP  50 -10.270   7.294  -7.840
  366   1HB   ASP  50          1HB       ASP  50 -13.275   6.721  -7.848
  367   2HB   ASP  50          2HB       ASP  50 -12.523   8.283  -8.093
  368    H    LYS  51           HN       LYS  51 -12.521   5.903  -5.434
  369    HA   LYS  51           HA       LYS  51 -12.171   8.212  -3.678
  370   1HB   LYS  51          2HB       LYS  51 -13.163   5.449  -2.857
  371   2HB   LYS  51          1HB       LYS  51 -13.276   6.999  -2.055
  372   1HG   LYS  51          2HG       LYS  51 -15.442   6.649  -2.846
  373   2HG   LYS  51          1HG       LYS  51 -14.743   7.874  -3.903
  374   1HD   LYS  51          2HD       LYS  51 -16.146   6.246  -5.107
  375   2HD   LYS  51          1HD       LYS  51 -14.499   6.220  -5.703
  376   1HE   LYS  51          1HE       LYS  51 -14.078   4.151  -4.292
  377   2HE   LYS  51          2HE       LYS  51 -15.773   4.210  -3.767
  378   1HZ   LYS  51          1HZ       LYS  51 -14.744   3.879  -6.492
  379   2HZ   LYS  51          2HZ       LYS  51 -16.352   3.955  -6.108
  380   3HZ   LYS  51          3HZ       LYS  51 -15.428   2.698  -5.566
  381    H    LEU  52           H        LEU  52 -10.351   5.321  -4.340
  382    HA   LEU  52           HA       LEU  52  -8.453   5.990  -2.178
  383   1HB   LEU  52          1HB       LEU  52  -9.978   4.401  -1.152
  384   2HB   LEU  52          2HB       LEU  52  -9.936   3.372  -2.584
  385    HG   LEU  52           HG       LEU  52  -7.578   2.806  -2.160
  386   1HD1  LEU  52          1HD2      LEU  52  -6.614   3.330   0.091
  387   2HD1  LEU  52          2HD2      LEU  52  -6.812   4.765  -0.914
  388   3HD1  LEU  52          3HD2      LEU  52  -7.977   4.409   0.399
  389   1HD2  LEU  52          1HD1      LEU  52  -9.511   2.389   0.171
  390   2HD2  LEU  52          2HD1      LEU  52  -9.464   1.433  -1.322
  391   3HD2  LEU  52          3HD1      LEU  52  -8.100   1.370  -0.202
  392    H    LYS  53           HN       LYS  53  -6.498   6.044  -3.136
  393    HA   LYS  53           HA       LYS  53  -6.068   4.741  -5.781
  394   1HB   LYS  53          2HB       LYS  53  -4.896   7.011  -4.356
  395   2HB   LYS  53          1HB       LYS  53  -3.646   5.859  -4.795
  396   1HG   LYS  53          1HG       LYS  53  -5.695   6.972  -6.744
  397   2HG   LYS  53          2HG       LYS  53  -4.081   7.648  -6.474
  398   1HD   LYS  53          2HD       LYS  53  -3.054   5.439  -7.092
  399   2HD   LYS  53          1HD       LYS  53  -4.655   4.829  -7.538
  400   1HE   LYS  53          2HE       LYS  53  -3.250   7.233  -8.788
  401   2HE   LYS  53          1HE       LYS  53  -3.387   5.615  -9.495
  402   1HZ   LYS  53          1HZ       LYS  53  -5.025   7.079 -10.373
  403   2HZ   LYS  53          2HZ       LYS  53  -5.757   5.879  -9.514
  404   3HZ   LYS  53          3HZ       LYS  53  -5.636   7.396  -8.877
  405    H    CYS  54           H        CYS  54  -3.934   3.427  -5.886
  406    HA   CYS  54           HA       CYS  54  -3.288   2.094  -3.372
  407   1HB   CYS  54          2HB       CYS  54  -5.236   0.759  -4.325
  408   2HB   CYS  54          1HB       CYS  54  -4.278   0.545  -5.774
  409    HG   CYS  54           HG       CYS  54  -3.057  -0.046  -2.778
  410    H    VAL  55           H        VAL  55  -1.195   1.028  -3.539
  411    HA   VAL  55           HA       VAL  55   0.192   1.219  -6.054
  412    HB   VAL  55           HB       VAL  55   1.733   2.812  -4.129
  413   1HG1  VAL  55          1HG1      VAL  55  -0.494   3.682  -3.417
  414   2HG1  VAL  55          2HG1      VAL  55  -0.764   4.264  -5.080
  415   3HG1  VAL  55          3HG1      VAL  55   0.581   4.888  -4.131
  416   1HG2  VAL  55          1HG2      VAL  55   1.899   4.316  -6.086
  417   2HG2  VAL  55          2HG2      VAL  55   0.686   3.356  -6.943
  418   3HG2  VAL  55          3HG2      VAL  55   2.255   2.630  -6.520
  419    H    LYS  56           HN       LYS  56   2.348   0.358  -5.879
  420    HA   LYS  56           HA       LYS  56   2.837  -1.237  -3.401
  421   1HB   LYS  56          1HB       LYS  56   2.613  -1.925  -6.278
  422   2HB   LYS  56          2HB       LYS  56   3.916  -2.726  -5.389
  423   1HG   LYS  56          1HG       LYS  56   2.468  -3.620  -3.763
  424   2HG   LYS  56          2HG       LYS  56   1.095  -2.614  -4.272
  425   1HD   LYS  56          1HD       LYS  56   2.345  -4.747  -6.041
  426   2HD   LYS  56          2HD       LYS  56   1.033  -5.060  -4.886
  427   1HE   LYS  56          1HE       LYS  56  -0.358  -3.288  -6.014
  428   2HE   LYS  56          2HE       LYS  56   0.900  -3.134  -7.252
  429   1HZ   LYS  56          1HZ       LYS  56  -0.670  -5.547  -6.638
  430   2HZ   LYS  56          2HZ       LYS  56  -0.818  -4.579  -7.959
  431   3HZ   LYS  56          3HZ       LYS  56   0.552  -5.468  -7.747
  432    H    LEU  57           H        LEU  57   4.493  -0.536  -2.362
  433    HA   LEU  57           HA       LEU  57   6.602   1.098  -3.667
  434   1HB   LEU  57          1HB       LEU  57   5.504   2.070  -1.793
  435   2HB   LEU  57          2HB       LEU  57   5.837   0.658  -0.761
  436    HG   LEU  57           HG       LEU  57   7.081   2.655  -0.226
  437   1HD1  LEU  57          1HD1      LEU  57   8.542   2.226  -2.848
  438   2HD1  LEU  57          2HD1      LEU  57   7.381   3.532  -2.526
  439   3HD1  LEU  57          3HD1      LEU  57   8.897   3.464  -1.618
  440   1HD2  LEU  57          1HD2      LEU  57   9.038   0.529  -1.090
  441   2HD2  LEU  57          2HD2      LEU  57   9.059   1.570   0.351
  442   3HD2  LEU  57          3HD2      LEU  57   7.880   0.261   0.215
  443    H    ASN  58           H        ASN  58   8.298   0.025  -4.441
  444    HA   ASN  58           HA       ASN  58   8.947  -2.674  -3.501
  445   1HB   ASN  58          1HB       ASN  58   9.331  -2.012  -5.833
  446   2HB   ASN  58          2HB       ASN  58  10.561  -0.857  -5.309
  447   1HD2  ASN  58          2HD2      ASN  58  10.221  -3.937  -6.532
  448   2HD2  ASN  58          1HD2      ASN  58  11.695  -4.637  -5.883
  449    H    THR  59           H        THR  59   9.738  -2.967  -1.612
  450    HA   THR  59           HA       THR  59  10.748  -0.992   0.154
  451    HB   THR  59           HB       THR  59  10.871  -4.046   0.184
  452    HG1  THR  59           HG1      THR  59   8.794  -3.353   0.073
  453   1HG2  THR  59          1HG2      THR  59  12.429  -3.186   1.828
  454   2HG2  THR  59          2HG2      THR  59  10.976  -3.791   2.640
  455   3HG2  THR  59          3HG2      THR  59  11.211  -2.033   2.429
  456    H    ASP  60           HN       ASP  60  12.356  -3.374  -1.913
  457    HA   ASP  60           HA       ASP  60  14.994  -3.099  -0.717
  458   1HB   ASP  60          2HB       ASP  60  14.280  -5.165  -1.707
  459   2HB   ASP  60          1HB       ASP  60  13.834  -4.370  -3.207
  460    H    GLU  61           HN       GLU  61  13.209  -1.714  -3.425
  461    HA   GLU  61           HA       GLU  61  15.427  -0.117  -4.435
  462   1HB   GLU  61          2HB       GLU  61  13.323  -1.049  -5.687
  463   2HB   GLU  61          1HB       GLU  61  12.473   0.316  -4.933
  464   1HG   GLU  61          1HG       GLU  61  13.056   1.062  -7.062
  465   2HG   GLU  61          2HG       GLU  61  14.262   1.825  -6.027
  466    H    SER  62           H        SER  62  12.838   0.250  -2.077
  467    HA   SER  62           HA       SER  62  13.510   3.116  -1.588
  468   1HB   SER  62          1HB       SER  62  10.833   1.831  -0.983
  469   2HB   SER  62          2HB       SER  62  11.313   3.524  -1.205
  470    HG   SER  62           HG       SER  62  11.066   1.402  -3.066
  471    HA   PRO  63           HA       PRO  63  14.189   0.504   2.342
  472   1HB   PRO  63          1HB       PRO  63  16.863   0.948   2.677
  473   2HB   PRO  63          2HB       PRO  63  16.243  -0.360   1.623
  474   1HG   PRO  63          2HG       PRO  63  17.108   2.428   0.769
  475   2HG   PRO  63          1HG       PRO  63  17.620   0.882   0.074
  476   1HD   PRO  63          1HD       PRO  63  15.617   2.252  -1.073
  477   2HD   PRO  63          2HD       PRO  63  15.449   0.487  -0.900
  478    H    ASN  64           H        ASN  64  15.318   3.516   0.995
  479    HA   ASN  64           HA       ASN  64  15.742   5.170   3.208
  480   1HB   ASN  64          1HB       ASN  64  14.298   5.873   0.610
  481   2HB   ASN  64          2HB       ASN  64  14.926   7.047   1.775
  482   1HD2  ASN  64          2HD2      ASN  64  15.772   7.356  -0.750
  483   2HD2  ASN  64          1HD2      ASN  64  17.441   6.805  -0.908
  484    H    VAL  65           H        VAL  65  12.635   4.747   1.507
  485    HA   VAL  65           HA       VAL  65  11.039   6.229   3.319
  486    HB   VAL  65           HB       VAL  65  10.243   3.916   1.479
  487   1HG1  VAL  65          1HG2      VAL  65   8.603   6.223   2.594
  488   2HG1  VAL  65          2HG2      VAL  65   8.518   4.559   3.185
  489   3HG1  VAL  65          3HG2      VAL  65   8.026   4.920   1.523
  490   1HG2  VAL  65          1HG1      VAL  65  10.425   6.919   0.985
  491   2HG2  VAL  65          2HG1      VAL  65  11.386   5.658   0.185
  492   3HG2  VAL  65          3HG1      VAL  65   9.642   5.749  -0.101
  493    H    ALA  66           H        ALA  66  11.441   2.729   2.940
  494    HA   ALA  66           HA       ALA  66   9.957   1.807   5.098
  495   1HB   ALA  66          1HB       ALA  66  12.642   0.694   4.162
  496   2HB   ALA  66          2HB       ALA  66  11.410  -0.183   5.085
  497   3HB   ALA  66          3HB       ALA  66  11.062   0.345   3.425
  498    H    SER  67           H        SER  67  13.373   2.943   5.205
  499    HA   SER  67           HA       SER  67  13.747   2.442   7.997
  500   1HB   SER  67          2HB       SER  67  15.163   4.457   6.189
  501   2HB   SER  67          1HB       SER  67  15.713   3.886   7.774
  502    HG   SER  67           HG       SER  67  15.346   2.332   5.422
  503    H    GLU  68           HN       GLU  68  12.892   5.407   6.197
  504    HA   GLU  68           HA       GLU  68  12.748   7.155   8.436
  505   1HB   GLU  68          1HB       GLU  68  11.268   7.156   5.765
  506   2HB   GLU  68          2HB       GLU  68  11.151   8.470   6.937
  507   1HG   GLU  68          2HG       GLU  68  13.793   7.536   5.724
  508   2HG   GLU  68          1HG       GLU  68  12.827   8.885   5.119
  509    H    TYR  69           H        TYR  69  10.204   5.093   6.980
  510    HA   TYR  69           HA       TYR  69   8.217   5.991   8.942
  511   1HB   TYR  69          2HB       TYR  69   8.278   4.004   6.660
  512   2HB   TYR  69          1HB       TYR  69   7.003   3.937   7.864
  513    HD1  TYR  69           HD1      TYR  69   5.350   5.722   8.117
  514    HD2  TYR  69           HD2      TYR  69   8.521   6.086   5.224
  515    HE1  TYR  69           HE1      TYR  69   4.389   7.867   7.314
  516    HE2  TYR  69           HE2      TYR  69   7.556   8.204   4.420
  517    HH   TYR  69           HH       TYR  69   5.896   9.808   4.729
  518    H    GLY  70           H        GLY  70  10.397   3.204   8.642
  519   1HA   GLY  70          1HA       GLY  70  11.250   2.081  10.556
  520   2HA   GLY  70          2HA       GLY  70   9.806   2.509  11.485
  521    H    ILE  71           H        ILE  71  10.623   0.842   8.422
  522    HA   ILE  71           HA       ILE  71   8.806  -1.423   9.127
  523    HB   ILE  71           HB       ILE  71   9.237  -0.193   6.375
  524   1HG1  ILE  71          1HG1      ILE  71   6.810   0.161   8.209
  525   2HG1  ILE  71          2HG1      ILE  71   8.016   1.406   7.858
  526   1HG2  ILE  71          1HG2      ILE  71   8.610  -2.578   6.297
  527   2HG2  ILE  71          2HG2      ILE  71   7.250  -2.280   7.400
  528   3HG2  ILE  71          3HG2      ILE  71   7.260  -1.610   5.757
  529   1HD1  ILE  71          1HD1      ILE  71   6.076   0.257   5.864
  530   2HD1  ILE  71          2HD1      ILE  71   7.570   1.130   5.434
  531   3HD1  ILE  71          3HD1      ILE  71   6.323   1.934   6.384
  532    H    ARG  72           HN       ARG  72   9.517  -3.444   8.231
  533    HA   ARG  72           HA       ARG  72  12.115  -3.617   6.898
  534   1HB   ARG  72          1HB       ARG  72  12.790  -3.504   9.260
  535   2HB   ARG  72          2HB       ARG  72  11.692  -4.826   9.678
  536   1HG   ARG  72          2HG       ARG  72  12.976  -6.347   8.164
  537   2HG   ARG  72          1HG       ARG  72  14.048  -5.003   7.738
  538   1HD   ARG  72          2HD       ARG  72  14.782  -4.799  10.067
  539   2HD   ARG  72          1HD       ARG  72  13.684  -6.077  10.582
  540    HE   ARG  72           HE       ARG  72  16.266  -6.332   9.269
  541   1HH1  ARG  72          1HH2      ARG  72  13.172  -7.964   9.751
  542   2HH1  ARG  72          2HH2      ARG  72  13.807  -9.564   9.477
  543   1HH2  ARG  72          1HH1      ARG  72  17.108  -8.406   8.885
  544   2HH2  ARG  72          2HH1      ARG  72  16.087  -9.815   8.963
  545    H    SER  73           H        SER  73   9.990  -5.844   8.857
  546    HA   SER  73           HA       SER  73   9.912  -7.829   6.800
  547   1HB   SER  73          2HB       SER  73   7.731  -8.360   8.320
  548   2HB   SER  73          1HB       SER  73   9.379  -8.732   8.817
  549    HG   SER  73           HG       SER  73   7.843  -6.432   9.513
  550    H    ILE  74           H        ILE  74   8.058  -8.376   5.498
  551    HA   ILE  74           HA       ILE  74   6.046  -6.364   5.049
  552    HB   ILE  74           HB       ILE  74   6.640  -6.487   2.509
  553   1HG1  ILE  74          1HG1      ILE  74   9.457  -6.879   3.551
  554   2HG1  ILE  74          2HG1      ILE  74   8.492  -8.193   2.854
  555   1HG2  ILE  74          1HG2      ILE  74   6.743  -4.456   4.022
  556   2HG2  ILE  74          2HG2      ILE  74   7.873  -4.417   2.676
  557   3HG2  ILE  74          3HG2      ILE  74   8.460  -4.817   4.294
  558   1HD1  ILE  74          1HD1      ILE  74   9.274  -5.608   1.438
  559   2HD1  ILE  74          2HD1      ILE  74   8.199  -6.855   0.772
  560   3HD1  ILE  74          3HD1      ILE  74   9.890  -7.221   1.106
  561    HA   PRO  75           HA       PRO  75   4.352  -6.593   2.786
  562   1HB   PRO  75          1HB       PRO  75   1.702  -7.109   3.249
  563   2HB   PRO  75          2HB       PRO  75   2.640  -7.887   1.948
  564   1HG   PRO  75          2HG       PRO  75   2.225  -8.924   4.784
  565   2HG   PRO  75          1HG       PRO  75   1.742  -9.758   3.300
  566   1HD   PRO  75          2HD       PRO  75   4.163 -10.374   4.346
  567   2HD   PRO  75          1HD       PRO  75   4.143  -9.906   2.640
  568    H    THR  76           H        THR  76   3.447  -4.795   3.489
  569    HA   THR  76           HA       THR  76   2.294  -4.361   6.094
  570    HB   THR  76           HB       THR  76   5.079  -3.305   5.495
  571    HG1  THR  76           HG1      THR  76   4.439  -5.329   6.760
  572   1HG2  THR  76          1HG2      THR  76   3.046  -2.315   7.552
  573   2HG2  THR  76          2HG2      THR  76   3.742  -1.364   6.219
  574   3HG2  THR  76          3HG2      THR  76   4.772  -1.907   7.552
  575    H    ILE  77           H        ILE  77   0.552  -3.499   5.093
  576    HA   ILE  77           HA       ILE  77   0.985  -1.617   2.846
  577    HB   ILE  77           HB       ILE  77  -0.298  -3.557   2.189
  578   1HG1  ILE  77          2HG1      ILE  77  -2.172  -1.170   2.490
  579   2HG1  ILE  77          1HG1      ILE  77  -0.864  -1.282   1.308
  580   1HG2  ILE  77          1HG2      ILE  77  -2.288  -2.839   4.391
  581   2HG2  ILE  77          2HG2      ILE  77  -1.212  -4.262   4.352
  582   3HG2  ILE  77          3HG2      ILE  77  -2.494  -4.102   3.167
  583   1HD1  ILE  77          1HD1      ILE  77  -3.378  -2.953   1.403
  584   2HD1  ILE  77          2HD1      ILE  77  -2.731  -1.951   0.089
  585   3HD1  ILE  77          3HD1      ILE  77  -1.941  -3.477   0.499
  586    H    MET  78           H        MET  78   0.652   0.472   3.192
  587    HA   MET  78           HA       MET  78  -0.488   1.289   5.838
  588   1HB   MET  78          1HB       MET  78   1.441   2.693   3.982
  589   2HB   MET  78          2HB       MET  78   0.777   3.373   5.475
  590   1HG   MET  78          1HG       MET  78   1.768   1.418   6.714
  591   2HG   MET  78          2HG       MET  78   2.629   0.979   5.253
  592   1HE   MET  78          1HE       MET  78   4.889   2.605   8.268
  593   2HE   MET  78          2HE       MET  78   3.222   2.071   8.559
  594   3HE   MET  78          3HE       MET  78   4.315   1.059   7.592
  595    H    VAL  79           H        VAL  79  -1.978   2.901   5.918
  596    HA   VAL  79           HA       VAL  79  -3.441   3.491   3.377
  597    HB   VAL  79           HB       VAL  79  -4.348   4.018   6.240
  598   1HG1  VAL  79          1HG1      VAL  79  -5.879   2.111   5.859
  599   2HG1  VAL  79          2HG1      VAL  79  -4.939   1.672   4.419
  600   3HG1  VAL  79          3HG1      VAL  79  -4.179   1.624   6.018
  601   1HG2  VAL  79          1HG2      VAL  79  -6.530   4.328   5.089
  602   2HG2  VAL  79          2HG2      VAL  79  -5.732   4.065   3.520
  603   3HG2  VAL  79          3HG2      VAL  79  -5.327   5.481   4.501
  604    H    PHE  80           H        PHE  80  -2.364   5.193   2.485
  605    HA   PHE  80           HA       PHE  80  -1.477   7.457   4.200
  606   1HB   PHE  80          1HB       PHE  80  -0.830   6.414   1.476
  607   2HB   PHE  80          2HB       PHE  80  -0.594   8.128   1.808
  608    HD1  PHE  80           HD1      PHE  80   0.631   4.728   2.583
  609    HD2  PHE  80           HD2      PHE  80   0.987   8.925   3.500
  610    HE1  PHE  80           HE1      PHE  80   2.901   4.347   3.549
  611    HE2  PHE  80           HE2      PHE  80   3.162   8.515   4.584
  612    HZ   PHE  80           HZ       PHE  80   4.099   6.187   4.663
  613    H    LYS  81           HN       LYS  81  -1.899   9.528   3.670
  614    HA   LYS  81           HA       LYS  81  -3.773  10.317   1.652
  615   1HB   LYS  81          2HB       LYS  81  -5.482  11.263   2.965
  616   2HB   LYS  81          1HB       LYS  81  -5.308   9.617   3.542
  617   1HG   LYS  81          2HG       LYS  81  -4.539  12.191   4.977
  618   2HG   LYS  81          1HG       LYS  81  -5.738  10.977   5.404
  619   1HD   LYS  81          2HD       LYS  81  -3.866   9.325   5.760
  620   2HD   LYS  81          1HD       LYS  81  -2.727  10.634   5.390
  621   1HE   LYS  81          2HE       LYS  81  -2.888  10.324   7.798
  622   2HE   LYS  81          1HE       LYS  81  -3.418  11.937   7.302
  623   1HZ   LYS  81          1HZ       LYS  81  -5.207   9.688   7.932
  624   2HZ   LYS  81          2HZ       LYS  81  -4.859  10.947   8.932
  625   3HZ   LYS  81          3HZ       LYS  81  -5.673  11.215   7.527
  626    H    GLY  82           H        GLY  82  -4.026  12.943   2.976
  627   1HA   GLY  82          2HA       GLY  82  -2.037  14.513   2.194
  628   2HA   GLY  82          1HA       GLY  82  -2.847  14.712   3.764
  629    H    GLY  83           H        GLY  83   0.125  13.616   2.192
  630   1HA   GLY  83          2HA       GLY  83   2.239  13.467   2.983
  631   2HA   GLY  83          1HA       GLY  83   1.729  14.272   4.460
  632    H    LYS  84           HN       LYS  84   0.464  12.818   5.984
  633    HA   LYS  84           HA       LYS  84   2.339  10.630   6.611
  634   1HB   LYS  84          1HB       LYS  84  -0.019  11.772   8.172
  635   2HB   LYS  84          2HB       LYS  84   1.187  10.638   8.800
  636   1HG   LYS  84          1HG       LYS  84   2.982  12.320   8.354
  637   2HG   LYS  84          2HG       LYS  84   1.740  13.483   7.845
  638   1HD   LYS  84          1HD       LYS  84   0.656  13.305  10.075
  639   2HD   LYS  84          2HD       LYS  84   1.911  12.161  10.593
  640   1HE   LYS  84          1HE       LYS  84   3.652  13.902  10.217
  641   2HE   LYS  84          2HE       LYS  84   2.397  15.046   9.699
  642   1HZ   LYS  84          1HZ       LYS  84   1.428  14.865  11.874
  643   2HZ   LYS  84          2HZ       LYS  84   2.995  15.363  11.972
  644   3HZ   LYS  84          3HZ       LYS  84   2.600  13.810  12.355
  645    H    LYS  85           HN       LYS  85   1.461   8.683   7.716
  646    HA   LYS  85           HA       LYS  85  -0.643   7.372   6.096
  647   1HB   LYS  85          2HB       LYS  85   0.120   5.304   7.054
  648   2HB   LYS  85          1HB       LYS  85   1.435   6.143   6.263
  649   1HG   LYS  85          2HG       LYS  85   2.673   6.196   8.100
  650   2HG   LYS  85          1HG       LYS  85   1.394   6.915   9.086
  651   1HD   LYS  85          1HD       LYS  85   1.629   3.954   8.430
  652   2HD   LYS  85          2HD       LYS  85   2.224   4.716   9.919
  653   1HE   LYS  85          2HE       LYS  85  -0.129   5.535  10.388
  654   2HE   LYS  85          1HE       LYS  85  -0.684   4.574   9.005
  655   1HZ   LYS  85          1HZ       LYS  85   0.126   2.630  10.095
  656   2HZ   LYS  85          2HZ       LYS  85   0.660   3.517  11.380
  657   3HZ   LYS  85          3HZ       LYS  85  -0.951   3.433  11.053
  658    H    CYS  86           H        CYS  86  -2.317   6.237   7.211
  659    HA   CYS  86           HA       CYS  86  -3.178   7.559   9.749
  660   1HB   CYS  86          2HB       CYS  86  -4.529   7.807   7.603
  661   2HB   CYS  86          1HB       CYS  86  -4.904   6.088   7.706
  662    HG   CYS  86           HG       CYS  86  -5.520   6.432  10.440
  663    H    GLU  87           HN       GLU  87  -3.490   4.451   8.008
  664    HA   GLU  87           HA       GLU  87  -3.197   2.911  10.539
  665   1HB   GLU  87          2HB       GLU  87  -5.267   2.289   8.397
  666   2HB   GLU  87          1HB       GLU  87  -5.061   1.511   9.974
  667   1HG   GLU  87          1HG       GLU  87  -6.075   4.336   9.461
  668   2HG   GLU  87          2HG       GLU  87  -7.021   2.951   9.981
  669    H    THR  88           H        THR  88  -3.084   0.382   9.732
  670    HA   THR  88           HA       THR  88  -1.910   0.035   7.158
  671    HB   THR  88           HB       THR  88   0.021   1.067   8.313
  672    HG1  THR  88           HG1      THR  88   0.319  -0.815   6.916
  673   1HG2  THR  88          1HG2      THR  88   1.082  -0.019  10.260
  674   2HG2  THR  88          2HG2      THR  88  -0.556   0.520  10.667
  675   3HG2  THR  88          3HG2      THR  88  -0.240  -1.195  10.349
  676    H    ILE  89           H        ILE  89  -1.185  -2.325   6.882
  677    HA   ILE  89           HA       ILE  89  -2.321  -4.203   8.844
  678    HB   ILE  89           HB       ILE  89  -2.854  -4.659   5.877
  679   1HG1  ILE  89          2HG1      ILE  89  -4.863  -3.322   7.715
  680   2HG1  ILE  89          1HG1      ILE  89  -3.973  -2.480   6.431
  681   1HG2  ILE  89          1HG2      ILE  89  -4.548  -6.216   6.731
  682   2HG2  ILE  89          2HG2      ILE  89  -4.265  -5.652   8.389
  683   3HG2  ILE  89          3HG2      ILE  89  -3.013  -6.546   7.505
  684   1HD1  ILE  89          1HD1      ILE  89  -6.141  -3.007   5.591
  685   2HD1  ILE  89          2HD1      ILE  89  -4.921  -3.954   4.720
  686   3HD1  ILE  89          3HD1      ILE  89  -5.941  -4.727   5.951
  687    H    ILE  90           H        ILE  90  -1.243  -6.256   8.742
  688    HA   ILE  90           HA       ILE  90   1.245  -6.368   7.121
  689    HB   ILE  90           HB       ILE  90   1.022  -6.825  10.157
  690   1HG1  ILE  90          1HG1      ILE  90   2.626  -4.653  10.037
  691   2HG1  ILE  90          2HG1      ILE  90   1.618  -4.272   8.666
  692   1HG2  ILE  90          1HG2      ILE  90   3.462  -6.796  10.147
  693   2HG2  ILE  90          2HG2      ILE  90   3.485  -6.508   8.403
  694   3HG2  ILE  90          3HG2      ILE  90   2.881  -8.047   9.055
  695   1HD1  ILE  90          1HD1      ILE  90   0.832  -3.274  10.790
  696   2HD1  ILE  90          2HD1      ILE  90  -0.383  -4.444  10.256
  697   3HD1  ILE  90          3HD1      ILE  90   0.752  -4.871  11.547
  698    H    GLY  91           H        GLY  91   2.022  -8.441   6.852
  699   1HA   GLY  91          1HA       GLY  91   1.986 -10.754   6.835
  700   2HA   GLY  91          2HA       GLY  91   0.597 -10.770   7.934
  701    H    ALA  92           H        ALA  92   0.952 -12.389   5.545
  702    HA   ALA  92           HA       ALA  92  -0.678 -11.284   3.405
  703   1HB   ALA  92          1HB       ALA  92   0.390 -14.089   3.958
  704   2HB   ALA  92          2HB       ALA  92   1.083 -12.857   2.878
  705   3HB   ALA  92          3HB       ALA  92  -0.462 -13.601   2.479
  706    H    VAL  93           H        VAL  93  -2.419 -10.721   5.112
  707    HA   VAL  93           HA       VAL  93  -4.097 -12.974   5.913
  708    HB   VAL  93           HB       VAL  93  -5.642 -11.340   6.763
  709   1HG1  VAL  93          1HG2      VAL  93  -5.142  -8.897   6.671
  710   2HG1  VAL  93          2HG2      VAL  93  -5.591  -9.576   5.108
  711   3HG1  VAL  93          3HG2      VAL  93  -3.886  -9.208   5.457
  712   1HG2  VAL  93          1HG1      VAL  93  -4.220 -10.318   8.448
  713   2HG2  VAL  93          2HG1      VAL  93  -3.623 -11.946   8.083
  714   3HG2  VAL  93          3HG1      VAL  93  -2.782 -10.522   7.434
  715    HA   PRO  94           HA       PRO  94  -6.139 -13.495   2.037
  716   1HB   PRO  94          2HB       PRO  94  -8.718 -13.640   3.606
  717   2HB   PRO  94          1HB       PRO  94  -8.155 -14.729   2.307
  718   1HG   PRO  94          2HG       PRO  94  -7.906 -15.491   4.901
  719   2HG   PRO  94          1HG       PRO  94  -6.556 -15.756   3.758
  720   1HD   PRO  94          1HD       PRO  94  -6.830 -13.590   5.841
  721   2HD   PRO  94          2HD       PRO  94  -5.411 -14.550   5.351
  722    H    LYS  95           HN       LYS  95  -7.496 -12.505   0.485
  723    HA   LYS  95           HA       LYS  95  -7.654  -9.762   0.441
  724   1HB   LYS  95          1HB       LYS  95  -9.211  -9.994  -1.399
  725   2HB   LYS  95          2HB       LYS  95  -7.871 -11.145  -1.537
  726   1HG   LYS  95          1HG       LYS  95  -9.399 -12.964  -0.765
  727   2HG   LYS  95          2HG       LYS  95 -10.742 -11.810  -0.726
  728   1HD   LYS  95          2HD       LYS  95  -9.135 -12.611  -3.178
  729   2HD   LYS  95          1HD       LYS  95 -10.775 -13.114  -2.781
  730   1HE   LYS  95          2HE       LYS  95  -9.885 -10.271  -3.490
  731   2HE   LYS  95          1HE       LYS  95 -10.838 -11.373  -4.472
  732   1HZ   LYS  95          1HZ       LYS  95 -11.669 -10.233  -1.904
  733   2HZ   LYS  95          2HZ       LYS  95 -12.558 -11.281  -2.818
  734   3HZ   LYS  95          3HZ       LYS  95 -12.199  -9.779  -3.395
  735    H    ALA  96           H        ALA  96 -10.140 -11.999   1.390
  736    HA   ALA  96           HA       ALA  96 -12.337 -10.297   1.848
  737   1HB   ALA  96          1HB       ALA  96 -13.124 -12.001   3.464
  738   2HB   ALA  96          2HB       ALA  96 -11.510 -12.744   3.483
  739   3HB   ALA  96          3HB       ALA  96 -12.480 -12.755   1.993
  740    H    THR  97           H        THR  97  -9.700 -11.161   4.177
  741    HA   THR  97           HA       THR  97 -10.668  -9.496   6.285
  742    HB   THR  97           HB       THR  97  -7.796  -9.813   6.394
  743    HG1  THR  97           HG1      THR  97  -7.914 -11.423   4.889
  744   1HG2  THR  97          1HG2      THR  97  -8.340 -11.302   8.269
  745   2HG2  THR  97          2HG2      THR  97 -10.038 -11.367   7.752
  746   3HG2  THR  97          3HG2      THR  97  -9.336  -9.833   8.327
  747    H    ILE  98           H        ILE  98  -8.278  -9.041   3.627
  748    HA   ILE  98           HA       ILE  98  -7.406  -6.461   4.415
  749    HB   ILE  98           HB       ILE  98  -7.657  -7.604   1.593
  750   1HG1  ILE  98          1HG1      ILE  98  -5.321  -7.484   3.557
  751   2HG1  ILE  98          2HG1      ILE  98  -6.224  -8.927   3.077
  752   1HG2  ILE  98          1HG2      ILE  98  -6.042  -5.847   0.952
  753   2HG2  ILE  98          2HG2      ILE  98  -6.026  -5.229   2.616
  754   3HG2  ILE  98          3HG2      ILE  98  -7.478  -5.090   1.610
  755   1HD1  ILE  98          1HD1      ILE  98  -4.214  -8.970   1.870
  756   2HD1  ILE  98          2HD1      ILE  98  -5.491  -8.565   0.707
  757   3HD1  ILE  98          3HD1      ILE  98  -4.385  -7.303   1.308
  758    H    VAL  99           H        VAL  99 -10.075  -7.316   2.128
  759    HA   VAL  99           HA       VAL  99 -11.029  -4.753   1.576
  760    HB   VAL  99           HB       VAL  99 -12.452  -7.439   1.847
  761   1HG1  VAL  99          1HG1      VAL  99 -13.568  -4.784   0.875
  762   2HG1  VAL  99          2HG1      VAL  99 -14.308  -6.357   0.513
  763   3HG1  VAL  99          3HG1      VAL  99 -14.216  -5.797   2.184
  764   1HG2  VAL  99          1HG2      VAL  99 -11.702  -5.747  -0.576
  765   2HG2  VAL  99          2HG2      VAL  99 -10.792  -7.163  -0.014
  766   3HG2  VAL  99          3HG2      VAL  99 -12.445  -7.358  -0.608
  767    H    GLN 100           H        GLN 100 -12.208  -6.942   4.203
  768    HA   GLN 100           HA       GLN 100 -14.006  -5.093   5.362
  769   1HB   GLN 100          2HB       GLN 100 -12.371  -7.380   6.526
  770   2HB   GLN 100          1HB       GLN 100 -13.563  -6.481   7.482
  771   1HG   GLN 100          1HG       GLN 100 -15.366  -7.082   6.052
  772   2HG   GLN 100          2HG       GLN 100 -14.299  -7.760   4.817
  773   1HE2  GLN 100          1HE2      GLN 100 -12.947  -9.616   5.438
  774   2HE2  GLN 100          2HE2      GLN 100 -13.617 -10.801   6.572
  775    H    THR 101           H        THR 101 -10.547  -5.623   6.104
  776    HA   THR 101           HA       THR 101 -10.429  -3.686   8.209
  777    HB   THR 101           HB       THR 101  -8.189  -4.694   6.419
  778    HG1  THR 101           HG1      THR 101  -9.242  -6.421   7.343
  779   1HG2  THR 101          1HG2      THR 101  -6.830  -4.321   8.503
  780   2HG2  THR 101          2HG2      THR 101  -7.486  -2.815   7.826
  781   3HG2  THR 101          3HG2      THR 101  -8.237  -3.552   9.259
  782    H    VAL 102           H        VAL 102  -9.852  -3.422   4.674
  783    HA   VAL 102           HA       VAL 102  -8.913  -0.720   4.692
  784    HB   VAL 102           HB       VAL 102 -10.226  -2.481   2.583
  785   1HG1  VAL 102          1HG1      VAL 102  -7.435  -1.276   2.785
  786   2HG1  VAL 102          2HG1      VAL 102  -8.001  -2.478   1.604
  787   3HG1  VAL 102          3HG1      VAL 102  -7.826  -2.915   3.312
  788   1HG2  VAL 102          1HG2      VAL 102  -9.241   0.385   2.253
  789   2HG2  VAL 102          2HG2      VAL 102  -9.583  -0.736   0.918
  790   3HG2  VAL 102          3HG2      VAL 102 -10.894  -0.209   1.974
  791    H    GLU 103           HN       GLU 103 -12.178  -2.130   4.238
  792    HA   GLU 103           HA       GLU 103 -13.529   0.345   4.034
  793   1HB   GLU 103          2HB       GLU 103 -14.421  -2.388   5.068
  794   2HB   GLU 103          1HB       GLU 103 -15.520  -1.027   4.811
  795   1HG   GLU 103          1HG       GLU 103 -14.962  -0.911   2.445
  796   2HG   GLU 103          2HG       GLU 103 -13.766  -2.201   2.603
  797    H    LYS 104           HN       LYS 104 -12.938  -1.672   6.916
  798    HA   LYS 104           HA       LYS 104 -14.079  -0.085   8.918
  799   1HB   LYS 104          1HB       LYS 104 -13.119  -2.256   9.389
  800   2HB   LYS 104          2HB       LYS 104 -11.532  -1.721   8.851
  801   1HG   LYS 104          2HG       LYS 104 -11.607  -0.027  10.834
  802   2HG   LYS 104          1HG       LYS 104 -12.916  -1.035  11.442
  803   1HD   LYS 104          2HD       LYS 104 -10.075  -1.893  10.654
  804   2HD   LYS 104          1HD       LYS 104 -10.628  -1.628  12.305
  805   1HE   LYS 104          1HE       LYS 104 -11.619  -3.813  10.400
  806   2HE   LYS 104          2HE       LYS 104 -10.545  -4.031  11.785
  807   1HZ   LYS 104          1HZ       LYS 104 -13.330  -3.115  11.907
  808   2HZ   LYS 104          2HZ       LYS 104 -12.773  -4.607  12.326
  809   3HZ   LYS 104          3HZ       LYS 104 -12.324  -3.286  13.203
  810    H    TYR 105           H        TYR 105 -10.753   0.198   7.542
  811    HA   TYR 105           HA       TYR 105 -10.135   2.599   9.064
  812   1HB   TYR 105          2HB       TYR 105  -8.890   1.442   6.552
  813   2HB   TYR 105          1HB       TYR 105  -8.154   2.651   7.599
  814    HD1  TYR 105           HD1      TYR 105  -6.762   0.209   6.707
  815    HD2  TYR 105           HD2      TYR 105  -9.168   0.894  10.223
  816    HE1  TYR 105           HE1      TYR 105  -5.147  -1.056   8.066
  817    HE2  TYR 105           HE2      TYR 105  -7.666  -0.575  11.520
  818    HH   TYR 105           HH       TYR 105  -4.605  -1.850  10.183
  819    H    LEU 106           H        LEU 106 -11.781   2.049   5.985
  820    HA   LEU 106           HA       LEU 106 -11.751   4.932   5.366
  821   1HB   LEU 106          1HB       LEU 106  -9.665   3.545   4.567
  822   2HB   LEU 106          2HB       LEU 106 -10.737   2.805   3.414
  823    HG   LEU 106           HG       LEU 106  -9.348   4.546   2.538
  824   1HD1  LEU 106          1HD2      LEU 106 -10.865   6.609   4.187
  825   2HD1  LEU 106          2HD2      LEU 106  -9.239   5.996   4.569
  826   3HD1  LEU 106          3HD2      LEU 106  -9.527   6.889   3.066
  827   1HD2  LEU 106          1HD1      LEU 106 -12.270   5.437   2.445
  828   2HD2  LEU 106          2HD1      LEU 106 -11.563   4.124   1.476
  829   3HD2  LEU 106          3HD1      LEU 106 -11.020   5.793   1.241
  830    H    ASN 107           H        ASN 107 -14.077   4.728   5.795
  831    HA   ASN 107           HA       ASN 107 -15.601   4.291   3.461
  832   1HB   ASN 107          2HB       ASN 107 -15.354   1.909   4.482
  833   2HB   ASN 107          1HB       ASN 107 -16.322   2.509   5.833
  834   1HD2  ASN 107          2HD2      ASN 107 -18.228   4.076   4.338
  835   2HD2  ASN 107          1HD2      ASN 107 -19.166   2.949   3.342